data_2l74_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 2l74 _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.51 ' H ' ' CD1' ' A' ' 14' ' ' ILE . 1.8 mp . . . . . 0 CA--C 1.521 -0.161 0 CA-C-O 120.889 0.376 . . . . 0.0 110.093 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -95.02 120.16 34.76 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.338 0.59 . . . . 0.0 111.262 -179.675 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 5.1 p90 -150.25 158.92 44.68 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 177.668 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . 0.437 ' OD1' ' N ' ' A' ' 17' ' ' ASP . 0.1 OUTLIER -95.49 146.03 24.74 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 120.304 -0.558 . . . . 0.0 110.858 -179.028 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -178.49 176.56 1.02 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.783 179.148 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -96.54 133.63 40.76 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.023 -179.454 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.538 ' O ' ' O ' ' A' ' 31' ' ' VAL . 4.9 p -132.51 149.9 52.25 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.316 0.579 . . . . 0.0 110.201 178.378 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 12.5 mm-40 -131.0 138.97 49.92 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.435 -0.802 . . . . 0.0 108.838 179.708 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 1.1 mm -120.27 136.39 57.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-O 121.282 0.563 . . . . 0.0 110.704 -179.374 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.462 ' CD1' ' N ' ' A' ' 23' ' ' LEU . 0.0 OUTLIER -126.12 123.4 38.23 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.393 -0.821 . . . . 0.0 111.014 -179.133 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.539 ' OE1' ' CE2' ' A' ' 57' ' ' PHE . 22.1 tt0 -129.35 102.18 6.31 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.094 -0.957 . . . . 0.0 109.676 178.826 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 80.3 -127.33 7.88 Favored Glycine 0 CA--C 1.524 0.606 0 N-CA-C 109.94 -1.264 . . . . 0.0 109.94 -178.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -100.22 11.32 39.66 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.833 0.349 . . . . 0.0 110.179 179.586 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.555 ' HB3' ' CZ2' ' A' ' 29' ' ' TRP . 35.4 mtt180 -113.14 133.82 54.85 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 112.423 0.527 . . . . 0.0 112.423 -178.34 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.434 ' HG2' ' N ' ' A' ' 29' ' ' TRP . 17.2 ttt180 -128.35 149.22 50.61 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.582 179.786 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.555 ' CZ2' ' HB3' ' A' ' 27' ' ' ARG . 6.8 m-90 -146.7 155.79 42.68 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.505 -179.286 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . 0.539 ' OE1' ' N ' ' A' ' 30' ' ' GLU . 1.9 mp0 -100.56 135.44 42.0 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.774 179.459 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.538 ' O ' ' O ' ' A' ' 20' ' ' SER . 15.4 m -145.61 157.33 12.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-O 121.315 0.579 . . . . 0.0 111.026 -179.612 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.736 ' H ' ' CD2' ' A' ' 32' ' ' LEU . 1.5 pt? -96.86 130.57 44.12 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 178.759 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -91.97 125.0 36.5 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.278 0.561 . . . . 0.0 109.908 -179.512 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 69.6 m-70 -91.4 -28.54 17.61 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.307 -0.861 . . . . 0.0 111.662 -178.695 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 -172.66 161.07 4.76 Favored 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 119.484 -0.886 . . . . 0.0 111.08 177.577 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 4.6 p -145.56 169.08 7.3 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.243 -178.894 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 32.1 t -142.18 169.59 17.31 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 107.894 -1.15 . . . . 0.0 107.894 178.348 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 2.6 mt -66.36 -0.82 2.88 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 119.793 -0.763 . . . . 0.0 110.856 -179.461 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . 0.546 ' CE1' ' O ' ' A' ' 87' ' ' CYS . 36.3 t60 -159.72 40.17 0.2 Allowed 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 120.664 -0.415 . . . . 0.0 111.472 -179.908 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -179.83 157.74 20.82 Favored Glycine 0 CA--C 1.525 0.681 0 N-CA-C 111.021 -0.832 . . . . 0.0 111.021 179.803 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -148.47 148.83 15.67 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.259 0 CA-C-O 121.382 0.61 . . . . 0.0 111.628 -178.804 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -121.95 137.4 54.81 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 115.016 -0.993 . . . . 0.0 108.759 178.664 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 32.7 m -141.98 174.53 6.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-O 121.214 0.531 . . . . 0.0 111.534 -179.447 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -96.43 145.48 17.85 Favored Glycine 0 CA--C 1.528 0.882 0 N-CA-C 109.506 -1.438 . . . . 0.0 109.506 178.39 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . 0.463 ' O ' ' OE1' ' A' ' 45' ' ' GLN . 1.9 tm0? -86.86 115.19 61.62 Favored Pre-proline 0 N--CA 1.464 0.235 0 CA-C-N 117.88 0.84 . . . . 0.0 111.838 -178.492 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 97.4 Cg_endo -84.92 160.55 11.86 Favored 'Trans proline' 0 C--N 1.307 -1.613 0 C-N-CA 121.51 1.473 . . . . 0.0 111.22 178.715 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.601 ' H ' ' NE2' ' A' ' 47' ' ' GLN . 3.7 mp0 -65.33 -40.4 93.66 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 112.422 0.527 . . . . 0.0 112.422 -178.677 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . 0.549 ' O ' ' N ' ' A' ' 50' ' ' ASN . 46.8 t0 -73.09 8.37 1.65 Allowed 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 111.89 0.33 . . . . 0.0 111.89 -178.592 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' TRP . . . . . 0.444 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 60.6 t-105 -59.3 69.62 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 111.828 0.307 . . . . 0.0 111.828 -179.579 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . 0.549 ' N ' ' O ' ' A' ' 48' ' ' ASP . 0.5 OUTLIER -93.21 79.06 4.5 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 120.439 -0.505 . . . . 0.0 110.024 178.909 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -142.94 161.25 27.54 Favored Glycine 0 CA--C 1.526 0.765 0 N-CA-C 111.417 -0.673 . . . . 0.0 111.417 -179.44 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -95.44 109.94 48.08 Favored Pre-proline 0 CA--C 1.535 0.366 0 N-CA-C 110.512 -0.181 . . . . 0.0 110.512 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 78.7 Cg_exo -46.32 -22.98 1.8 Allowed 'Trans proline' 0 N--CA 1.498 1.769 0 C-N-CA 122.713 2.275 . . . . 0.0 112.813 -179.785 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 3.4 mm100 -79.86 -24.23 41.4 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 120.354 -0.539 . . . . 0.0 111.652 -178.718 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.578 ' O ' ' CE1' ' A' ' 57' ' ' PHE . 82.1 mtt180 -92.15 148.81 37.49 Favored Pre-proline 0 C--N 1.33 -0.246 0 C-N-CA 120.721 -0.391 . . . . 0.0 110.403 -179.978 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . 0.442 ' O ' ' OE1' ' A' ' 24' ' ' GLN . 29.8 Cg_endo -63.23 160.87 32.79 Favored 'Trans proline' 0 N--CA 1.497 1.724 0 C-N-CA 123.07 2.514 . . . . 0.0 113.436 -178.761 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . 0.578 ' CE1' ' O ' ' A' ' 55' ' ' ARG . 49.0 m-85 -131.12 157.3 43.49 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 114.971 -1.013 . . . . 0.0 109.161 179.419 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 64.8 mt-10 -122.21 138.46 54.47 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 178.245 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -118.98 137.08 53.76 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.316 0.487 . . . . 0.0 112.316 -178.116 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 9.4 mtm180 -123.11 127.73 49.13 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 108.379 -0.971 . . . . 0.0 108.379 177.237 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -109.88 144.16 38.75 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 120.638 -0.425 . . . . 0.0 110.736 -178.898 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' TYR . . . . . 0.431 ' CD1' ' N ' ' A' ' 62' ' ' TYR . 14.3 m-85 -125.47 109.47 12.75 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.694 179.862 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -106.17 -85.87 0.49 Allowed 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.39 -0.823 . . . . 0.0 109.488 179.579 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -74.65 176.06 48.89 Favored Glycine 0 CA--C 1.521 0.428 0 N-CA-C 109.168 -1.573 . . . . 0.0 109.168 178.46 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 2.0 mt -73.12 -33.18 65.39 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 119.667 -0.813 . . . . 0.0 110.011 -179.587 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 51.4 t0 -102.35 8.82 40.17 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.869 179.858 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 13.2 t -106.05 96.68 4.81 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.283 0 CA-C-O 121.364 0.602 . . . . 0.0 111.833 -178.832 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 7.9 tp -113.04 117.4 31.92 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 107.977 -1.12 . . . . 0.0 107.977 178.089 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 8.5 mt -111.64 142.54 23.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-O 120.909 0.385 . . . . 0.0 110.881 -178.541 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 26.3 ttp180 -128.49 130.64 47.8 Favored 'General case' 0 C--O 1.24 0.553 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.343 179.824 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' MET . . . . . 0.433 ' SD ' ' CD1' ' A' ' 90' ' ' ILE . 1.4 mtm -139.42 147.63 41.69 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.739 -0.664 . . . . 0.0 109.575 179.238 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 22.0 tt0 -104.75 124.5 49.52 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 107.529 -1.286 . . . . 0.0 107.529 178.273 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 2.7 pt -134.34 160.75 41.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 C-N-CA 119.673 -0.811 . . . . 0.0 113.0 -177.162 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 35.5 m -121.13 152.2 39.0 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.057 -0.974 . . . . 0.0 109.46 178.804 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.46 ' CD1' ' CZ ' ' A' ' 85' ' ' PHE . 10.2 tp -66.44 123.36 19.8 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.274 0.559 . . . . 0.0 109.97 -179.659 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -97.68 -41.7 7.98 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.854 178.373 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' TRP . . . . . 0.535 ' NE1' ' HA3' ' A' ' 84' ' ' GLY . 65.9 p-90 -171.22 165.04 7.3 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.556 -179.121 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -143.59 123.98 13.89 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 109.622 -0.511 . . . . 0.0 109.622 178.437 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 6.7 ttt180 -152.1 133.46 14.5 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 119.634 -0.826 . . . . 0.0 112.96 179.868 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 3.6 t70 57.01 47.03 18.32 Favored 'General case' 0 N--CA 1.462 0.139 0 N-CA-C 113.735 1.013 . . . . 0.0 113.735 176.804 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 82.56 -26.68 3.98 Favored Glycine 0 CA--C 1.523 0.532 0 C-N-CA 120.445 -0.883 . . . . 0.0 113.263 177.238 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 5.0 mt -89.66 159.21 17.24 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 117.631 0.715 . . . . 0.0 110.362 -179.11 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 44.0 mt -132.0 135.73 46.75 Favored 'General case' 0 CA--C 1.516 -0.356 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.344 -179.16 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . 0.535 ' HA3' ' NE1' ' A' ' 77' ' ' TRP . . . -102.58 154.0 18.39 Favored Glycine 0 N--CA 1.452 -0.278 0 N-CA-C 109.758 -1.337 . . . . 0.0 109.758 178.714 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' PHE . . . . . 0.46 ' CZ ' ' CD1' ' A' ' 75' ' ' LEU . 50.5 m-85 -145.36 136.55 24.89 Favored 'General case' 0 C--N 1.318 -0.763 0 C-N-CA 120.921 -0.312 . . . . 0.0 110.45 -179.66 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -104.01 128.96 51.6 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 179.53 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . 0.546 ' O ' ' CE1' ' A' ' 39' ' ' HIS . 42.9 t -69.38 120.45 15.2 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 112.378 0.51 . . . . 0.0 112.378 -178.237 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . 0.538 HE21 ' C ' ' A' ' 87' ' ' CYS . 5.0 mm-40 -94.58 -34.79 12.51 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.075 178.935 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . 0.449 ' ND1' ' C ' ' A' ' 89' ' ' HIS . 0.0 OUTLIER -161.41 141.89 10.9 Favored 'General case' 0 C--O 1.223 -0.338 0 CA-C-N 116.187 -0.46 . . . . 0.0 109.848 179.761 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . 0.433 ' CD1' ' SD ' ' A' ' 71' ' ' MET . 6.0 tt -145.04 140.9 23.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-O 121.332 0.587 . . . . 0.0 110.465 -178.833 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -56.9 142.86 39.78 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 115.153 -0.931 . . . . 0.0 112.297 -178.455 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 5.0 tp -54.28 -42.04 69.57 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 114.892 -1.049 . . . . 0.0 110.319 -179.343 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 26.3 t0 -68.3 -42.65 79.15 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.04 179.603 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 14.8 m -60.07 -38.39 82.7 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.062 179.5 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 50.8 mt -58.79 -38.46 72.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.317 179.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -70.97 -40.79 71.73 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.235 -0.586 . . . . 0.0 111.157 -179.204 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 60.0 m-70 . . . . . 0 C--N 1.325 -0.494 0 C-N-CA 119.177 -1.009 . . . . 0.0 108.704 179.87 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 12.2 mm . . . . . 0 C--O 1.232 0.18 0 N-CA-C 110.085 -0.339 . . . . 0.0 110.085 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -93.67 120.55 34.08 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.506 0.669 . . . . 0.0 111.714 -179.221 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 2.9 p90 -149.37 156.9 42.78 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 114.803 -1.09 . . . . 0.0 108.2 178.298 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -95.51 146.18 24.63 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 120.009 -0.676 . . . . 0.0 110.82 -179.106 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . 179.57 176.75 0.63 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.065 179.865 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -96.47 134.23 39.92 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.731 -179.659 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.508 ' O ' ' O ' ' A' ' 31' ' ' VAL . 6.5 p -134.06 151.89 51.6 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.16 0.505 . . . . 0.0 110.451 178.914 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 22.8 mm-40 -129.27 144.43 51.22 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.679 -0.691 . . . . 0.0 109.169 179.654 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . 0.411 HG22 HD11 ' A' ' 22' ' ' ILE . 75.4 mt -126.9 136.46 60.73 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.326 0 C-N-CA 120.352 -0.539 . . . . 0.0 110.869 -179.782 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -125.46 123.27 38.85 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.538 -0.756 . . . . 0.0 111.256 -178.893 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.548 ' OE1' ' CE2' ' A' ' 57' ' ' PHE . 23.8 tt0 -129.58 102.33 6.32 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.453 -0.794 . . . . 0.0 109.717 178.715 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 80.41 -126.23 7.31 Favored Glycine 0 CA--C 1.523 0.564 0 N-CA-C 109.789 -1.324 . . . . 0.0 109.789 -178.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -101.42 11.77 38.54 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.816 0.341 . . . . 0.0 110.277 179.58 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.536 ' HB3' ' CZ2' ' A' ' 29' ' ' TRP . 48.0 mtt180 -114.29 134.18 55.13 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 112.664 0.616 . . . . 0.0 112.664 -178.189 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 56.5 ttt180 -127.88 149.48 50.28 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.421 179.288 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.554 ' NE1' ' O ' ' A' ' 48' ' ' ASP . 7.2 m-90 -146.31 156.04 43.07 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.477 -179.568 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -100.7 135.23 42.47 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.585 179.22 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.508 ' O ' ' O ' ' A' ' 20' ' ' SER . 28.9 m -145.73 156.3 12.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 C-N-CA 120.652 -0.419 . . . . 0.0 110.83 -179.663 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -95.12 130.32 41.87 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 108.518 -0.919 . . . . 0.0 108.518 178.429 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.423 ' CB ' ' HG ' ' A' ' 20' ' ' SER . 1.5 tt -90.1 126.01 35.63 Favored 'General case' 0 C--N 1.325 -0.492 0 C-N-CA 120.203 -0.599 . . . . 0.0 110.179 -179.478 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 79.3 m-70 -90.29 -30.98 17.15 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.055 -0.975 . . . . 0.0 111.704 -178.811 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -173.67 162.31 4.08 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 119.632 -0.827 . . . . 0.0 111.434 178.303 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 4.1 p -144.75 168.77 9.21 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.112 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.117 -179.549 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' SER . . . . . 0.51 ' C ' ' H ' ' A' ' 39' ' ' HIS . 18.8 t -142.33 167.27 22.49 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 107.402 -1.333 . . . . 0.0 107.402 178.262 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 1.7 mp -62.42 1.4 0.35 Allowed 'General case' 0 C--N 1.322 -0.588 0 C-N-CA 119.412 -0.915 . . . . 0.0 110.635 -179.483 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . 0.51 ' H ' ' C ' ' A' ' 37' ' ' SER . 0.3 OUTLIER -168.34 44.89 0.04 OUTLIER 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 120.655 -0.418 . . . . 0.0 111.338 179.868 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -177.71 150.44 9.99 Favored Glycine 0 CA--C 1.527 0.782 0 N-CA-C 110.573 -1.011 . . . . 0.0 110.573 179.768 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -147.02 148.65 16.45 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.222 0 CA-C-O 121.317 0.579 . . . . 0.0 111.656 -179.082 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.1 tt -121.87 139.69 53.32 Favored 'General case' 0 N--CA 1.464 0.262 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 178.596 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 18.8 m -143.72 175.15 3.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 C-N-CA 120.129 -0.628 . . . . 0.0 112.058 -178.8 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -98.13 143.98 16.99 Favored Glycine 0 CA--C 1.528 0.853 0 N-CA-C 109.224 -1.55 . . . . 0.0 109.224 177.845 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . 0.499 ' CD ' ' O ' ' A' ' 45' ' ' GLN . 0.0 OUTLIER -86.25 120.16 72.11 Favored Pre-proline 0 CA--C 1.532 0.262 0 CA-C-N 118.075 0.938 . . . . 0.0 112.046 -178.224 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_endo -86.24 159.64 9.83 Favored 'Trans proline' 0 C--N 1.308 -1.564 0 C-N-CA 121.797 1.665 . . . . 0.0 110.906 178.278 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 65.7 mt-30 -65.38 -40.23 93.25 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.315 0.487 . . . . 0.0 112.315 -178.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . 0.554 ' O ' ' NE1' ' A' ' 29' ' ' TRP . 29.5 m-20 -73.59 8.4 1.87 Allowed 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 111.975 0.361 . . . . 0.0 111.975 -178.71 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' TRP . . . . . 0.445 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 58.9 t-105 -59.51 69.57 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 111.914 0.338 . . . . 0.0 111.914 -179.308 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . 0.551 ' N ' ' O ' ' A' ' 48' ' ' ASP . 0.2 OUTLIER -93.39 78.92 4.41 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 120.159 -0.616 . . . . 0.0 109.953 178.729 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -142.88 159.93 27.42 Favored Glycine 0 CA--C 1.524 0.632 0 N-CA-C 111.548 -0.621 . . . . 0.0 111.548 -179.647 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -94.2 111.25 52.65 Favored Pre-proline 0 CA--C 1.536 0.422 0 CA-C-N 115.543 -0.329 . . . . 0.0 110.744 -179.817 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_exo -47.99 -23.31 4.21 Favored 'Trans proline' 0 N--CA 1.497 1.721 0 C-N-CA 122.473 2.116 . . . . 0.0 112.366 179.762 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 1.7 mm100 -78.25 -24.01 47.07 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.782 -178.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.558 ' O ' ' CE1' ' A' ' 57' ' ' PHE . 44.3 mtp85 -94.54 148.9 35.72 Favored Pre-proline 0 C--N 1.331 -0.232 0 C-N-CA 120.598 -0.441 . . . . 0.0 110.138 179.94 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . 0.423 ' O ' ' OE1' ' A' ' 24' ' ' GLN . 31.1 Cg_endo -63.43 160.82 33.74 Favored 'Trans proline' 0 N--CA 1.494 1.527 0 C-N-CA 122.93 2.42 . . . . 0.0 113.337 -178.598 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . 0.558 ' CE1' ' O ' ' A' ' 55' ' ' ARG . 34.2 m-85 -130.5 158.42 39.99 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 114.8 -1.091 . . . . 0.0 108.922 179.346 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 69.3 mt-10 -121.39 135.34 55.08 Favored 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 108.644 -0.873 . . . . 0.0 108.644 178.175 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -118.02 138.15 52.41 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.281 0.562 . . . . 0.0 111.645 -177.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 47.6 mtm180 -124.71 128.11 48.29 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 178.024 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 10.2 mt -107.16 143.0 35.97 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 120.431 -0.508 . . . . 0.0 111.098 -178.522 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' TYR . . . . . 0.473 ' CD1' ' N ' ' A' ' 62' ' ' TYR . 7.7 m-85 -125.93 107.78 10.79 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.242 179.471 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.42 ' HB3' ' H ' ' A' ' 64' ' ' GLY . 1.9 tt -104.53 -85.37 0.47 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.441 -0.799 . . . . 0.0 109.436 179.688 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . 0.42 ' H ' ' HB3' ' A' ' 63' ' ' LEU . . . -74.23 178.09 44.79 Favored Glycine 0 CA--C 1.522 0.482 0 N-CA-C 109.139 -1.584 . . . . 0.0 109.139 178.403 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.518 ' CD1' ' N ' ' A' ' 65' ' ' LEU . 7.9 mp -74.63 -31.44 61.98 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 119.846 -0.742 . . . . 0.0 110.151 -179.777 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -103.84 9.5 36.86 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 123.054 0.542 . . . . 0.0 110.798 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 20.7 t -105.71 96.06 4.3 Favored 'Isoleucine or valine' 0 C--O 1.234 0.277 0 CA-C-O 121.206 0.527 . . . . 0.0 111.855 -178.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 3.8 tp -113.14 117.3 31.55 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 108.128 -1.064 . . . . 0.0 108.128 178.405 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . 0.451 HD12 HG23 ' A' ' 69' ' ' ILE . 17.7 mm -112.5 143.82 21.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 120.926 0.393 . . . . 0.0 111.049 -178.677 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . 0.451 ' C ' ' HG2' ' A' ' 71' ' ' MET . 59.2 mtp180 -127.64 130.31 48.74 Favored 'General case' 0 C--O 1.239 0.516 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.374 179.3 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' MET . . . . . 0.451 ' HG2' ' C ' ' A' ' 70' ' ' ARG . 0.1 OUTLIER -142.4 147.69 36.61 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.223 -0.898 . . . . 0.0 109.476 -179.576 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -102.05 128.89 48.31 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 108.017 -1.105 . . . . 0.0 108.017 178.587 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.478 HD13 ' CG ' ' A' ' 85' ' ' PHE . 25.9 pt -136.77 157.62 36.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 C-N-CA 119.836 -0.746 . . . . 0.0 112.836 -177.611 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 2.0 p -122.63 155.41 36.42 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 115.068 -0.969 . . . . 0.0 109.414 178.393 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.524 ' CD1' ' CZ ' ' A' ' 85' ' ' PHE . 7.1 tp -70.43 126.13 28.76 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.591 0.71 . . . . 0.0 110.782 -179.752 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -98.36 -43.66 6.84 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 114.515 -1.22 . . . . 0.0 111.138 178.103 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' TRP . . . . . 0.649 ' NE1' ' HA3' ' A' ' 84' ' ' GLY . 69.3 p-90 -167.71 172.4 9.28 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.425 -178.884 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -151.36 123.69 8.32 Favored 'General case' 0 N--CA 1.467 0.39 0 N-CA-C 110.032 -0.358 . . . . 0.0 110.032 178.373 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 61.4 ttt180 -152.58 133.54 14.11 Favored 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 112.91 0.708 . . . . 0.0 112.91 179.842 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 25.7 t0 56.71 47.22 18.66 Favored 'General case' 0 N--CA 1.464 0.229 0 N-CA-C 114.055 1.132 . . . . 0.0 114.055 176.154 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 83.98 -27.51 4.41 Favored Glycine 0 CA--C 1.522 0.529 0 C-N-CA 120.385 -0.912 . . . . 0.0 113.242 177.128 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 4.4 mt -89.52 161.26 16.31 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 117.664 0.732 . . . . 0.0 110.41 -178.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 42.3 mt -133.93 135.36 43.52 Favored 'General case' 0 CA--C 1.518 -0.272 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.242 -179.236 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . 0.649 ' HA3' ' NE1' ' A' ' 77' ' ' TRP . . . -94.84 152.36 20.47 Favored Glycine 0 N--CA 1.451 -0.331 0 N-CA-C 109.962 -1.255 . . . . 0.0 109.962 178.999 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' PHE . . . . . 0.524 ' CZ ' ' CD1' ' A' ' 75' ' ' LEU . 29.0 m-85 -145.47 133.77 21.75 Favored 'General case' 0 C--N 1.319 -0.754 0 C-N-CA 120.985 -0.286 . . . . 0.0 110.492 -179.602 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -103.8 127.93 51.25 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 108.555 -0.905 . . . . 0.0 108.555 179.242 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 2.3 t -67.69 119.89 13.16 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.925 0.393 . . . . 0.0 111.704 -178.595 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -89.33 -36.35 15.59 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.973 179.782 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . 0.485 ' ND1' ' C ' ' A' ' 89' ' ' HIS . 0.0 OUTLIER -166.43 147.8 6.45 Favored 'General case' 0 C--O 1.224 -0.237 0 CA-C-N 116.028 -0.533 . . . . 0.0 109.921 179.371 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . 0.409 ' CD1' ' SD ' ' A' ' 71' ' ' MET . 10.4 tt -145.27 141.1 22.7 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-O 121.418 0.628 . . . . 0.0 110.568 -178.984 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . 0.504 ' CB ' ' OG ' ' A' ' 94' ' ' SER . 0.0 OUTLIER -55.6 141.56 37.04 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 115.045 -0.98 . . . . 0.0 112.27 -178.077 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 5.2 tp -54.72 -42.33 71.42 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.192 -0.913 . . . . 0.0 110.294 -179.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -68.62 -42.9 77.43 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.264 -0.425 . . . . 0.0 109.93 179.625 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' SER . . . . . 0.504 ' OG ' ' CB ' ' A' ' 91' ' ' ASP . 1.5 p -60.24 -36.32 77.47 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.022 -0.536 . . . . 0.0 109.918 179.303 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 38.2 mt -60.35 -38.77 78.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.16 179.894 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -70.44 -37.53 74.39 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 120.342 -0.543 . . . . 0.0 110.852 -178.856 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 67.2 m-70 . . . . . 0 C--N 1.323 -0.548 0 C-N-CA 119.666 -0.814 . . . . 0.0 109.385 179.668 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 41.1 mm . . . . . 0 CA--C 1.52 -0.204 0 CA-C-O 120.654 0.264 . . . . 0.0 110.386 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -91.82 120.22 32.33 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.416 0.627 . . . . 0.0 110.99 179.907 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 3.1 p90 -149.8 158.65 44.37 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.034 -0.984 . . . . 0.0 108.423 178.18 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 3.1 p30 -95.34 144.67 25.7 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 120.184 -0.606 . . . . 0.0 110.051 -179.62 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -177.49 175.7 1.39 Allowed 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 179.697 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -96.37 134.24 39.77 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.704 -179.716 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.542 ' O ' ' O ' ' A' ' 31' ' ' VAL . 10.7 p -134.04 152.7 51.95 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.109 0.481 . . . . 0.0 110.293 178.851 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 12.0 mm-40 -129.5 141.53 50.98 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 179.625 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -122.21 135.72 61.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 C-N-CA 120.096 -0.642 . . . . 0.0 110.371 179.771 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -126.12 123.15 37.66 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.32 -0.854 . . . . 0.0 110.934 -179.133 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.582 ' OE1' ' CE2' ' A' ' 57' ' ' PHE . 22.2 tt0 -128.79 101.82 6.28 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.245 -0.889 . . . . 0.0 109.678 178.849 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 80.11 -126.77 7.59 Favored Glycine 0 CA--C 1.523 0.55 0 N-CA-C 110.138 -1.185 . . . . 0.0 110.138 -178.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -99.65 11.31 39.53 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.844 0.354 . . . . 0.0 110.325 179.57 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.527 ' HB3' ' CZ2' ' A' ' 29' ' ' TRP . 67.7 mtt180 -113.24 134.97 54.32 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 112.422 0.527 . . . . 0.0 112.422 -178.369 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 28.0 ttt180 -129.29 150.62 50.58 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.51 179.65 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.527 ' CZ2' ' HB3' ' A' ' 27' ' ' ARG . 7.0 m-90 -149.0 156.5 42.35 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.675 -178.919 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 14.7 mt-10 -100.28 134.59 42.99 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.003 179.292 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.542 ' O ' ' O ' ' A' ' 20' ' ' SER . 16.8 m -145.9 158.03 12.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 121.104 0.478 . . . . 0.0 111.306 -179.628 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.716 ' H ' ' CD2' ' A' ' 32' ' ' LEU . 1.4 pt? -97.0 130.21 44.36 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 178.505 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.4 tt -93.29 126.63 38.5 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.27 0.557 . . . . 0.0 109.731 -179.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 45.8 m-70 -92.31 -26.09 18.27 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.397 -0.819 . . . . 0.0 111.923 -178.36 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -174.24 159.45 3.15 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 119.528 -0.869 . . . . 0.0 111.12 177.652 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 6.7 p -142.82 168.89 13.14 Favored 'Isoleucine or valine' 0 C--O 1.231 0.099 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.84 -179.178 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 22.9 t -142.36 169.15 18.12 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 107.889 -1.152 . . . . 0.0 107.889 178.926 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 91.4 mt -66.23 -1.25 3.12 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 119.642 -0.823 . . . . 0.0 110.941 -179.438 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . 0.513 ' NE2' ' O ' ' A' ' 87' ' ' CYS . 3.7 t60 -161.32 38.98 0.14 Allowed 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 120.839 -0.344 . . . . 0.0 111.179 -179.847 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -175.77 154.67 17.98 Favored Glycine 0 CA--C 1.527 0.825 0 N-CA-C 110.929 -0.868 . . . . 0.0 110.929 179.88 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.435 HG22 HD11 ' A' ' 41' ' ' ILE . 0.1 OUTLIER -148.04 148.87 15.82 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.345 0 CA-C-O 121.389 0.614 . . . . 0.0 111.809 -178.87 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.8 tt -122.22 140.85 52.11 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 115.088 -0.96 . . . . 0.0 109.1 178.836 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 20.8 m -145.42 174.84 2.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-O 121.12 0.486 . . . . 0.0 111.633 -179.568 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -97.9 145.77 17.93 Favored Glycine 0 CA--C 1.529 0.913 0 N-CA-C 109.961 -1.256 . . . . 0.0 109.961 178.86 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 1.6 tm0? -87.64 113.76 55.85 Favored Pre-proline 0 N--CA 1.463 0.184 0 CA-C-N 117.923 0.862 . . . . 0.0 111.841 -178.574 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 77.2 Cg_endo -85.26 163.37 11.32 Favored 'Trans proline' 0 C--N 1.305 -1.752 0 C-N-CA 121.625 1.55 . . . . 0.0 111.289 178.899 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -65.39 -40.52 93.56 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 116.519 -0.309 . . . . 0.0 111.815 -179.054 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . 0.53 ' O ' ' N ' ' A' ' 50' ' ' ASN . 86.0 m-20 -71.28 8.63 0.96 Allowed 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 111.926 0.343 . . . . 0.0 111.926 -178.819 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' TRP . . . . . 0.46 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 61.8 t-105 -61.56 67.4 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 111.856 0.317 . . . . 0.0 111.856 -179.576 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . 0.533 ' ND2' ' C ' ' A' ' 50' ' ' ASN . 0.7 OUTLIER -93.1 78.71 4.57 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 178.569 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -142.7 159.34 27.28 Favored Glycine 0 CA--C 1.523 0.583 0 N-CA-C 111.239 -0.745 . . . . 0.0 111.239 -179.581 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 14.3 t0 -92.91 121.57 65.58 Favored Pre-proline 0 CA--C 1.534 0.362 0 N-CA-C 110.321 -0.251 . . . . 0.0 110.321 179.886 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -61.29 -22.38 74.44 Favored 'Trans proline' 0 N--CA 1.495 1.587 0 C-N-CA 122.477 2.118 . . . . 0.0 112.075 -179.513 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 18.7 mt-30 -77.45 -20.08 55.04 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.12 -179.492 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.471 ' O ' ' CE1' ' A' ' 57' ' ' PHE . 1.3 mtt85 -97.85 157.32 34.82 Favored Pre-proline 0 CA--C 1.531 0.215 0 CA-C-O 120.745 0.307 . . . . 0.0 110.23 179.926 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . 0.443 ' O ' ' OE1' ' A' ' 24' ' ' GLN . 55.7 Cg_endo -70.22 161.0 47.62 Favored 'Trans proline' 0 N--CA 1.495 1.606 0 C-N-CA 122.913 2.409 . . . . 0.0 113.298 -178.766 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . 0.582 ' CE2' ' OE1' ' A' ' 24' ' ' GLN . 53.3 m-85 -131.16 155.63 46.7 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.053 -0.976 . . . . 0.0 109.142 179.605 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -121.34 137.74 54.56 Favored 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 178.517 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -119.74 137.82 53.7 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.143 0.497 . . . . 0.0 111.963 -178.201 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . 0.567 ' HE ' ' CD1' ' A' ' 68' ' ' LEU . 7.0 mmm-85 -123.43 127.56 48.6 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 108.404 -0.961 . . . . 0.0 108.404 177.612 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 12.4 mt -107.18 149.08 28.09 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.906 0.384 . . . . 0.0 110.836 -178.965 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 10.3 m-85 -134.14 111.8 10.61 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.711 -179.735 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.42 ' C ' ' CD2' ' A' ' 63' ' ' LEU . 2.9 tt -105.94 -83.35 0.52 Allowed 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 115.812 -0.631 . . . . 0.0 109.5 179.444 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . 0.404 ' H ' ' HB ' ' A' ' 67' ' ' VAL . . . -76.81 -177.12 44.42 Favored Glycine 0 CA--C 1.521 0.436 0 N-CA-C 109.326 -1.509 . . . . 0.0 109.326 178.699 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.452 ' CD1' ' N ' ' A' ' 65' ' ' LEU . 7.3 mp -75.45 -33.2 60.86 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 119.988 -0.685 . . . . 0.0 110.477 -179.612 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -102.63 8.96 39.59 Favored 'General case' 0 C--N 1.332 -0.168 0 C-N-CA 122.67 0.388 . . . . 0.0 111.323 -179.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . 0.404 ' HB ' ' H ' ' A' ' 64' ' ' GLY . 9.5 t -101.49 93.56 2.89 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.245 0 CA-C-O 121.197 0.523 . . . . 0.0 111.694 -178.864 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.567 ' CD1' ' HE ' ' A' ' 60' ' ' ARG . 1.9 tp -111.69 117.81 33.9 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 108.446 -0.946 . . . . 0.0 108.446 178.62 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 3.6 mt -115.28 144.78 22.09 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.247 0 CA-C-O 120.945 0.402 . . . . 0.0 111.155 -178.815 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -128.46 134.42 48.73 Favored 'General case' 0 C--O 1.238 0.492 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.251 179.417 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -143.75 148.15 35.22 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.439 -0.8 . . . . 0.0 109.557 179.472 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -110.82 121.49 45.47 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 107.975 -1.12 . . . . 0.0 107.975 178.509 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 4.2 pt -132.19 165.41 32.12 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 N-CA-C 113.627 0.973 . . . . 0.0 113.627 -176.621 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 3.3 p -120.09 148.96 42.96 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 114.926 -1.033 . . . . 0.0 109.642 178.71 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.439 ' CD1' ' CZ ' ' A' ' 85' ' ' PHE . 14.2 tp -66.1 124.4 22.48 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-O 121.239 0.542 . . . . 0.0 110.542 -179.002 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -98.58 -44.89 6.28 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 115.307 -0.861 . . . . 0.0 111.429 178.205 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' TRP . . . . . 0.568 ' NE1' ' HA3' ' A' ' 84' ' ' GLY . 69.2 p-90 -164.91 172.34 12.96 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.808 -179.091 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -151.3 123.78 8.4 Favored 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 178.117 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . 0.547 ' O ' ' OD1' ' A' ' 80' ' ' ASP . 5.2 ttm180 -152.2 131.81 13.1 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 119.916 -0.713 . . . . 0.0 112.617 179.891 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . 0.563 ' OD2' ' O ' ' A' ' 80' ' ' ASP . 0.6 OUTLIER 53.61 46.76 25.36 Favored 'General case' 0 N--CA 1.467 0.418 0 N-CA-C 113.699 0.999 . . . . 0.0 113.699 177.117 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 72.32 12.15 76.38 Favored Glycine 0 CA--C 1.521 0.461 0 C-N-CA 120.433 -0.889 . . . . 0.0 111.856 178.114 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 52.4 mt -116.24 140.27 49.49 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 178.734 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 35.2 mt -128.17 135.72 50.13 Favored 'General case' 0 CA--C 1.512 -0.501 0 C-N-CA 120.715 -0.394 . . . . 0.0 111.339 -178.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . 0.568 ' HA3' ' NE1' ' A' ' 77' ' ' TRP . . . -110.66 156.67 15.43 Favored Glycine 0 N--CA 1.448 -0.558 0 N-CA-C 109.317 -1.513 . . . . 0.0 109.317 178.301 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' PHE . . . . . 0.439 ' CZ ' ' CD1' ' A' ' 75' ' ' LEU . 78.4 m-85 -145.37 143.94 30.4 Favored 'General case' 0 C--N 1.312 -1.028 0 N-CA-C 110.001 -0.37 . . . . 0.0 110.001 -179.53 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 52.4 tt0 -103.64 130.16 51.06 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 179.355 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . 0.513 ' O ' ' NE2' ' A' ' 39' ' ' HIS . 4.6 t -69.26 118.67 12.44 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.492 0.553 . . . . 0.0 112.492 -177.926 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 58.7 mm-40 -92.43 -36.76 12.93 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.77 178.876 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . 0.449 ' ND1' ' C ' ' A' ' 89' ' ' HIS . 0.0 OUTLIER -164.0 143.79 8.06 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.966 179.955 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . 0.604 ' CD1' ' HG ' ' A' ' 94' ' ' SER . 9.0 tt -145.61 141.3 22.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-O 121.254 0.55 . . . . 0.0 109.994 -179.592 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -58.5 141.04 53.03 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 115.272 -0.876 . . . . 0.0 112.434 -178.029 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 6.3 tp -54.15 -41.73 68.77 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 114.853 -1.067 . . . . 0.0 110.725 -179.491 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . 0.524 ' OD1' ' N ' ' A' ' 94' ' ' SER . 2.8 p30 -68.5 -37.18 79.86 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 179.469 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' SER . . . . . 0.604 ' HG ' ' CD1' ' A' ' 90' ' ' ILE . 1.6 t -67.2 -38.45 85.36 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.08 179.337 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 56.4 mt -58.65 -37.81 67.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.324 179.886 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -70.24 -40.66 74.32 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.158 -0.617 . . . . 0.0 111.195 -178.489 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 61.2 m-70 . . . . . 0 C--N 1.326 -0.434 0 C-N-CA 119.359 -0.936 . . . . 0.0 109.207 179.767 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.552 ' CD1' ' N ' ' A' ' 14' ' ' ILE . 1.8 mp . . . . . 0 CA--C 1.521 -0.171 0 N-CA-C 109.863 -0.421 . . . . 0.0 109.863 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -95.19 120.5 35.53 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.506 0.669 . . . . 0.0 111.623 -179.363 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -149.73 155.57 40.39 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 114.791 -1.095 . . . . 0.0 108.363 178.022 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -95.44 146.81 24.13 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 120.159 -0.616 . . . . 0.0 110.863 -178.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . 0.405 ' O ' ' CD1' ' A' ' 32' ' ' LEU . . . -179.79 176.99 0.72 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.9 -0.591 . . . . 0.0 109.926 179.598 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -96.12 133.88 39.86 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.79 -179.855 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.583 ' O ' ' O ' ' A' ' 31' ' ' VAL . 13.0 t -133.8 152.86 52.0 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.186 0.517 . . . . 0.0 110.215 178.692 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.538 ' OE1' ' NH2' ' A' ' 28' ' ' ARG . 97.0 mt-10 -129.09 155.67 45.09 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 109.136 -0.691 . . . . 0.0 109.136 179.291 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . 0.463 ' HA ' ' O ' ' A' ' 58' ' ' GLU . 34.2 mt -138.47 136.36 43.94 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.437 0 C-N-CA 120.005 -0.678 . . . . 0.0 111.263 -179.603 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.561 ' CD1' ' HE ' ' A' ' 60' ' ' ARG . 0.0 OUTLIER -125.29 127.79 47.23 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.419 -0.809 . . . . 0.0 111.261 -178.793 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.469 ' O ' ' OE1' ' A' ' 24' ' ' GLN . 1.6 tm0? -132.49 101.95 5.53 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.082 -0.963 . . . . 0.0 109.532 178.519 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 80.71 -126.51 7.43 Favored Glycine 0 CA--C 1.523 0.554 0 N-CA-C 110.111 -1.195 . . . . 0.0 110.111 -178.729 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.613 ' OE1' ' N ' ' A' ' 26' ' ' GLU . 6.0 pm0 -100.68 13.21 35.58 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 110.084 -0.339 . . . . 0.0 110.084 179.583 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.529 ' HB3' ' CZ2' ' A' ' 29' ' ' TRP . 33.5 mtt180 -114.54 135.83 53.69 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 112.755 0.65 . . . . 0.0 112.755 -178.312 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.538 ' NH2' ' OE1' ' A' ' 21' ' ' GLU . 26.7 ttt180 -128.74 148.7 50.87 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.174 179.206 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.529 ' CZ2' ' HB3' ' A' ' 27' ' ' ARG . 6.7 m-90 -147.2 156.13 42.7 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.655 -179.144 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 18.8 mt-10 -100.34 138.54 37.27 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 178.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.583 ' O ' ' O ' ' A' ' 20' ' ' SER . 12.0 m -148.06 157.96 8.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-O 121.223 0.535 . . . . 0.0 111.274 -179.454 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.405 ' CD1' ' O ' ' A' ' 18' ' ' ALA . 8.3 tp -98.31 130.03 45.0 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 108.301 -1.0 . . . . 0.0 108.301 178.816 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.4 ' N ' HD11 ' A' ' 32' ' ' LEU . 0.8 OUTLIER -92.12 125.96 37.01 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 120.334 -0.547 . . . . 0.0 109.881 179.895 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 73.3 m-70 -90.48 -28.74 18.36 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.418 -0.81 . . . . 0.0 111.742 -178.706 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -171.98 162.23 5.88 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 119.493 -0.883 . . . . 0.0 111.283 177.568 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 4.8 p -146.04 168.88 6.64 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.11 0 CA-C-N 115.782 -0.645 . . . . 0.0 111.193 -178.798 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' SER . . . . . 0.422 ' C ' ' H ' ' A' ' 39' ' ' HIS . 23.0 t -142.11 168.46 19.69 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 107.632 -1.247 . . . . 0.0 107.632 178.513 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 3.6 tp -64.41 -0.6 1.36 Allowed 'General case' 0 C--N 1.322 -0.588 0 C-N-CA 119.555 -0.858 . . . . 0.0 110.795 -179.277 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . 0.422 ' H ' ' C ' ' A' ' 37' ' ' SER . 2.0 p80 -162.25 43.16 0.13 Allowed 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 120.693 -0.403 . . . . 0.0 111.41 179.747 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 179.83 156.58 18.18 Favored Glycine 0 CA--C 1.528 0.898 0 N-CA-C 111.039 -0.824 . . . . 0.0 111.039 179.765 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -148.57 148.76 15.69 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.355 0 CA-C-O 121.453 0.644 . . . . 0.0 111.664 -178.745 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -121.83 132.29 54.51 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 115.069 -0.969 . . . . 0.0 108.53 178.79 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 31.7 m -136.62 174.84 11.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 121.316 0.579 . . . . 0.0 112.078 -179.172 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -98.57 144.56 17.3 Favored Glycine 0 CA--C 1.526 0.725 0 N-CA-C 109.263 -1.535 . . . . 0.0 109.263 178.109 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . 0.516 ' CD ' ' O ' ' A' ' 45' ' ' GLN . 0.0 OUTLIER -87.16 117.73 69.01 Favored Pre-proline 0 CA--C 1.534 0.33 0 CA-C-N 118.052 0.926 . . . . 0.0 111.862 -178.284 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 74.6 Cg_endo -85.85 160.16 10.43 Favored 'Trans proline' 0 C--N 1.306 -1.673 0 C-N-CA 121.772 1.648 . . . . 0.0 111.576 178.89 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 24.0 mm-40 -65.2 -25.33 67.66 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 112.291 0.478 . . . . 0.0 112.291 -178.888 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . 0.532 ' O ' ' N ' ' A' ' 50' ' ' ASN . 3.3 m-20 -86.68 8.82 20.84 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 111.661 0.245 . . . . 0.0 111.661 -178.897 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' TRP . . . . . 0.463 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 59.3 t-105 -60.56 66.9 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 112.265 0.468 . . . . 0.0 112.265 -179.421 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . 0.557 ' C ' HD21 ' A' ' 50' ' ' ASN . 0.2 OUTLIER -93.16 78.66 4.54 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 120.047 -0.661 . . . . 0.0 109.246 178.105 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -145.65 146.25 16.24 Favored Glycine 0 CA--C 1.523 0.54 0 N-CA-C 111.601 -0.6 . . . . 0.0 111.601 -179.07 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -77.75 121.97 84.99 Favored Pre-proline 0 C--N 1.328 -0.365 0 CA-C-N 115.427 -0.386 . . . . 0.0 110.714 -179.969 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 21.5 Cg_endo -62.12 -22.41 74.16 Favored 'Trans proline' 0 N--CA 1.496 1.634 0 C-N-CA 122.61 2.207 . . . . 0.0 112.113 -179.757 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 15.8 mt-30 -77.19 -24.19 51.41 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 120.477 -0.489 . . . . 0.0 111.429 -179.2 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.535 ' O ' ' CE1' ' A' ' 57' ' ' PHE . 17.1 mtp85 -92.88 155.42 41.56 Favored Pre-proline 0 C--N 1.331 -0.223 0 C-N-CA 120.836 -0.345 . . . . 0.0 110.383 -179.955 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_endo -68.0 161.16 45.42 Favored 'Trans proline' 0 N--CA 1.497 1.694 0 C-N-CA 123.059 2.506 . . . . 0.0 113.03 -179.057 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . 0.535 ' CE1' ' O ' ' A' ' 55' ' ' ARG . 43.5 m-85 -131.09 157.31 43.42 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.35 -0.841 . . . . 0.0 109.415 179.595 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.463 ' O ' ' HA ' ' A' ' 22' ' ' ILE . 42.0 mt-10 -123.13 139.23 54.28 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 109.095 -0.706 . . . . 0.0 109.095 178.319 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -124.92 142.08 51.7 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 112.817 0.673 . . . . 0.0 112.817 -177.531 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . 0.561 ' HE ' ' CD1' ' A' ' 23' ' ' LEU . 0.0 OUTLIER -124.95 128.08 48.05 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.115 -0.948 . . . . 0.0 109.288 177.215 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 7.4 mt -108.59 129.38 55.32 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 120.569 -0.452 . . . . 0.0 110.431 -179.658 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' TYR . . . . . 0.43 ' CD1' ' N ' ' A' ' 62' ' ' TYR . 19.9 m-85 -110.67 109.66 20.02 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.002 0.429 . . . . 0.0 110.742 -179.957 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.408 ' HB3' ' H ' ' A' ' 64' ' ' GLY . 3.5 tt -104.19 -85.03 0.47 Allowed 'General case' 0 C--N 1.333 -0.116 0 CA-C-N 115.76 -0.655 . . . . 0.0 109.545 179.476 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . 0.414 ' H ' ' HB ' ' A' ' 67' ' ' VAL . . . -76.3 176.89 51.49 Favored Glycine 0 CA--C 1.523 0.585 0 N-CA-C 109.337 -1.505 . . . . 0.0 109.337 178.7 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.449 ' CD1' ' C ' ' A' ' 65' ' ' LEU . 3.0 tm? -71.93 -37.31 70.05 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 120.031 -0.668 . . . . 0.0 109.604 -179.636 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . 0.427 ' OD1' ' O ' ' A' ' 66' ' ' ASP . 55.6 t0 -98.52 9.2 43.72 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.105 179.49 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . 0.414 ' HB ' ' H ' ' A' ' 64' ' ' GLY . 8.7 t -106.06 96.15 4.37 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.305 0 CA-C-O 121.405 0.621 . . . . 0.0 111.741 -178.875 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 7.8 tp -113.24 117.55 32.18 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 108.102 -1.073 . . . . 0.0 108.102 178.221 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . 0.437 ' CG2' ' OG ' ' A' ' 94' ' ' SER . 3.6 mt -112.64 144.76 19.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 120.798 0.333 . . . . 0.0 110.948 -178.974 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . 0.409 ' N ' HG22 ' A' ' 69' ' ' ILE . 9.8 ptt180 -128.16 130.98 48.92 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.835 179.214 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 2.0 mtp -140.18 148.14 41.16 Favored 'General case' 0 C--O 1.227 -0.117 0 CA-C-N 115.719 -0.673 . . . . 0.0 109.902 179.836 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -103.78 126.54 50.98 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 107.627 -1.249 . . . . 0.0 107.627 178.143 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.406 HD12 HG22 ' A' ' 73' ' ' ILE . 11.2 pt -134.83 157.68 41.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 N-CA-C 112.953 0.723 . . . . 0.0 112.953 -177.44 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -122.52 154.69 37.53 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.023 -0.99 . . . . 0.0 109.623 178.723 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.523 ' CD1' ' CZ ' ' A' ' 85' ' ' PHE . 5.2 tp -66.47 120.74 13.9 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.226 0.536 . . . . 0.0 110.558 -179.828 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -97.69 -41.75 7.96 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.422 177.927 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' TRP . . . . . 0.569 ' NE1' ' HA3' ' A' ' 84' ' ' GLY . 67.6 p-90 -170.45 168.52 7.81 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 115.485 -0.78 . . . . 0.0 109.898 -179.647 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -148.15 123.89 10.53 Favored 'General case' 0 N--CA 1.464 0.27 0 N-CA-C 109.932 -0.395 . . . . 0.0 109.932 178.795 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 38.4 ttt85 -152.37 133.68 14.41 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 113.215 0.82 . . . . 0.0 113.215 179.863 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 13.3 t70 56.92 47.15 18.3 Favored 'General case' 0 N--CA 1.464 0.246 0 N-CA-C 114.227 1.195 . . . . 0.0 114.227 176.405 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 83.77 -28.08 4.12 Favored Glycine 0 CA--C 1.524 0.656 0 C-N-CA 120.314 -0.946 . . . . 0.0 113.153 177.114 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 3.5 mt -89.69 157.89 17.8 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 117.637 0.719 . . . . 0.0 110.206 -179.283 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 36.5 mt -129.62 135.34 48.42 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.308 -179.078 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . 0.569 ' HA3' ' NE1' ' A' ' 77' ' ' TRP . . . -96.29 152.4 20.21 Favored Glycine 0 N--CA 1.451 -0.347 0 N-CA-C 109.894 -1.283 . . . . 0.0 109.894 178.935 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' PHE . . . . . 0.523 ' CZ ' ' CD1' ' A' ' 75' ' ' LEU . 23.8 m-85 -145.67 132.75 20.36 Favored 'General case' 0 C--N 1.318 -0.772 0 C-N-CA 120.79 -0.364 . . . . 0.0 110.892 -179.2 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.501 ' O ' ' NE2' ' A' ' 88' ' ' GLN . 42.3 tt0 -103.92 126.32 50.95 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 178.994 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . 0.408 ' C ' HE21 ' A' ' 88' ' ' GLN . 5.6 t -68.72 122.12 17.89 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.015 0.436 . . . . 0.0 112.007 -178.408 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . 0.501 ' NE2' ' O ' ' A' ' 86' ' ' GLU . 20.1 mm-40 -95.14 -34.05 12.42 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.078 179.348 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . 0.442 ' ND1' ' C ' ' A' ' 89' ' ' HIS . 0.0 OUTLIER -161.5 141.69 10.65 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.031 179.66 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . 0.46 HD12 HG22 ' A' ' 90' ' ' ILE . 7.1 tt -143.36 139.33 26.52 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-O 121.169 0.509 . . . . 0.0 109.988 -179.045 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -57.21 142.69 42.0 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 115.508 -0.769 . . . . 0.0 112.057 -178.312 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 3.3 tp -54.1 -42.05 68.98 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.222 -0.899 . . . . 0.0 110.457 -179.337 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . 0.522 ' OD1' ' N ' ' A' ' 94' ' ' SER . 1.4 p30 -67.07 -39.07 86.79 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 179.273 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' SER . . . . . 0.522 ' N ' ' OD1' ' A' ' 93' ' ' ASP . 6.7 t -66.24 -37.0 84.47 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.573 -0.74 . . . . 0.0 110.185 179.268 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 38.5 mt -58.61 -38.3 70.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.137 179.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -70.88 -41.54 71.23 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.354 -0.538 . . . . 0.0 111.203 -179.003 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 60.7 m-70 . . . . . 0 C--N 1.325 -0.465 0 C-N-CA 119.408 -0.917 . . . . 0.0 109.303 179.791 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 2.4 mp . . . . . 0 CA--C 1.522 -0.134 0 CA-C-O 120.92 0.39 . . . . 0.0 111.043 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -95.14 120.21 34.96 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.635 179.145 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 2.2 p90 -150.11 157.82 43.52 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 108.503 -0.925 . . . . 0.0 108.503 178.02 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -95.77 143.37 27.07 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 120.139 -0.624 . . . . 0.0 110.77 -179.372 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -176.48 175.23 1.79 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.665 179.091 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -96.33 134.03 39.96 Favored 'General case' 0 C--N 1.326 -0.45 0 C-N-CA 120.647 -0.421 . . . . 0.0 111.141 -179.598 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.495 ' O ' ' O ' ' A' ' 31' ' ' VAL . 11.0 p -133.52 152.39 51.9 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.019 178.588 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.423 ' CG ' HH21 ' A' ' 28' ' ' ARG . 6.1 mm-40 -131.31 136.74 48.38 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 179.814 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 1.1 mm -117.45 135.37 58.08 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.552 0 C-N-CA 120.197 -0.601 . . . . 0.0 110.338 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -130.56 122.78 28.16 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.78 -179.321 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.535 ' OE1' ' CZ ' ' A' ' 57' ' ' PHE . 24.2 tt0 -124.64 101.78 7.28 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 114.735 -1.12 . . . . 0.0 109.823 179.097 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 82.14 -124.53 6.52 Favored Glycine 0 CA--C 1.523 0.557 0 N-CA-C 110.055 -1.218 . . . . 0.0 110.055 -178.952 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -100.53 10.64 40.91 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.776 0.322 . . . . 0.0 110.197 179.555 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.498 ' HB3' ' CZ2' ' A' ' 29' ' ' TRP . 17.5 mtt180 -112.58 133.57 54.56 Favored 'General case' 0 C--N 1.332 -0.158 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 -178.502 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.423 HH21 ' CG ' ' A' ' 21' ' ' GLU . 49.2 ttt180 -128.47 152.88 47.73 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.388 179.212 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.518 ' NE1' ' O ' ' A' ' 48' ' ' ASP . 6.6 m-90 -151.02 156.9 42.08 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.709 -178.691 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . 0.477 ' CD ' ' H ' ' A' ' 30' ' ' GLU . 2.3 mp0 -99.94 136.18 40.24 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 179.159 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.495 ' O ' ' O ' ' A' ' 20' ' ' SER . 30.7 m -145.36 156.65 13.35 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-O 121.049 0.452 . . . . 0.0 111.001 -179.451 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 10.7 tp -97.41 129.71 44.61 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 108.42 -0.956 . . . . 0.0 108.42 178.811 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -90.14 124.41 34.79 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.152 0.501 . . . . 0.0 110.111 -179.729 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 75.4 m-70 -91.02 -31.56 16.26 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.375 -0.829 . . . . 0.0 111.414 -178.87 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 1.9 p30 -170.8 161.87 7.4 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 119.577 -0.849 . . . . 0.0 111.125 177.387 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 5.4 p -146.78 169.11 5.16 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.168 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.307 -178.572 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 14.7 t -140.09 171.78 13.7 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 107.956 -1.127 . . . . 0.0 107.956 178.224 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 4.0 tp -68.18 0.79 3.35 Favored 'General case' 0 C--N 1.324 -0.514 0 C-N-CA 120.124 -0.63 . . . . 0.0 111.185 -179.091 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -160.78 35.21 0.15 Allowed 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.573 -0.451 . . . . 0.0 111.141 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -174.02 159.93 29.55 Favored Glycine 0 CA--C 1.524 0.656 0 N-CA-C 110.943 -0.863 . . . . 0.0 110.943 179.673 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -148.22 148.91 15.7 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.277 0 CA-C-O 121.46 0.648 . . . . 0.0 111.839 -178.664 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -121.57 134.84 55.02 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 114.839 -1.073 . . . . 0.0 108.612 178.662 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 33.3 m -139.63 175.05 7.79 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-O 121.234 0.54 . . . . 0.0 111.698 -179.444 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -99.47 143.7 16.66 Favored Glycine 0 N--CA 1.467 0.746 0 N-CA-C 108.774 -1.73 . . . . 0.0 108.774 177.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . 0.52 ' CD ' ' O ' ' A' ' 45' ' ' GLN . 0.0 OUTLIER -85.66 121.7 73.3 Favored Pre-proline 0 CA--C 1.534 0.332 0 CA-C-N 118.221 1.01 . . . . 0.0 111.659 -178.314 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 79.8 Cg_endo -86.6 161.74 9.38 Favored 'Trans proline' 0 C--N 1.303 -1.82 0 C-N-CA 121.766 1.644 . . . . 0.0 111.106 178.447 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.4 mm100 -65.72 -39.65 91.41 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 111.9 0.334 . . . . 0.0 111.9 -179.32 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . 0.528 ' O ' ' N ' ' A' ' 50' ' ' ASN . 79.2 m-20 -72.48 8.7 1.29 Allowed 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 111.912 0.338 . . . . 0.0 111.912 -178.873 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' TRP . . . . . 0.462 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 64.8 t-105 -59.84 66.72 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 112.324 0.49 . . . . 0.0 112.324 -179.344 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . 0.538 ' ND2' ' O ' ' A' ' 50' ' ' ASN . 1.8 t30 -93.07 78.71 4.59 Favored 'General case' 0 C--N 1.326 -0.43 0 C-N-CA 119.947 -0.701 . . . . 0.0 109.302 178.176 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -144.39 144.23 13.11 Favored Glycine 0 CA--C 1.525 0.682 0 N-CA-C 111.578 -0.609 . . . . 0.0 111.578 -179.199 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -78.62 121.99 84.31 Favored Pre-proline 0 CA--C 1.534 0.357 0 CA-C-N 115.795 -0.203 . . . . 0.0 110.811 -179.898 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -60.93 -22.93 75.97 Favored 'Trans proline' 0 N--CA 1.495 1.59 0 C-N-CA 122.443 2.096 . . . . 0.0 112.433 -179.576 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . 0.564 ' C ' ' HE ' ' A' ' 55' ' ' ARG . 28.2 mt-30 -75.5 -23.73 56.78 Favored 'General case' 0 C--N 1.323 -0.544 0 C-N-CA 120.36 -0.536 . . . . 0.0 111.059 -179.634 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.564 ' HE ' ' C ' ' A' ' 54' ' ' GLN . 0.0 OUTLIER -94.11 151.45 39.64 Favored Pre-proline 0 C--N 1.33 -0.252 0 CA-C-O 120.851 0.358 . . . . 0.0 110.043 179.981 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . 0.438 ' O ' ' OE1' ' A' ' 24' ' ' GLN . 33.2 Cg_endo -64.03 160.92 35.5 Favored 'Trans proline' 0 N--CA 1.495 1.615 0 C-N-CA 123.068 2.512 . . . . 0.0 113.532 -178.833 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . 0.535 ' CZ ' ' OE1' ' A' ' 24' ' ' GLN . 58.7 m-85 -130.79 156.38 45.09 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 114.926 -1.034 . . . . 0.0 109.191 179.366 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -123.36 136.74 54.8 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 178.537 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -115.33 135.42 54.16 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.971 0.415 . . . . 0.0 111.915 -178.545 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 3.7 mmm180 -122.91 127.42 48.92 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 108.547 -0.908 . . . . 0.0 108.547 177.725 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 13.5 mt -108.35 151.24 26.26 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.908 0.385 . . . . 0.0 111.001 -178.895 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' TYR . . . . . 0.407 ' CD1' ' N ' ' A' ' 62' ' ' TYR . 12.7 m-85 -134.61 110.68 9.47 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.62 179.809 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.402 ' C ' ' CD2' ' A' ' 63' ' ' LEU . 1.4 tt -106.01 -81.91 0.54 Allowed 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.625 179.608 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -79.84 -177.88 50.96 Favored Glycine 0 CA--C 1.521 0.41 0 N-CA-C 109.343 -1.503 . . . . 0.0 109.343 178.678 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 5.5 mt -76.13 -33.42 59.43 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 119.806 -0.758 . . . . 0.0 110.478 -179.535 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -101.67 8.35 41.68 Favored 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 122.616 0.367 . . . . 0.0 110.849 179.886 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 12.1 t -103.95 94.1 2.99 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.195 0 CA-C-O 121.336 0.589 . . . . 0.0 111.877 -178.769 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 5.4 tp -113.65 117.33 31.26 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 108.088 -1.079 . . . . 0.0 108.088 178.156 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 3.9 mt -112.09 144.39 19.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-O 120.943 0.401 . . . . 0.0 111.174 -178.814 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . 0.418 ' C ' ' HG2' ' A' ' 71' ' ' MET . 0.5 OUTLIER -128.2 130.1 47.49 Favored 'General case' 0 C--O 1.239 0.547 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.653 179.183 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' MET . . . . . 0.418 ' HG2' ' C ' ' A' ' 70' ' ' ARG . 0.0 OUTLIER -138.54 146.83 42.37 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.771 -0.649 . . . . 0.0 109.829 179.551 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . 0.454 ' OE2' ' O ' ' A' ' 57' ' ' PHE . 15.4 tp10 -99.59 132.83 44.67 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 107.551 -1.277 . . . . 0.0 107.551 178.663 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.425 ' O ' ' O ' ' A' ' 57' ' ' PHE . 2.0 pt -143.16 157.17 17.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 C-N-CA 119.182 -1.007 . . . . 0.0 113.102 -177.732 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 7.2 m -123.11 155.87 36.1 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-N 115.111 -0.95 . . . . 0.0 110.022 179.043 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.56 118.33 8.67 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.793 0.33 . . . . 0.0 110.698 -179.252 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -97.1 -43.32 7.45 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-O 121.136 0.493 . . . . 0.0 110.022 177.659 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' TRP . . . . . 0.543 ' NE1' ' HA3' ' A' ' 84' ' ' GLY . 67.5 p-90 -171.22 167.75 6.92 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.042 179.946 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -146.96 123.73 11.23 Favored 'General case' 0 N--CA 1.465 0.278 0 N-CA-C 109.878 -0.416 . . . . 0.0 109.878 178.575 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 10.9 ttp180 -152.48 134.23 14.69 Favored 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 113.163 0.801 . . . . 0.0 113.163 -179.98 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 56.97 47.18 18.12 Favored 'General case' 0 C--N 1.333 -0.15 0 N-CA-C 113.788 1.033 . . . . 0.0 113.788 176.487 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 82.39 -27.94 3.54 Favored Glycine 0 CA--C 1.523 0.58 0 C-N-CA 120.319 -0.943 . . . . 0.0 113.033 177.268 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 4.9 mt -89.39 154.0 20.4 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 117.381 0.59 . . . . 0.0 110.335 -179.004 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 70.1 mt -126.87 135.67 51.28 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.402 -178.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . 0.543 ' HA3' ' NE1' ' A' ' 77' ' ' TRP . . . -98.49 150.84 19.46 Favored Glycine 0 N--CA 1.45 -0.375 0 N-CA-C 109.546 -1.421 . . . . 0.0 109.546 178.64 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 45.8 m-85 -145.57 134.85 22.95 Favored 'General case' 0 C--N 1.318 -0.766 0 C-N-CA 120.863 -0.335 . . . . 0.0 110.458 -179.542 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.431 ' CD ' HE22 ' A' ' 88' ' ' GLN . 5.7 tt0 -103.97 125.73 50.57 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 179.646 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -70.38 125.44 26.8 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.979 0.419 . . . . 0.0 111.542 -178.744 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . 0.431 HE22 ' CD ' ' A' ' 86' ' ' GLU . 29.3 mm-40 -98.22 -31.94 11.82 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.302 179.468 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . 0.472 ' ND1' ' C ' ' A' ' 89' ' ' HIS . 0.0 OUTLIER -160.48 141.59 12.06 Favored 'General case' 0 C--O 1.222 -0.342 0 CA-C-N 116.043 -0.526 . . . . 0.0 109.842 179.617 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . 0.411 ' CD1' ' SD ' ' A' ' 71' ' ' MET . 7.1 tt -145.26 140.72 22.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-O 121.381 0.61 . . . . 0.0 110.235 -179.13 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . 0.545 ' OD1' ' N ' ' A' ' 92' ' ' LEU . 12.9 t0 -56.88 142.42 41.29 Favored 'General case' 0 N--CA 1.462 0.131 0 CA-C-N 115.148 -0.933 . . . . 0.0 112.003 -178.294 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.545 ' N ' ' OD1' ' A' ' 91' ' ' ASP . 6.5 tt -53.87 -41.84 67.96 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 114.82 -1.082 . . . . 0.0 110.233 -179.051 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . 0.43 ' N ' ' OD1' ' A' ' 91' ' ' ASP . 0.6 OUTLIER -67.52 -42.46 82.76 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.815 -0.439 . . . . 0.0 109.815 179.254 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 6.4 m -60.79 -37.8 83.17 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.176 179.615 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 61.4 mt -58.62 -38.32 70.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.243 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -70.97 -40.81 71.72 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.206 -0.597 . . . . 0.0 111.337 -179.131 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 68.7 m-70 . . . . . 0 C--N 1.326 -0.428 0 C-N-CA 119.503 -0.879 . . . . 0.0 109.316 179.945 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 40.5 mm . . . . . 0 CA--C 1.521 -0.149 0 CA-C-O 120.659 0.266 . . . . 0.0 110.412 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -95.58 119.86 34.82 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.33 0.586 . . . . 0.0 111.663 -179.861 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -149.93 154.64 38.62 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.036 -0.983 . . . . 0.0 108.433 177.816 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -95.57 147.03 24.0 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 120.013 -0.675 . . . . 0.0 111.478 -178.328 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -179.11 176.8 0.85 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.698 -0.683 . . . . 0.0 109.846 179.375 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 22.2 t0 -96.11 134.26 39.39 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.95 -179.737 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.594 ' O ' ' O ' ' A' ' 31' ' ' VAL . 21.5 p -134.37 154.06 51.55 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.135 0.493 . . . . 0.0 110.263 179.002 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 18.7 mt-10 -135.29 143.16 46.08 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 109.041 -0.726 . . . . 0.0 109.041 179.487 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -122.35 136.3 59.64 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 C-N-CA 120.21 -0.596 . . . . 0.0 110.986 -179.023 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -123.89 123.32 40.17 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.927 -179.44 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.547 ' OE1' ' CZ ' ' A' ' 57' ' ' PHE . 20.6 tt0 -131.15 102.7 6.11 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.32 -0.855 . . . . 0.0 109.635 178.858 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 78.56 -128.38 8.64 Favored Glycine 0 CA--C 1.522 0.524 0 N-CA-C 109.77 -1.332 . . . . 0.0 109.77 -178.94 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -98.89 11.24 39.42 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.675 0.274 . . . . 0.0 110.456 179.612 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.551 ' HB3' ' CZ2' ' A' ' 29' ' ' TRP . 0.6 OUTLIER -111.78 132.5 54.62 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 121.007 0.432 . . . . 0.0 112.011 -179.056 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.415 ' HG2' ' N ' ' A' ' 29' ' ' TRP . 4.5 ttt85 -126.79 147.43 50.01 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.8 -0.637 . . . . 0.0 109.947 178.931 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.583 ' HE1' ' CG ' ' A' ' 48' ' ' ASP . 6.5 m-90 -145.85 155.44 42.9 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.497 -179.0 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . 0.586 ' OE1' ' N ' ' A' ' 30' ' ' GLU . 0.0 OUTLIER -99.33 138.53 36.3 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 178.982 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.594 ' O ' ' O ' ' A' ' 20' ' ' SER . 17.7 m -149.12 157.82 6.67 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-O 121.226 0.536 . . . . 0.0 110.947 -179.335 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 8.2 tp -98.24 129.84 44.97 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 107.975 -1.12 . . . . 0.0 107.975 178.511 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.9 tt -92.17 126.46 37.26 Favored 'General case' 0 C--N 1.325 -0.489 0 C-N-CA 120.271 -0.572 . . . . 0.0 109.61 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 73.4 m-70 -90.46 -28.16 18.78 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.428 -0.805 . . . . 0.0 111.732 -178.299 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -172.44 161.46 5.11 Favored 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 119.635 -0.826 . . . . 0.0 111.205 177.578 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 4.8 p -144.92 168.99 8.57 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.165 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.949 -179.026 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 9.4 t -141.88 170.55 15.5 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 107.924 -1.139 . . . . 0.0 107.924 178.717 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.479 ' O ' ' CD2' ' A' ' 38' ' ' LEU . 4.0 tt -67.13 -1.08 3.85 Favored 'General case' 0 C--N 1.322 -0.611 0 C-N-CA 119.691 -0.804 . . . . 0.0 110.58 -179.243 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . 0.539 ' CE1' ' O ' ' A' ' 87' ' ' CYS . 26.1 t60 -159.86 35.4 0.18 Allowed 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 120.642 -0.423 . . . . 0.0 111.609 179.926 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -171.83 155.59 24.17 Favored Glycine 0 CA--C 1.528 0.862 0 N-CA-C 111.135 -0.786 . . . . 0.0 111.135 179.79 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.407 HG22 HD13 ' A' ' 41' ' ' ILE . 0.1 OUTLIER -147.33 149.09 15.89 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.454 0 CA-C-O 121.368 0.604 . . . . 0.0 111.774 -179.182 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -122.7 139.58 53.8 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 115.205 -0.907 . . . . 0.0 109.185 178.984 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.0 m -144.1 175.29 3.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 121.178 0.514 . . . . 0.0 111.709 -179.474 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -97.18 145.47 17.87 Favored Glycine 0 CA--C 1.531 1.073 0 N-CA-C 109.692 -1.363 . . . . 0.0 109.692 178.545 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . 0.541 ' NE2' ' O ' ' A' ' 46' ' ' PRO . 17.9 tm0? -87.65 114.3 58.32 Favored Pre-proline 0 N--CA 1.467 0.411 0 CA-C-N 117.954 0.877 . . . . 0.0 112.06 -178.467 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.541 ' O ' ' NE2' ' A' ' 45' ' ' GLN . 83.7 Cg_endo -84.24 161.5 13.26 Favored 'Trans proline' 0 C--N 1.308 -1.557 0 C-N-CA 121.569 1.513 . . . . 0.0 110.97 178.524 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -65.26 -40.17 93.62 Favored 'General case' 0 N--CA 1.465 0.317 0 N-CA-C 112.7 0.629 . . . . 0.0 112.7 -178.621 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . 0.583 ' CG ' ' HE1' ' A' ' 29' ' ' TRP . 38.5 t0 -73.95 8.84 1.79 Allowed 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 112.068 0.396 . . . . 0.0 112.068 -178.571 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' TRP . . . . . 0.475 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 65.2 t-105 -59.17 69.32 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 111.636 0.235 . . . . 0.0 111.636 -179.781 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . 0.547 ' N ' ' O ' ' A' ' 48' ' ' ASP . 0.5 OUTLIER -93.41 78.82 4.4 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 120.203 -0.599 . . . . 0.0 110.019 178.913 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -142.52 159.48 27.22 Favored Glycine 0 CA--C 1.526 0.731 0 N-CA-C 111.22 -0.752 . . . . 0.0 111.22 -179.765 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 45.3 t0 -95.26 109.05 42.85 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-N 115.759 -0.22 . . . . 0.0 111.022 -179.544 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 78.1 Cg_exo -47.27 -22.69 2.59 Favored 'Trans proline' 0 N--CA 1.493 1.485 0 C-N-CA 122.358 2.039 . . . . 0.0 112.077 179.532 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.51 -23.84 53.7 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.285 -179.386 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.487 ' O ' ' CE1' ' A' ' 57' ' ' PHE . 26.6 mtm180 -95.26 155.22 39.1 Favored Pre-proline 0 N--CA 1.463 0.207 0 C-N-CA 120.616 -0.434 . . . . 0.0 110.22 179.635 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . 0.409 ' O ' ' OE1' ' A' ' 24' ' ' GLN . 9.3 Cg_exo -66.92 160.73 45.63 Favored 'Trans proline' 0 N--CA 1.493 1.49 0 C-N-CA 122.685 2.256 . . . . 0.0 113.305 -178.864 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . 0.547 ' CZ ' ' OE1' ' A' ' 24' ' ' GLN . 49.3 m-85 -130.76 155.31 46.86 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 114.851 -1.068 . . . . 0.0 108.937 179.313 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -122.16 139.17 54.06 Favored 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 178.326 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -119.77 137.69 53.8 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 112.217 0.451 . . . . 0.0 112.217 -178.059 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 13.0 mtt180 -123.17 127.6 48.88 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 108.623 -0.88 . . . . 0.0 108.623 177.385 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 9.7 mt -109.39 150.98 27.25 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.942 0.401 . . . . 0.0 110.757 -178.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' TYR . . . . . 0.425 ' CD1' ' N ' ' A' ' 62' ' ' TYR . 20.1 m-85 -132.61 109.68 9.91 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.438 179.73 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 1.9 tt -104.55 -82.48 0.51 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.731 -0.668 . . . . 0.0 109.398 179.501 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . 0.409 ' H ' ' HB ' ' A' ' 67' ' ' VAL . . . -78.68 179.01 52.82 Favored Glycine 0 CA--C 1.522 0.497 0 N-CA-C 109.156 -1.578 . . . . 0.0 109.156 178.423 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.57 ' CD2' ' N ' ' A' ' 65' ' ' LEU . 3.1 mm? -74.22 -33.06 63.25 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 119.827 -0.749 . . . . 0.0 110.118 -179.498 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -101.96 9.32 40.61 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.95 179.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . 0.409 ' HB ' ' H ' ' A' ' 64' ' ' GLY . 8.9 t -106.08 95.91 4.18 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.242 0 CA-C-O 121.309 0.576 . . . . 0.0 111.807 -178.621 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 6.5 tp -113.1 117.46 32.03 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 108.169 -1.049 . . . . 0.0 108.169 178.176 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 3.5 mt -111.04 142.92 22.02 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-O 120.97 0.414 . . . . 0.0 110.836 -178.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 5.7 ttp180 -128.2 130.97 48.83 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.734 179.572 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -139.64 147.4 40.98 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.643 179.846 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -106.38 123.74 48.53 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 107.52 -1.289 . . . . 0.0 107.52 178.257 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.476 ' O ' ' O ' ' A' ' 57' ' ' PHE . 3.8 pt -134.47 162.35 39.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 N-CA-C 113.348 0.87 . . . . 0.0 113.348 -176.923 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 1.9 t -119.0 148.58 42.84 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 114.808 -1.087 . . . . 0.0 108.71 178.251 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.405 ' HA ' ' CD1' ' A' ' 85' ' ' PHE . 2.3 tt -66.46 126.74 29.79 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.569 0.7 . . . . 0.0 110.119 -179.127 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -98.2 -41.39 7.92 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 114.923 -1.035 . . . . 0.0 110.928 178.284 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' TRP . . . . . 0.534 ' NE1' ' HA3' ' A' ' 84' ' ' GLY . 69.2 p-90 -169.59 171.94 7.24 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.096 -179.409 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -149.19 123.13 9.37 Favored 'General case' 0 N--CA 1.465 0.301 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 177.725 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 20.4 ttt-85 -152.91 134.66 14.59 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 119.775 -0.77 . . . . 0.0 113.033 -179.882 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 56.54 46.84 19.78 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 113.372 0.878 . . . . 0.0 113.372 176.586 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 80.82 -25.22 3.53 Favored Glycine 0 CA--C 1.524 0.632 0 C-N-CA 120.485 -0.864 . . . . 0.0 113.082 177.479 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 7.6 mt -89.76 161.41 16.05 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 117.882 0.841 . . . . 0.0 110.825 -178.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 54.3 mt -136.37 136.24 39.48 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.278 -179.308 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . 0.534 ' HA3' ' NE1' ' A' ' 77' ' ' TRP . . . -109.61 156.2 15.72 Favored Glycine 0 N--CA 1.451 -0.316 0 N-CA-C 109.294 -1.522 . . . . 0.0 109.294 178.169 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' PHE . . . . . 0.405 ' CD1' ' HA ' ' A' ' 75' ' ' LEU . 81.4 m-85 -145.46 143.3 29.94 Favored 'General case' 0 C--N 1.318 -0.788 0 C-N-CA 120.829 -0.348 . . . . 0.0 110.214 -179.655 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.485 ' OE2' ' CD2' ' A' ' 39' ' ' HIS . 14.5 tm-20 -103.37 128.74 50.4 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 179.276 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . 0.539 ' O ' ' CE1' ' A' ' 39' ' ' HIS . 41.0 t -78.28 127.14 31.8 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 112.267 0.469 . . . . 0.0 112.267 -178.236 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -102.98 -27.99 12.28 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.462 179.367 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . 0.558 ' ND1' ' N ' ' A' ' 90' ' ' ILE . 0.0 OUTLIER -160.46 141.28 11.88 Favored 'General case' 0 C--O 1.227 -0.104 0 CA-C-O 121.019 0.438 . . . . 0.0 110.55 179.433 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . 0.558 ' N ' ' ND1' ' A' ' 89' ' ' HIS . 9.3 tt -145.74 141.16 21.99 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.966 -179.843 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 5.5 t0 -54.67 141.9 30.38 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 115.334 -0.848 . . . . 0.0 112.23 -178.248 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 57.3 tp -54.12 -41.97 68.93 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 114.929 -1.032 . . . . 0.0 109.979 -179.704 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -68.89 -41.53 78.15 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 109.558 -0.534 . . . . 0.0 109.558 179.228 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 13.4 m -61.39 -37.3 82.93 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.863 -0.608 . . . . 0.0 109.878 179.325 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 47.6 mt -58.62 -38.03 68.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 115.635 -0.712 . . . . 0.0 110.011 179.74 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -70.86 -37.79 73.11 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 120.266 -0.574 . . . . 0.0 110.686 -179.465 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 73.5 m-70 . . . . . 0 C--N 1.326 -0.448 0 C-N-CA 119.657 -0.817 . . . . 0.0 109.235 179.491 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 42.2 mm . . . . . 0 CA--C 1.522 -0.121 0 CA-C-O 120.566 0.222 . . . . 0.0 110.887 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -93.75 120.39 33.96 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.315 0.579 . . . . 0.0 111.19 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 2.3 p90 -149.76 157.66 43.42 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.164 -0.926 . . . . 0.0 108.683 178.045 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -95.6 146.21 24.65 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 120.343 -0.543 . . . . 0.0 110.502 -179.472 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . 179.32 174.45 0.76 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.367 179.703 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -96.15 133.84 39.94 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.544 179.924 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.531 ' O ' ' O ' ' A' ' 31' ' ' VAL . 3.3 p -134.64 154.11 51.66 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.976 0.417 . . . . 0.0 110.18 179.076 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -132.93 143.67 49.63 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.172 -0.677 . . . . 0.0 109.172 179.427 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 53.3 mt -124.33 136.41 60.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 C-N-CA 120.176 -0.61 . . . . 0.0 111.184 -179.477 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -121.11 123.39 42.2 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.659 -179.34 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.567 HE22 ' N ' ' A' ' 52' ' ' ASP . 3.4 tt0 -130.78 101.9 5.86 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.135 -0.939 . . . . 0.0 109.551 179.361 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 78.37 -129.08 9.1 Favored Glycine 0 CA--C 1.523 0.553 0 N-CA-C 109.785 -1.326 . . . . 0.0 109.785 -178.668 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 19.2 pt-20 -98.81 11.49 38.56 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.903 0.382 . . . . 0.0 110.21 179.367 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.449 ' HB3' ' CZ2' ' A' ' 29' ' ' TRP . 1.1 mpt_? -112.42 133.79 54.31 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.074 -0.512 . . . . 0.0 112.01 -178.922 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 17.2 ttt180 -127.12 149.58 49.88 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.873 -0.603 . . . . 0.0 109.764 178.777 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.566 ' NE1' ' O ' ' A' ' 48' ' ' ASP . 6.1 m-90 -147.74 156.45 42.76 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.769 -178.927 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 78.1 mt-10 -99.3 131.3 45.42 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.693 -0.685 . . . . 0.0 109.212 178.81 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.531 ' O ' ' O ' ' A' ' 20' ' ' SER . 14.4 m -137.15 154.7 31.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-O 121.256 0.551 . . . . 0.0 111.214 -179.504 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 13.0 tp -95.23 126.57 40.64 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 108.531 -0.914 . . . . 0.0 108.531 178.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.452 ' HG ' ' N ' ' A' ' 34' ' ' HIS . 2.3 tt -83.02 150.75 26.15 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 179.631 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' HIS . . . . . 0.452 ' N ' ' HG ' ' A' ' 33' ' ' LEU . 64.7 m-70 -123.01 -28.33 4.08 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.155 179.604 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -173.83 160.62 3.65 Favored 'General case' 0 C--N 1.327 -0.413 0 C-N-CA 119.802 -0.759 . . . . 0.0 111.109 176.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 6.5 p -145.24 169.08 7.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.146 -179.06 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' SER . . . . . 0.449 ' C ' ' H ' ' A' ' 39' ' ' HIS . 29.8 t -142.17 167.68 21.55 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 107.985 -1.117 . . . . 0.0 107.985 178.6 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 2.7 pp -62.99 -0.16 0.65 Allowed 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 119.758 -0.777 . . . . 0.0 110.963 -179.157 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . 0.449 ' H ' ' C ' ' A' ' 37' ' ' SER . 0.4 OUTLIER -165.61 43.04 0.07 Allowed 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 120.793 -0.363 . . . . 0.0 111.467 -179.91 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -178.85 154.95 15.09 Favored Glycine 0 CA--C 1.528 0.881 0 N-CA-C 110.816 -0.914 . . . . 0.0 110.816 179.812 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -148.21 148.77 15.84 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.238 0 CA-C-O 121.469 0.652 . . . . 0.0 111.873 -178.9 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -120.79 132.42 55.02 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 114.813 -1.085 . . . . 0.0 108.187 178.355 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 5.4 m -139.26 175.9 6.88 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-O 121.368 0.604 . . . . 0.0 111.821 -178.737 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -98.0 143.87 16.94 Favored Glycine 0 CA--C 1.529 0.968 0 N-CA-C 109.758 -1.337 . . . . 0.0 109.758 178.148 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . 0.483 ' O ' ' OE1' ' A' ' 45' ' ' GLN . 1.7 tm0? -85.78 117.73 69.26 Favored Pre-proline 0 N--CA 1.466 0.345 0 CA-C-N 117.625 0.713 . . . . 0.0 111.686 -178.78 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_endo -86.79 161.76 9.1 Favored 'Trans proline' 0 C--N 1.311 -1.446 0 C-N-CA 121.628 1.552 . . . . 0.0 111.037 178.687 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.53 ' CD ' ' H ' ' A' ' 47' ' ' GLN . 1.2 mp0 -65.49 -40.63 93.31 Favored 'General case' 0 N--CA 1.467 0.407 0 N-CA-C 112.604 0.594 . . . . 0.0 112.604 -178.877 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . 0.566 ' O ' ' NE1' ' A' ' 29' ' ' TRP . 1.2 m-20 -72.2 8.56 1.27 Allowed 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 111.866 0.321 . . . . 0.0 111.866 -178.371 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' TRP . . . . . 0.463 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 63.5 t-105 -60.13 68.9 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.55 -0.295 . . . . 0.0 111.717 -179.521 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . 0.534 ' C ' HD21 ' A' ' 50' ' ' ASN . 0.7 OUTLIER -93.35 78.76 4.44 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 120.074 -0.651 . . . . 0.0 109.806 178.737 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . 0.452 ' CA ' HE22 ' A' ' 24' ' ' GLN . . . -143.93 151.22 23.19 Favored Glycine 0 CA--C 1.525 0.707 0 N-CA-C 110.896 -0.882 . . . . 0.0 110.896 -179.729 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . 0.567 ' N ' HE22 ' A' ' 24' ' ' GLN . 11.0 t0 -88.17 114.18 58.29 Favored Pre-proline 0 CA--C 1.536 0.415 0 CA-C-O 120.339 0.114 . . . . 0.0 111.014 -179.677 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_exo -46.93 -22.42 2.0 Favored 'Trans proline' 0 N--CA 1.497 1.694 0 C-N-CA 122.735 2.29 . . . . 0.0 112.671 179.618 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -78.27 -24.12 46.94 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 120.571 -0.452 . . . . 0.0 111.894 -178.632 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.553 ' O ' ' CE1' ' A' ' 57' ' ' PHE . 12.7 mtp85 -93.9 152.59 40.69 Favored Pre-proline 0 C--N 1.33 -0.247 0 C-N-CA 120.598 -0.441 . . . . 0.0 110.177 179.839 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_endo -65.01 160.57 40.89 Favored 'Trans proline' 0 N--CA 1.495 1.565 0 C-N-CA 122.734 2.289 . . . . 0.0 112.93 -178.912 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . 0.553 ' CE1' ' O ' ' A' ' 55' ' ' ARG . 43.1 m-85 -130.41 156.43 44.76 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.094 -0.957 . . . . 0.0 109.17 179.469 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -123.1 136.8 54.95 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 178.357 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -116.66 136.08 53.26 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.097 0.475 . . . . 0.0 111.931 -178.152 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . 0.457 ' HE ' HD13 ' A' ' 68' ' ' LEU . 16.1 mmm-85 -123.02 127.56 48.95 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 177.864 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 6.9 mt -105.99 151.06 25.1 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.063 0.458 . . . . 0.0 111.243 -178.43 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' TYR . . . . . 0.478 ' CD1' ' N ' ' A' ' 62' ' ' TYR . 13.6 m-85 -135.88 108.9 7.66 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.002 179.291 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -105.34 -81.3 0.54 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.681 -0.69 . . . . 0.0 109.589 179.911 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . 0.411 ' H ' ' HB ' ' A' ' 67' ' ' VAL . . . -78.82 -176.44 47.93 Favored Glycine 0 CA--C 1.521 0.428 0 N-CA-C 109.254 -1.538 . . . . 0.0 109.254 178.421 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.41 ' H ' HD23 ' A' ' 65' ' ' LEU . 0.3 OUTLIER -76.39 -33.34 58.88 Favored 'General case' 0 C--N 1.329 -0.326 0 C-N-CA 119.918 -0.713 . . . . 0.0 110.59 -179.62 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . 0.41 ' OD1' ' O ' ' A' ' 66' ' ' ASP . 48.2 t0 -103.06 9.21 38.64 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 122.753 0.421 . . . . 0.0 111.075 -179.789 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . 0.411 ' HB ' ' H ' ' A' ' 64' ' ' GLY . 28.7 t -103.33 95.21 3.66 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.249 0 CA-C-O 121.288 0.566 . . . . 0.0 111.698 -178.652 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.457 HD13 ' HE ' ' A' ' 60' ' ' ARG . 1.3 tp -114.2 117.6 31.65 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 178.917 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . 0.453 HD13 HG21 ' A' ' 69' ' ' ILE . 18.7 mm -113.15 145.24 19.35 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.252 0 CA-C-O 121.012 0.434 . . . . 0.0 111.726 -178.422 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 3.2 ptm180 -128.51 133.42 48.44 Favored 'General case' 0 C--O 1.239 0.502 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.078 179.133 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -146.16 150.42 35.84 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.273 -0.876 . . . . 0.0 110.144 -179.765 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -103.81 128.2 51.25 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 107.851 -1.166 . . . . 0.0 107.851 178.335 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.51 HD13 ' CG ' ' A' ' 85' ' ' PHE . 14.5 pt -135.97 156.98 38.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 C-N-CA 119.995 -0.682 . . . . 0.0 112.757 -177.594 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 31.3 t -122.41 151.35 41.34 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 114.781 -1.1 . . . . 0.0 109.903 179.195 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.506 ' CD1' ' CZ ' ' A' ' 85' ' ' PHE . 7.1 tp -66.21 121.2 14.66 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.184 0.516 . . . . 0.0 110.365 -179.68 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -97.57 -42.57 7.62 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 115.454 -0.793 . . . . 0.0 110.522 178.175 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' TRP . . . . . 0.555 ' NE1' ' HA3' ' A' ' 84' ' ' GLY . 66.8 p-90 -168.52 167.37 11.69 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 115.419 -0.809 . . . . 0.0 110.084 -179.357 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -147.51 123.77 10.89 Favored 'General case' 0 N--CA 1.465 0.325 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 178.612 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 33.9 ttt85 -152.4 134.29 14.81 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 119.789 -0.764 . . . . 0.0 113.043 179.87 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 57.05 47.3 17.7 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 113.781 1.03 . . . . 0.0 113.781 176.839 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 82.78 -27.48 3.82 Favored Glycine 0 CA--C 1.522 0.495 0 C-N-CA 120.292 -0.956 . . . . 0.0 113.28 177.075 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 3.9 mt -89.67 158.85 17.4 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 117.744 0.772 . . . . 0.0 110.153 -179.096 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 63.4 mt -130.68 135.44 47.83 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.387 -179.119 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . 0.555 ' HA3' ' NE1' ' A' ' 77' ' ' TRP . . . -93.93 151.69 20.38 Favored Glycine 0 N--CA 1.448 -0.561 0 N-CA-C 109.477 -1.449 . . . . 0.0 109.477 178.434 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' PHE . . . . . 0.51 ' CG ' HD13 ' A' ' 73' ' ' ILE . 26.8 m-85 -145.81 131.3 18.73 Favored 'General case' 0 C--N 1.317 -0.823 0 C-N-CA 120.647 -0.421 . . . . 0.0 110.692 -179.234 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.527 ' OE1' ' NE2' ' A' ' 88' ' ' GLN . 4.0 tt0 -103.76 127.56 51.23 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 179.664 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 4.9 t -70.67 122.77 20.42 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.929 0.395 . . . . 0.0 111.907 -178.616 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . 0.527 ' NE2' ' OE1' ' A' ' 86' ' ' GLU . 32.0 mm-40 -94.74 -32.43 13.33 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.898 -0.592 . . . . 0.0 109.774 179.16 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . 0.498 ' ND1' ' N ' ' A' ' 90' ' ' ILE . 0.0 OUTLIER -163.38 143.72 8.93 Favored 'General case' 0 C--O 1.223 -0.316 0 CA-C-N 115.74 -0.664 . . . . 0.0 109.984 179.751 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . 0.498 ' N ' ' ND1' ' A' ' 89' ' ' HIS . 10.7 tt -144.89 141.06 23.32 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-O 121.379 0.609 . . . . 0.0 109.918 -179.83 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . 0.553 ' O ' ' OG ' ' A' ' 94' ' ' SER . 4.7 t0 -56.43 142.11 39.8 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-N 115.209 -0.905 . . . . 0.0 112.1 -177.903 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 3.7 tp -54.44 -41.56 69.55 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 114.885 -1.052 . . . . 0.0 109.895 -179.635 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -70.51 -37.71 74.2 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.208 179.45 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' SER . . . . . 0.553 ' OG ' ' O ' ' A' ' 91' ' ' ASP . 2.2 p -63.16 -35.18 79.44 Favored 'General case' 0 C--N 1.333 -0.149 0 N-CA-C 109.841 -0.429 . . . . 0.0 109.841 179.706 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 36.2 mt -62.08 -39.16 82.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.209 179.539 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -70.53 -42.73 70.83 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.386 -0.526 . . . . 0.0 111.785 -178.371 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 57.4 m-70 . . . . . 0 C--N 1.323 -0.567 0 C-N-CA 119.153 -1.019 . . . . 0.0 109.264 -179.778 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.563 ' CD1' ' N ' ' A' ' 14' ' ' ILE . 1.9 mp . . . . . 0 CA--C 1.519 -0.215 0 N-CA-C 110.276 -0.268 . . . . 0.0 110.276 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -93.0 120.57 33.43 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.297 0.57 . . . . 0.0 111.402 -179.524 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 2.0 p90 -149.68 157.06 42.88 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.135 -0.939 . . . . 0.0 108.565 178.134 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -95.55 147.22 23.8 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 120.341 -0.544 . . . . 0.0 110.62 -179.223 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . 178.94 176.2 0.57 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.241 179.795 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -96.43 134.51 39.51 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.933 -179.608 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.654 ' O ' ' O ' ' A' ' 31' ' ' VAL . 11.5 p -136.48 159.93 40.29 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.07 179.092 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.471 ' OE1' ' N ' ' A' ' 22' ' ' ILE . 0.3 OUTLIER -148.29 145.2 28.07 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 108.717 -0.845 . . . . 0.0 108.717 178.772 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . 0.471 ' N ' ' OE1' ' A' ' 21' ' ' GLU . 61.6 mt -119.58 136.73 55.77 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.323 0 CA-C-O 121.237 0.542 . . . . 0.0 112.056 -177.776 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.433 ' CD1' ' N ' ' A' ' 23' ' ' LEU . 0.0 OUTLIER -117.8 123.24 45.46 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.492 -0.776 . . . . 0.0 110.443 179.678 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.422 ' HG3' ' O ' ' A' ' 56' ' ' PRO . 38.1 tt0 -129.26 101.42 5.99 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.446 -0.797 . . . . 0.0 109.823 179.101 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 78.09 -126.78 7.84 Favored Glycine 0 CA--C 1.521 0.418 0 N-CA-C 109.877 -1.289 . . . . 0.0 109.877 -179.089 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.457 ' OE1' ' O ' ' A' ' 26' ' ' GLU . 0.0 OUTLIER -100.24 9.82 42.16 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.894 0.378 . . . . 0.0 110.084 179.53 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.463 ' HB3' ' CZ2' ' A' ' 29' ' ' TRP . 36.7 mtt85 -112.37 134.62 53.81 Favored 'General case' 0 CA--C 1.521 -0.15 0 CA-C-N 116.06 -0.518 . . . . 0.0 112.066 -178.806 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 60.1 ttt-85 -129.24 150.15 50.74 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.346 179.852 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.528 ' NE1' ' O ' ' A' ' 48' ' ' ASP . 6.5 m-90 -147.49 155.01 41.48 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.171 -179.169 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . 0.551 ' CD ' ' H ' ' A' ' 30' ' ' GLU . 1.4 mp0 -101.23 140.32 35.69 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 179.517 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.654 ' O ' ' O ' ' A' ' 20' ' ' SER . 18.9 m -148.89 157.11 7.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-O 121.149 0.499 . . . . 0.0 111.121 -179.466 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.684 ' H ' ' CD2' ' A' ' 32' ' ' LEU . 1.2 pt? -95.71 129.82 42.81 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 108.456 -0.942 . . . . 0.0 108.456 178.294 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.4 tt -93.57 126.11 38.54 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.403 0.62 . . . . 0.0 110.239 -179.255 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 50.2 m-70 -90.65 -25.75 19.95 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.009 -0.996 . . . . 0.0 111.863 -178.375 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -175.2 161.78 2.89 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 119.721 -0.792 . . . . 0.0 111.341 177.78 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 4.3 p -143.42 168.37 12.47 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.157 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.871 -179.472 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' SER . . . . . 0.448 ' C ' ' H ' ' A' ' 39' ' ' HIS . 25.3 t -142.92 167.06 22.97 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 107.789 -1.189 . . . . 0.0 107.789 178.399 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.488 ' C ' ' CG ' ' A' ' 39' ' ' HIS . 1.0 OUTLIER -63.28 -1.32 1.04 Allowed 'General case' 0 C--N 1.322 -0.588 0 C-N-CA 119.602 -0.839 . . . . 0.0 110.31 -179.811 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . 0.488 ' CG ' ' C ' ' A' ' 38' ' ' LEU . 0.0 OUTLIER -163.3 46.31 0.13 Allowed 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 120.713 -0.395 . . . . 0.0 111.301 179.995 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 177.14 153.58 11.05 Favored Glycine 0 CA--C 1.528 0.86 0 N-CA-C 111.221 -0.752 . . . . 0.0 111.221 179.568 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -148.77 149.36 15.08 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.255 0 CA-C-O 121.33 0.586 . . . . 0.0 111.64 -179.198 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.419 HD21 ' N ' ' A' ' 43' ' ' VAL . 0.6 OUTLIER -121.18 136.47 54.97 Favored 'General case' 0 N--CA 1.464 0.27 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 178.685 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . 0.419 ' N ' HD21 ' A' ' 42' ' ' LEU . 19.3 m -140.22 175.29 6.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 C-N-CA 120.226 -0.589 . . . . 0.0 111.887 -179.561 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -97.3 144.36 17.28 Favored Glycine 0 CA--C 1.527 0.829 0 N-CA-C 109.247 -1.541 . . . . 0.0 109.247 177.938 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 60.4 tt0 -86.82 114.66 59.23 Favored Pre-proline 0 N--CA 1.466 0.349 0 CA-C-N 117.938 0.869 . . . . 0.0 111.839 -178.504 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 93.8 Cg_endo -84.85 162.7 12.03 Favored 'Trans proline' 0 C--N 1.31 -1.488 0 C-N-CA 121.81 1.674 . . . . 0.0 111.774 178.938 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.684 ' NE2' ' H ' ' A' ' 48' ' ' ASP . 0.4 OUTLIER -65.54 -40.1 92.5 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 112.438 0.532 . . . . 0.0 112.438 -178.981 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . 0.684 ' H ' ' NE2' ' A' ' 47' ' ' GLN . 37.6 m-20 -74.21 8.79 1.93 Allowed 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 111.895 0.331 . . . . 0.0 111.895 -178.645 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' TRP . . . . . 0.48 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 62.3 t-105 -60.79 69.01 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 112.006 0.373 . . . . 0.0 112.006 -179.525 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . 0.557 HD21 ' C ' ' A' ' 50' ' ' ASN . 0.2 OUTLIER -92.96 80.07 4.61 Favored 'General case' 0 C--N 1.326 -0.43 0 C-N-CA 119.84 -0.744 . . . . 0.0 109.439 178.476 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -143.17 146.08 16.53 Favored Glycine 0 CA--C 1.524 0.596 0 N-CA-C 111.341 -0.703 . . . . 0.0 111.341 -179.301 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 53.9 t0 -84.42 113.95 51.92 Favored Pre-proline 0 CA--C 1.533 0.305 0 CA-C-N 115.96 -0.12 . . . . 0.0 110.705 179.817 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_exo -48.0 -22.33 3.41 Favored 'Trans proline' 0 N--CA 1.497 1.716 0 C-N-CA 122.517 2.144 . . . . 0.0 112.194 179.854 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 34.5 mm-40 -77.63 -24.11 49.6 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.132 -0.485 . . . . 0.0 112.044 -178.703 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.564 ' O ' ' CE1' ' A' ' 57' ' ' PHE . 39.1 mtp85 -95.15 151.64 38.91 Favored Pre-proline 0 N--CA 1.464 0.245 0 C-N-CA 120.573 -0.451 . . . . 0.0 110.436 -179.703 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . 0.422 ' O ' ' HG3' ' A' ' 24' ' ' GLN . 38.3 Cg_endo -65.59 161.09 40.09 Favored 'Trans proline' 0 N--CA 1.498 1.751 0 C-N-CA 123.156 2.571 . . . . 0.0 113.072 -178.855 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . 0.564 ' CE1' ' O ' ' A' ' 55' ' ' ARG . 42.7 m-85 -131.59 156.29 46.04 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.344 -0.843 . . . . 0.0 109.572 179.587 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 29.2 mt-10 -120.35 133.95 55.35 Favored 'General case' 0 N--CA 1.469 0.475 0 N-CA-C 108.913 -0.773 . . . . 0.0 108.913 178.043 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -114.36 136.28 53.16 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.149 0.5 . . . . 0.0 111.998 -178.332 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 12.1 mmt180 -123.12 127.86 49.29 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 108.352 -0.981 . . . . 0.0 108.352 177.644 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 10.7 mp -108.16 147.14 31.7 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 120.33 -0.548 . . . . 0.0 110.683 -179.316 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' TYR . . . . . 0.513 ' CD1' ' N ' ' A' ' 62' ' ' TYR . 4.2 m-85 -130.6 111.1 11.91 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.353 179.77 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 1.8 tt -106.57 -79.33 0.57 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.852 -0.613 . . . . 0.0 109.938 179.781 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -80.99 -177.33 51.58 Favored Glycine 0 CA--C 1.52 0.404 0 N-CA-C 109.372 -1.491 . . . . 0.0 109.372 178.643 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 12.1 mt -76.07 -32.62 59.35 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 119.725 -0.79 . . . . 0.0 110.452 -179.441 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -104.16 8.91 36.38 Favored 'General case' 0 C--N 1.332 -0.185 0 C-N-CA 122.656 0.382 . . . . 0.0 111.222 -179.825 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 37.6 t -104.8 96.29 4.48 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.294 0 CA-C-O 121.37 0.605 . . . . 0.0 111.654 -179.072 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 3.1 tp -116.06 117.52 30.33 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 107.95 -1.13 . . . . 0.0 107.95 178.659 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . 0.464 HG22 HD12 ' A' ' 69' ' ' ILE . 20.9 mm -111.8 146.3 16.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.639 -178.29 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . 0.678 ' H ' ' HG ' ' A' ' 94' ' ' SER . 0.0 OUTLIER -128.36 130.49 47.82 Favored 'General case' 0 C--O 1.238 0.481 0 CA-C-O 121.25 0.548 . . . . 0.0 111.134 178.817 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' MET . . . . . 0.403 ' HG2' ' C ' ' A' ' 70' ' ' ARG . 1.2 mtm -140.66 148.2 40.46 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.494 -0.775 . . . . 0.0 110.002 179.629 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . 0.457 ' OE2' ' O ' ' A' ' 57' ' ' PHE . 10.6 tp10 -100.74 128.47 46.77 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 107.678 -1.23 . . . . 0.0 107.678 178.666 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.512 HD13 ' CG ' ' A' ' 85' ' ' PHE . 9.2 pt -138.83 157.23 29.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 C-N-CA 119.601 -0.84 . . . . 0.0 112.965 -177.644 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -121.82 150.99 41.11 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 114.787 -1.097 . . . . 0.0 109.613 178.765 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.435 ' CD1' ' CZ ' ' A' ' 85' ' ' PHE . 7.3 tp -66.48 123.46 20.08 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.425 0.631 . . . . 0.0 110.457 -179.666 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -98.18 -43.63 6.92 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 114.959 -1.019 . . . . 0.0 111.115 178.168 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' TRP . . . . . 0.563 ' NE1' ' HA3' ' A' ' 84' ' ' GLY . 68.7 p-90 -167.56 171.21 10.52 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.436 -179.124 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -151.09 123.87 8.58 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 116.541 -0.3 . . . . 0.0 110.305 178.776 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 8.1 ttt85 -152.33 133.6 14.38 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 112.821 0.674 . . . . 0.0 112.821 179.494 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . 0.414 ' O ' ' OD1' ' A' ' 80' ' ' ASP . 8.3 t70 56.4 47.41 19.02 Favored 'General case' 0 N--CA 1.464 0.26 0 N-CA-C 113.528 0.936 . . . . 0.0 113.528 176.506 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 69.43 12.72 66.93 Favored Glycine 0 CA--C 1.523 0.558 0 C-N-CA 120.305 -0.95 . . . . 0.0 111.931 178.188 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 49.5 mt -117.65 139.67 50.7 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 108.739 -0.837 . . . . 0.0 108.739 178.665 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 44.9 mt -122.72 135.06 54.46 Favored 'General case' 0 CA--C 1.513 -0.455 0 C-N-CA 120.359 -0.536 . . . . 0.0 111.179 -179.311 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . 0.563 ' HA3' ' NE1' ' A' ' 77' ' ' TRP . . . -97.81 153.63 20.14 Favored Glycine 0 N--CA 1.448 -0.558 0 N-CA-C 109.474 -1.451 . . . . 0.0 109.474 178.868 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' PHE . . . . . 0.512 ' CG ' HD13 ' A' ' 73' ' ' ILE . 27.8 m-85 -145.44 132.16 19.99 Favored 'General case' 0 C--N 1.314 -0.966 0 C-N-CA 120.788 -0.365 . . . . 0.0 110.668 -179.183 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 55.9 tt0 -103.92 127.88 51.44 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 179.726 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -76.62 125.86 29.98 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.065 0.459 . . . . 0.0 111.626 -178.715 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -103.46 -29.26 11.29 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.236 179.701 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . 0.459 ' ND1' ' C ' ' A' ' 89' ' ' HIS . 0.0 OUTLIER -160.35 141.2 11.97 Favored 'General case' 0 C--O 1.223 -0.318 0 CA-C-O 120.947 0.403 . . . . 0.0 110.462 179.542 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . 0.451 ' N ' ' ND1' ' A' ' 89' ' ' HIS . 7.5 tt -146.01 141.06 21.6 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.131 -179.619 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -56.75 138.82 52.42 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 115.194 -0.912 . . . . 0.0 111.864 -178.321 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 1.8 tt -54.09 -41.46 68.28 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 115.078 -0.965 . . . . 0.0 110.304 -179.849 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -67.88 -36.1 79.67 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 179.321 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' SER . . . . . 0.678 ' HG ' ' H ' ' A' ' 70' ' ' ARG . 3.9 m -68.62 -37.39 79.72 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.869 179.355 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 54.7 mt -58.9 -38.75 75.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.721 -179.757 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -70.67 -41.21 72.38 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 120.332 -0.547 . . . . 0.0 111.502 -178.385 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 58.5 m-70 . . . . . 0 C--N 1.324 -0.507 0 C-N-CA 119.272 -0.971 . . . . 0.0 109.216 179.875 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.587 ' CD1' ' N ' ' A' ' 14' ' ' ILE . 1.8 mp . . . . . 0 CA--C 1.52 -0.208 0 N-CA-C 109.944 -0.391 . . . . 0.0 109.944 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -93.35 120.4 33.6 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.358 0.599 . . . . 0.0 111.435 -179.493 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -149.7 156.19 41.46 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.029 -0.987 . . . . 0.0 108.509 178.01 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -95.38 148.04 22.87 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 120.271 -0.571 . . . . 0.0 110.646 -178.888 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . 178.73 178.69 0.42 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.695 -0.684 . . . . 0.0 109.852 179.565 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 63.1 t0 -96.63 133.78 40.7 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.76 179.946 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.573 ' O ' ' O ' ' A' ' 31' ' ' VAL . 13.0 p -134.11 154.03 51.45 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.013 0.435 . . . . 0.0 110.164 178.818 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -135.36 145.99 47.93 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 179.519 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 1.1 mm -124.83 136.28 61.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-O 121.278 0.561 . . . . 0.0 110.865 -179.092 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.401 ' CD1' ' NE ' ' A' ' 60' ' ' ARG . 0.3 OUTLIER -123.0 124.1 42.38 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.85 -179.615 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.523 ' O ' ' OE1' ' A' ' 24' ' ' GLN . 1.7 tm0? -130.92 102.2 5.95 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.418 -0.81 . . . . 0.0 109.459 178.774 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 79.04 -128.03 8.34 Favored Glycine 0 CA--C 1.525 0.659 0 N-CA-C 110.016 -1.234 . . . . 0.0 110.016 -178.705 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -99.75 12.07 37.6 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.732 0.301 . . . . 0.0 110.373 179.567 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.471 ' HB3' ' CZ2' ' A' ' 29' ' ' TRP . 0.0 OUTLIER -112.68 133.56 54.64 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.25 -0.432 . . . . 0.0 112.04 -178.815 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.436 ' HG2' ' N ' ' A' ' 29' ' ' TRP . 2.5 ttt85 -126.98 147.45 50.12 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.967 -0.56 . . . . 0.0 109.896 179.146 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.55 ' NE1' ' O ' ' A' ' 48' ' ' ASP . 6.6 m-90 -146.13 155.64 42.88 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.538 -0.755 . . . . 0.0 110.541 -179.214 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -100.19 137.49 38.55 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 179.144 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.573 ' O ' ' O ' ' A' ' 20' ' ' SER . 16.7 m -146.14 156.65 12.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-O 121.2 0.524 . . . . 0.0 111.077 -179.429 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 10.2 tp -95.67 129.95 42.71 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 108.042 -1.096 . . . . 0.0 108.042 178.421 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.3 tt -92.35 124.89 36.74 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.334 0.587 . . . . 0.0 109.99 -179.89 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 72.6 m-70 -90.29 -27.86 19.16 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.287 -0.87 . . . . 0.0 111.864 -178.429 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -172.91 161.91 4.62 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 119.531 -0.867 . . . . 0.0 111.331 177.732 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 4.6 p -144.95 168.76 8.8 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.161 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.121 -179.186 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' SER . . . . . 0.477 ' HG ' ' N ' ' A' ' 38' ' ' LEU . 26.4 t -141.97 168.32 20.02 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 107.919 -1.141 . . . . 0.0 107.919 178.73 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.477 ' N ' ' HG ' ' A' ' 37' ' ' SER . 22.4 tp -64.92 -1.61 2.12 Favored 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 119.64 -0.824 . . . . 0.0 110.281 -179.495 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . 0.411 ' H ' ' C ' ' A' ' 37' ' ' SER . 3.2 p-80 -161.1 41.24 0.15 Allowed 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 120.569 -0.452 . . . . 0.0 111.857 179.655 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -178.76 155.96 17.65 Favored Glycine 0 CA--C 1.528 0.863 0 N-CA-C 111.255 -0.738 . . . . 0.0 111.255 179.635 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -147.29 148.72 16.26 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.321 0 CA-C-O 121.332 0.587 . . . . 0.0 111.991 -178.995 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -121.76 133.53 54.92 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 114.941 -1.027 . . . . 0.0 108.498 178.735 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 32.2 m -138.76 175.19 8.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-O 121.278 0.561 . . . . 0.0 111.891 -179.036 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -97.58 144.18 17.15 Favored Glycine 0 CA--C 1.527 0.842 0 N-CA-C 109.161 -1.575 . . . . 0.0 109.161 177.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . 0.495 ' CD ' ' O ' ' A' ' 45' ' ' GLN . 0.0 OUTLIER -87.34 118.63 70.17 Favored Pre-proline 0 CA--C 1.534 0.342 0 CA-C-N 118.159 0.98 . . . . 0.0 111.941 -178.339 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 95.6 Cg_endo -86.45 162.19 9.61 Favored 'Trans proline' 0 C--N 1.307 -1.608 0 C-N-CA 121.586 1.524 . . . . 0.0 111.196 178.649 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 4.0 mm100 -65.45 -40.23 92.98 Favored 'General case' 0 CA--C 1.533 0.322 0 N-CA-C 112.347 0.499 . . . . 0.0 112.347 -178.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . 0.55 ' O ' ' NE1' ' A' ' 29' ' ' TRP . 7.7 m-20 -71.78 8.83 1.04 Allowed 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.059 0.392 . . . . 0.0 112.059 -178.677 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' TRP . . . . . 0.471 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 64.0 t-105 -60.28 67.77 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 112.054 0.39 . . . . 0.0 112.054 -179.425 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . 0.549 ' ND2' ' C ' ' A' ' 50' ' ' ASN . 0.6 OUTLIER -93.29 78.56 4.48 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 120.195 -0.602 . . . . 0.0 109.394 178.395 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -144.6 145.41 14.84 Favored Glycine 0 CA--C 1.527 0.822 0 C-N-CA 121.165 -0.541 . . . . 0.0 111.807 -179.326 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 45.7 t0 -78.02 122.41 85.39 Favored Pre-proline 0 CA--C 1.536 0.419 0 CA-C-N 115.505 -0.348 . . . . 0.0 110.824 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 20.6 Cg_endo -60.96 -22.3 74.05 Favored 'Trans proline' 0 N--CA 1.498 1.769 0 C-N-CA 122.805 2.336 . . . . 0.0 112.079 -179.576 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 32.1 mt-30 -78.72 -23.53 45.45 Favored 'General case' 0 C--N 1.324 -0.54 0 C-N-CA 120.633 -0.427 . . . . 0.0 111.374 -179.264 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.567 ' O ' ' CE1' ' A' ' 57' ' ' PHE . 34.3 mtp85 -93.85 147.31 33.3 Favored Pre-proline 0 C--N 1.332 -0.186 0 C-N-CA 120.876 -0.33 . . . . 0.0 110.492 -179.741 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -60.71 160.96 22.8 Favored 'Trans proline' 0 N--CA 1.496 1.67 0 C-N-CA 123.041 2.494 . . . . 0.0 113.399 -178.817 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . 0.567 ' CE1' ' O ' ' A' ' 55' ' ' ARG . 39.1 m-85 -130.44 157.14 43.44 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 115.162 -0.927 . . . . 0.0 109.117 179.414 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -124.02 137.62 54.57 Favored 'General case' 0 N--CA 1.469 0.523 0 N-CA-C 109.486 -0.561 . . . . 0.0 109.486 178.683 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -118.55 136.7 53.7 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 112.41 0.522 . . . . 0.0 112.41 -178.093 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . 0.435 HH11 ' HD2' ' A' ' 60' ' ' ARG . 0.6 OUTLIER -121.55 127.43 50.95 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 108.075 -1.083 . . . . 0.0 108.075 176.631 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 12.6 mt -110.11 151.18 27.55 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.93 0.395 . . . . 0.0 110.977 -178.63 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 55.6 m-85 -132.31 108.58 9.3 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.528 179.938 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 3.9 tt -104.17 -82.83 0.5 Allowed 'General case' 0 C--N 1.333 -0.121 0 CA-C-N 115.65 -0.705 . . . . 0.0 109.359 179.238 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . 0.403 ' H ' ' HB ' ' A' ' 67' ' ' VAL . . . -77.59 176.11 53.85 Favored Glycine 0 CA--C 1.521 0.418 0 N-CA-C 109.094 -1.602 . . . . 0.0 109.094 178.279 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.443 ' CD1' ' C ' ' A' ' 65' ' ' LEU . 3.1 tm? -72.2 -35.91 69.06 Favored 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 119.852 -0.739 . . . . 0.0 109.768 -179.693 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . 0.478 ' OD1' ' O ' ' A' ' 66' ' ' ASP . 15.2 t0 -98.55 9.51 43.05 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.15 179.608 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . 0.403 ' HB ' ' H ' ' A' ' 64' ' ' GLY . 15.0 t -107.1 96.47 4.66 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.296 0 CA-C-O 121.453 0.644 . . . . 0.0 112.069 -178.719 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.411 HD22 HH11 ' A' ' 70' ' ' ARG . 0.0 OUTLIER -112.53 118.19 34.44 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 108.173 -1.047 . . . . 0.0 108.173 178.208 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . 0.427 HG23 ' OG ' ' A' ' 94' ' ' SER . 3.3 mt -113.37 144.21 21.48 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.233 0 CA-C-O 121.065 0.46 . . . . 0.0 111.373 -178.694 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . 0.436 ' HD3' ' N ' ' A' ' 70' ' ' ARG . 0.0 OUTLIER -128.14 131.53 48.96 Favored 'General case' 0 C--O 1.239 0.508 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.868 179.407 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -143.26 149.74 38.31 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.11 -179.628 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -104.88 127.24 52.63 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 107.945 -1.131 . . . . 0.0 107.945 178.307 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.459 HD13 ' CG ' ' A' ' 85' ' ' PHE . 14.0 pt -134.9 157.91 41.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 N-CA-C 112.888 0.699 . . . . 0.0 112.888 -177.507 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 9.2 p -122.69 156.06 35.14 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.045 -0.98 . . . . 0.0 109.911 179.032 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 7.2 tp -65.42 119.05 10.3 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.885 0.374 . . . . 0.0 111.054 -179.447 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -97.63 -41.98 7.87 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.554 177.614 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' TRP . . . . . 0.567 ' NE1' ' HA3' ' A' ' 84' ' ' GLY . 67.7 p-90 -171.01 170.02 6.39 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 115.828 -0.624 . . . . 0.0 109.894 -179.741 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -151.32 124.02 8.52 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 110.017 -0.364 . . . . 0.0 110.017 178.84 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . 0.448 ' NH1' ' OD2' ' A' ' 80' ' ' ASP . 1.0 OUTLIER -152.15 133.64 14.58 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 119.833 -0.747 . . . . 0.0 112.91 179.67 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . 0.448 ' OD2' ' NH1' ' A' ' 79' ' ' ARG . 61.5 m-20 56.75 47.43 18.16 Favored 'General case' 0 N--CA 1.462 0.168 0 N-CA-C 114.131 1.16 . . . . 0.0 114.131 176.357 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 84.97 -28.35 4.59 Favored Glycine 0 CA--C 1.524 0.649 0 C-N-CA 120.425 -0.893 . . . . 0.0 113.311 177.043 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 4.5 mt -89.84 158.03 17.65 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 117.705 0.752 . . . . 0.0 110.567 -178.915 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 58.4 mt -129.95 135.59 48.49 Favored 'General case' 0 CA--C 1.517 -0.301 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.443 -179.13 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . 0.567 ' HA3' ' NE1' ' A' ' 77' ' ' TRP . . . -96.86 151.77 19.93 Favored Glycine 0 N--CA 1.451 -0.323 0 N-CA-C 109.517 -1.433 . . . . 0.0 109.517 178.522 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' PHE . . . . . 0.459 ' CG ' HD13 ' A' ' 73' ' ' ILE . 25.2 m-85 -145.56 132.32 20.03 Favored 'General case' 0 C--N 1.318 -0.804 0 C-N-CA 120.711 -0.396 . . . . 0.0 110.884 -179.205 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.464 ' O ' ' NE2' ' A' ' 88' ' ' GLN . 34.3 tt0 -104.04 126.58 51.27 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 179.614 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 39.1 t -69.23 122.2 18.37 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.005 0.431 . . . . 0.0 112.083 -178.486 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . 0.464 ' NE2' ' O ' ' A' ' 86' ' ' GLU . 51.6 mm-40 -95.28 -33.31 12.61 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.14 179.113 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -162.11 141.92 9.88 Favored 'General case' 0 C--O 1.223 -0.313 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.067 179.974 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . 0.66 ' CG1' ' HG ' ' A' ' 94' ' ' SER . 10.5 tt -145.05 141.17 23.01 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-O 121.237 0.541 . . . . 0.0 110.049 -179.467 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -59.44 141.52 54.48 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 115.319 -0.855 . . . . 0.0 112.382 -177.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 14.6 tp -54.21 -41.71 68.94 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 114.963 -1.017 . . . . 0.0 110.669 -179.549 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -65.49 -40.13 92.74 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 179.339 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' SER . . . . . 0.66 ' HG ' ' CG1' ' A' ' 90' ' ' ILE . 2.3 t -69.54 -35.01 75.06 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.149 179.392 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 36.1 mt -58.37 -38.35 68.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.802 -0.636 . . . . 0.0 109.821 -179.906 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -70.75 -37.98 73.46 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 120.383 -0.527 . . . . 0.0 111.051 -179.202 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 61.9 m-70 . . . . . 0 C--N 1.326 -0.426 0 C-N-CA 119.381 -0.927 . . . . 0.0 109.112 179.772 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.569 ' CD1' ' N ' ' A' ' 14' ' ' ILE . 1.4 mp . . . . . 0 CA--C 1.52 -0.178 0 CA-C-O 120.656 0.265 . . . . 0.0 110.455 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -95.46 119.72 34.46 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.459 0.647 . . . . 0.0 111.55 -179.883 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -150.02 155.12 39.35 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 114.904 -1.044 . . . . 0.0 108.293 177.891 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . 0.53 ' N ' ' OD1' ' A' ' 17' ' ' ASP . 17.9 p-10 -95.6 146.22 24.64 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 120.09 -0.644 . . . . 0.0 111.005 -178.626 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -178.65 174.9 1.14 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.244 179.588 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 3.5 t0 -96.07 133.91 39.75 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.854 -179.669 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.539 ' O ' ' O ' ' A' ' 31' ' ' VAL . 27.7 p -133.71 152.51 51.9 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.253 0.549 . . . . 0.0 110.358 178.729 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.482 ' OE1' ' NH2' ' A' ' 28' ' ' ARG . 6.7 mm-40 -131.34 151.96 51.04 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 108.976 -0.75 . . . . 0.0 108.976 179.533 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . 0.416 ' HA ' ' O ' ' A' ' 58' ' ' GLU . 22.6 mt -134.44 136.25 53.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 C-N-CA 120.053 -0.659 . . . . 0.0 111.304 -179.376 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -124.16 123.27 39.93 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.473 -0.785 . . . . 0.0 111.402 -179.142 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.536 ' OE1' ' CZ ' ' A' ' 57' ' ' PHE . 24.1 tt0 -128.12 102.07 6.56 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.538 -0.755 . . . . 0.0 109.811 178.61 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 80.97 -125.8 7.06 Favored Glycine 0 CA--C 1.522 0.528 0 N-CA-C 109.974 -1.25 . . . . 0.0 109.974 -178.894 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -100.55 12.19 37.86 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.954 0.407 . . . . 0.0 110.014 179.489 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.572 ' HB3' ' CZ2' ' A' ' 29' ' ' TRP . 24.1 mtt85 -114.27 135.84 53.62 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 112.968 0.729 . . . . 0.0 112.968 -178.062 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.482 ' NH2' ' OE1' ' A' ' 21' ' ' GLU . 72.0 ttt-85 -128.69 151.38 49.59 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.017 178.77 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.572 ' CZ2' ' HB3' ' A' ' 27' ' ' ARG . 6.5 m-90 -149.25 156.56 42.31 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.59 -179.249 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -100.83 140.07 35.64 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.09 -0.504 . . . . 0.0 109.676 179.321 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.539 ' O ' ' O ' ' A' ' 20' ' ' SER . 12.5 m -149.92 158.45 5.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-O 121.324 0.583 . . . . 0.0 111.19 -179.267 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.69 ' H ' ' CD2' ' A' ' 32' ' ' LEU . 1.0 OUTLIER -99.02 129.95 45.33 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 108.577 -0.897 . . . . 0.0 108.577 178.556 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.2 tt -95.18 125.51 39.87 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 120.306 -0.558 . . . . 0.0 109.787 -179.62 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' HIS . . . . . 0.484 ' HE2' ' CD1' ' A' ' 32' ' ' LEU . 20.3 m-70 -90.62 -26.17 19.77 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.402 -0.817 . . . . 0.0 111.714 -178.455 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -172.16 161.31 5.42 Favored 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 119.544 -0.862 . . . . 0.0 111.271 177.403 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 8.4 p -145.17 168.59 8.59 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.823 -178.792 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 6.4 t -141.77 169.66 17.17 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 108.045 -1.094 . . . . 0.0 108.045 178.801 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 5.7 tt -67.69 -1.97 6.13 Favored 'General case' 0 C--N 1.323 -0.556 0 C-N-CA 119.872 -0.731 . . . . 0.0 110.69 -179.325 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . 0.569 ' CE1' ' O ' ' A' ' 87' ' ' CYS . 58.1 t60 -156.98 35.42 0.29 Allowed 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 120.777 -0.369 . . . . 0.0 111.501 -179.756 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -175.96 158.98 26.17 Favored Glycine 0 CA--C 1.527 0.787 0 N-CA-C 111.241 -0.744 . . . . 0.0 111.241 179.811 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -149.36 149.58 14.65 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.388 0 CA-C-O 121.104 0.478 . . . . 0.0 111.532 -178.963 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.7 tt -122.09 141.86 50.96 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 115.527 -0.761 . . . . 0.0 109.105 178.519 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 20.0 m -145.26 174.98 2.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-O 121.263 0.554 . . . . 0.0 111.684 -179.562 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -98.72 145.63 17.8 Favored Glycine 0 CA--C 1.528 0.846 0 N-CA-C 109.808 -1.317 . . . . 0.0 109.808 178.811 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 47.5 tt0 -87.22 113.27 53.0 Favored Pre-proline 0 N--CA 1.463 0.22 0 CA-C-N 117.611 0.706 . . . . 0.0 111.699 -178.654 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 96.9 Cg_endo -83.96 161.35 13.82 Favored 'Trans proline' 0 C--N 1.306 -1.682 0 C-N-CA 121.56 1.507 . . . . 0.0 111.372 179.031 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.535 ' CD ' ' H ' ' A' ' 47' ' ' GLN . 0.0 OUTLIER -65.12 -26.24 68.11 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 112.388 0.514 . . . . 0.0 112.388 -178.797 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . 0.534 ' O ' ' N ' ' A' ' 50' ' ' ASN . 1.3 p30 -86.65 8.42 22.45 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 112.085 0.402 . . . . 0.0 112.085 -178.619 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' TRP . . . . . 0.435 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 58.9 t-105 -60.52 68.56 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 111.786 0.291 . . . . 0.0 111.786 -179.69 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . 0.534 ' N ' ' O ' ' A' ' 48' ' ' ASP . 0.3 OUTLIER -93.15 78.77 4.54 Favored 'General case' 0 C--N 1.324 -0.509 0 C-N-CA 120.129 -0.628 . . . . 0.0 109.763 178.607 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -145.02 160.17 27.99 Favored Glycine 0 CA--C 1.525 0.708 0 N-CA-C 111.047 -0.821 . . . . 0.0 111.047 -179.611 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 30.1 t0 -95.31 110.89 52.98 Favored Pre-proline 0 CA--C 1.533 0.296 0 C-N-CA 121.267 -0.173 . . . . 0.0 110.924 -179.646 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_exo -47.79 -22.35 3.13 Favored 'Trans proline' 0 N--CA 1.493 1.485 0 C-N-CA 122.362 2.041 . . . . 0.0 112.357 179.614 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 83.7 mt-30 -76.77 -23.85 52.93 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.382 -179.411 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.521 ' O ' ' CE1' ' A' ' 57' ' ' PHE . 15.9 mtp180 -95.46 151.88 38.89 Favored Pre-proline 0 CA--C 1.531 0.227 0 N-CA-C 110.08 -0.341 . . . . 0.0 110.08 179.987 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . 0.454 ' O ' ' OE1' ' A' ' 24' ' ' GLN . 35.4 Cg_endo -64.85 160.87 38.8 Favored 'Trans proline' 0 N--CA 1.495 1.579 0 C-N-CA 122.852 2.368 . . . . 0.0 113.331 -178.497 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . 0.536 ' CZ ' ' OE1' ' A' ' 24' ' ' GLN . 57.8 m-85 -130.71 154.66 47.72 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 114.997 -1.001 . . . . 0.0 109.192 179.486 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.416 ' O ' ' HA ' ' A' ' 22' ' ' ILE . 16.5 mt-10 -119.31 136.01 54.44 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 108.863 -0.792 . . . . 0.0 108.863 178.667 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . 0.496 ' C ' ' HE ' ' A' ' 60' ' ' ARG . . . -120.47 139.43 52.88 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.281 0.563 . . . . 0.0 112.507 -177.871 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . 0.496 ' HE ' ' C ' ' A' ' 59' ' ' ALA . 2.4 mmp_? -123.96 127.67 48.29 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 108.418 -0.956 . . . . 0.0 108.418 177.304 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 9.6 mp -105.78 150.36 25.61 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 120.701 -0.4 . . . . 0.0 110.386 -179.234 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' TYR . . . . . 0.446 ' CD1' ' N ' ' A' ' 62' ' ' TYR . 18.3 m-85 -133.9 108.99 8.75 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.46 179.643 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.427 ' C ' ' CD2' ' A' ' 63' ' ' LEU . 2.4 tt -104.97 -84.7 0.49 Allowed 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.582 -0.736 . . . . 0.0 109.207 179.382 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . 0.416 ' H ' ' HB3' ' A' ' 63' ' ' LEU . . . -75.72 178.11 48.69 Favored Glycine 0 CA--C 1.52 0.384 0 N-CA-C 109.23 -1.548 . . . . 0.0 109.23 178.508 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 11.6 mt -73.34 -33.8 65.31 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 119.949 -0.7 . . . . 0.0 110.31 -179.588 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -100.87 9.31 42.48 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.822 179.913 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 8.7 t -104.94 94.97 3.43 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-O 121.334 0.588 . . . . 0.0 111.901 -178.824 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 6.1 tp -112.37 117.46 32.51 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 177.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . 0.404 HG22 ' OG ' ' A' ' 94' ' ' SER . 3.4 mt -112.63 144.78 19.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 120.946 0.403 . . . . 0.0 111.148 -178.942 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . 0.401 ' N ' HG22 ' A' ' 69' ' ' ILE . 5.9 mtt85 -127.98 131.6 49.24 Favored 'General case' 0 C--O 1.239 0.506 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.75 179.344 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -142.95 149.03 37.85 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.211 -179.822 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 17.6 tp10 -100.44 134.2 43.74 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 107.635 -1.246 . . . . 0.0 107.635 178.123 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.407 HD11 ' CG ' ' A' ' 85' ' ' PHE . 4.5 pt -144.1 157.34 15.63 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.157 0 C-N-CA 119.084 -1.046 . . . . 0.0 113.138 -177.707 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 29.7 m -122.06 152.86 39.36 Favored 'General case' 0 N--CA 1.463 0.225 0 CA-C-N 115.012 -0.995 . . . . 0.0 109.965 178.877 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -65.31 120.31 12.55 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-O 120.964 0.411 . . . . 0.0 110.398 -179.197 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -97.31 -37.63 9.97 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.166 177.53 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' TRP . . . . . 0.707 ' NE1' ' HA3' ' A' ' 84' ' ' GLY . 69.6 p-90 -171.12 169.91 6.33 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.745 179.725 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -151.45 123.9 8.37 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.178 178.459 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 21.6 ttm-85 -152.36 131.44 12.66 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 120.308 -0.557 . . . . 0.0 112.35 179.441 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 19.5 t70 55.95 47.28 20.31 Favored 'General case' 0 N--CA 1.466 0.325 0 N-CA-C 113.634 0.976 . . . . 0.0 113.634 176.257 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 68.74 12.28 64.2 Favored Glycine 0 CA--C 1.523 0.549 0 C-N-CA 120.325 -0.941 . . . . 0.0 111.594 178.603 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 32.4 mt -114.36 139.93 49.07 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 178.156 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 27.6 mt -128.45 135.28 49.26 Favored 'General case' 0 CA--C 1.512 -0.515 0 C-N-CA 120.298 -0.561 . . . . 0.0 111.51 -178.805 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . 0.707 ' HA3' ' NE1' ' A' ' 77' ' ' TRP . . . -103.49 155.39 17.92 Favored Glycine 0 N--CA 1.446 -0.667 0 N-CA-C 109.179 -1.568 . . . . 0.0 109.179 178.436 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' PHE . . . . . 0.407 ' CG ' HD11 ' A' ' 73' ' ' ILE . 49.6 m-85 -145.75 136.79 24.66 Favored 'General case' 0 C--N 1.311 -1.093 0 C-N-CA 120.792 -0.363 . . . . 0.0 110.417 -179.535 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.444 ' O ' ' NE2' ' A' ' 88' ' ' GLN . 4.6 pt-20 -103.89 127.76 51.4 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 179.232 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . 0.569 ' O ' ' CE1' ' A' ' 39' ' ' HIS . 4.8 t -75.73 126.08 30.3 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.889 0.376 . . . . 0.0 111.985 -178.305 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . 0.444 ' NE2' ' O ' ' A' ' 86' ' ' GLU . 0.0 OUTLIER -102.1 -28.5 12.3 Favored 'General case' 0 N--CA 1.462 0.143 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.49 179.318 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . 0.554 ' ND1' ' N ' ' A' ' 90' ' ' ILE . 0.1 OUTLIER -161.0 141.26 11.1 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.958 0.409 . . . . 0.0 110.377 179.712 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . 0.56 ' CD1' ' OG ' ' A' ' 94' ' ' SER . 7.9 tt -146.01 141.34 21.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.186 -179.422 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . 0.526 ' N ' ' OD1' ' A' ' 91' ' ' ASP . 0.3 OUTLIER -55.24 143.15 28.88 Favored 'General case' 0 N--CA 1.462 0.139 0 CA-C-N 115.381 -0.827 . . . . 0.0 111.98 -178.293 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 59.2 tp -54.08 -41.66 68.46 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.066 -0.97 . . . . 0.0 109.705 -179.579 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -67.88 -38.33 82.91 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.001 -0.545 . . . . 0.0 109.554 179.081 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' SER . . . . . 0.56 ' OG ' ' CD1' ' A' ' 90' ' ' ILE . 5.6 t -68.25 -35.14 77.45 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.946 179.368 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 44.2 mt -58.74 -38.26 70.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.786 -0.643 . . . . 0.0 109.702 179.507 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -71.42 -42.11 68.7 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.947 -179.728 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 61.3 m-70 . . . . . 0 C--N 1.325 -0.475 0 C-N-CA 119.745 -0.782 . . . . 0.0 109.718 -179.996 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 41.8 mm . . . . . 0 CA--C 1.521 -0.169 0 CA-C-O 120.594 0.235 . . . . 0.0 110.491 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -93.83 119.96 33.46 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.274 0.559 . . . . 0.0 110.95 179.834 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 5.0 p90 -149.99 158.08 43.8 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 108.522 -0.918 . . . . 0.0 108.522 178.07 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 17.8 p-10 -95.6 145.92 24.87 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 120.185 -0.606 . . . . 0.0 110.746 -179.126 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -178.94 177.08 0.86 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.99 -0.55 . . . . 0.0 109.81 179.52 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 37.3 t0 -96.39 133.27 41.01 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 120.763 -0.375 . . . . 0.0 110.783 -179.679 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.56 ' O ' ' O ' ' A' ' 31' ' ' VAL . 2.9 p -132.97 150.61 52.15 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.371 0.605 . . . . 0.0 110.106 178.734 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 28.9 mm-40 -129.44 135.74 49.05 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.453 -0.794 . . . . 0.0 108.962 179.82 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -117.59 136.13 55.76 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.438 0 C-N-CA 120.227 -0.589 . . . . 0.0 110.376 -179.66 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.434 ' CD2' HH12 ' A' ' 60' ' ' ARG . 0.1 OUTLIER -125.38 123.2 38.81 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.518 -0.764 . . . . 0.0 111.08 -179.167 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.527 ' OE1' ' CZ ' ' A' ' 57' ' ' PHE . 20.1 tt0 -130.05 102.71 6.38 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.382 -0.826 . . . . 0.0 109.493 178.419 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 78.31 -127.93 8.44 Favored Glycine 0 CA--C 1.522 0.476 0 N-CA-C 109.672 -1.371 . . . . 0.0 109.672 -178.69 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.47 ' OE1' ' O ' ' A' ' 26' ' ' GLU . 2.5 pp20? -99.77 11.25 39.72 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.627 0.251 . . . . 0.0 110.387 179.468 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.525 ' HB3' ' CZ2' ' A' ' 29' ' ' TRP . 2.5 mpt_? -110.89 132.08 54.51 Favored 'General case' 0 CA--C 1.522 -0.134 0 CA-C-O 121.032 0.444 . . . . 0.0 111.872 -179.536 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.597 ' NH2' ' NH2' ' A' ' 60' ' ' ARG . 5.9 ttt180 -126.88 146.49 50.27 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.767 -0.651 . . . . 0.0 109.776 179.227 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.553 ' NE1' ' O ' ' A' ' 48' ' ' ASP . 6.5 m-90 -144.63 155.1 43.45 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.464 -179.097 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -100.24 128.62 46.27 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.785 -0.643 . . . . 0.0 109.934 179.734 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.56 ' O ' ' O ' ' A' ' 20' ' ' SER . 35.3 m -140.83 155.83 22.36 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-O 121.109 0.481 . . . . 0.0 111.202 -179.703 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.41 HD12 ' HE2' ' A' ' 34' ' ' HIS . 0.3 OUTLIER -94.03 131.34 39.62 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 108.553 -0.906 . . . . 0.0 108.553 178.375 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.5 tt -89.91 127.22 35.97 Favored 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 120.298 -0.561 . . . . 0.0 109.852 -179.735 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' HIS . . . . . 0.41 ' HE2' HD12 ' A' ' 32' ' ' LEU . 74.0 m-70 -92.45 -27.32 17.54 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.501 -0.772 . . . . 0.0 111.581 -178.634 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 -175.16 162.32 2.99 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 119.693 -0.803 . . . . 0.0 111.536 177.599 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 4.5 p -145.29 168.55 8.4 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.179 0 CA-C-N 115.503 -0.771 . . . . 0.0 111.094 -179.182 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 20.1 t -142.08 169.71 17.07 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 107.738 -1.208 . . . . 0.0 107.738 178.474 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.417 ' H ' HD22 ' A' ' 38' ' ' LEU . 0.3 OUTLIER -66.31 -0.72 2.78 Favored 'General case' 0 C--N 1.322 -0.598 0 C-N-CA 119.552 -0.859 . . . . 0.0 110.874 -179.256 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . 0.5 ' CE1' ' O ' ' A' ' 87' ' ' CYS . 47.6 t60 -158.9 38.16 0.22 Allowed 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 120.639 -0.424 . . . . 0.0 111.566 -179.828 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -177.46 158.16 23.33 Favored Glycine 0 CA--C 1.528 0.906 0 C-N-CA 120.606 -0.807 . . . . 0.0 111.422 179.871 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -148.49 148.95 15.56 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.374 0 CA-C-O 121.421 0.629 . . . . 0.0 111.768 -178.736 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.443 HD21 ' N ' ' A' ' 43' ' ' VAL . 0.6 OUTLIER -122.39 138.5 54.51 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 115.01 -0.996 . . . . 0.0 108.947 178.96 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . 0.443 ' N ' HD21 ' A' ' 42' ' ' LEU . 23.6 m -142.83 174.58 5.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-O 121.16 0.505 . . . . 0.0 111.491 -179.695 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -95.13 144.9 17.47 Favored Glycine 0 CA--C 1.529 0.923 0 N-CA-C 109.528 -1.429 . . . . 0.0 109.528 178.285 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . 0.557 ' NE2' ' O ' ' A' ' 46' ' ' PRO . 18.0 tm0? -87.58 115.5 63.07 Favored Pre-proline 0 N--CA 1.464 0.264 0 CA-C-N 118.121 0.96 . . . . 0.0 112.099 -178.523 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.557 ' O ' ' NE2' ' A' ' 45' ' ' GLN . 96.1 Cg_endo -85.97 161.96 10.31 Favored 'Trans proline' 0 C--N 1.308 -1.588 0 C-N-CA 121.562 1.508 . . . . 0.0 111.213 178.587 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.2 mt-30 -65.14 -40.36 94.29 Favored 'General case' 0 N--CA 1.466 0.37 0 N-CA-C 112.585 0.587 . . . . 0.0 112.585 -178.709 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . 0.572 ' O ' ' N ' ' A' ' 50' ' ' ASN . 6.4 m-20 -72.89 8.88 1.33 Allowed 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 112.035 0.383 . . . . 0.0 112.035 -178.479 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' TRP . . . . . 0.46 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 64.5 t-105 -58.97 69.06 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.729 -0.214 . . . . 0.0 111.531 -179.878 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . 0.572 ' N ' ' O ' ' A' ' 48' ' ' ASP . 0.1 OUTLIER -93.25 78.55 4.5 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 120.201 -0.6 . . . . 0.0 109.531 178.812 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . 0.412 ' CA ' HE21 ' A' ' 24' ' ' GLN . . . -142.54 160.16 27.3 Favored Glycine 0 CA--C 1.52 0.401 0 N-CA-C 111.295 -0.722 . . . . 0.0 111.295 -179.557 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -95.02 121.97 61.21 Favored Pre-proline 0 C--N 1.325 -0.465 0 CA-C-N 115.367 -0.416 . . . . 0.0 110.662 -179.637 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 17.4 Cg_endo -60.15 -22.48 70.17 Favored 'Trans proline' 0 N--CA 1.494 1.519 0 C-N-CA 122.259 1.973 . . . . 0.0 111.564 -179.742 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 6.4 mm-40 -77.73 -21.68 51.52 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.472 179.927 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.511 ' O ' ' CE1' ' A' ' 57' ' ' PHE . 72.2 mtt-85 -97.65 149.86 36.17 Favored Pre-proline 0 CA--C 1.53 0.208 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.108 179.74 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . 0.411 ' O ' ' OE1' ' A' ' 24' ' ' GLN . 37.5 Cg_endo -65.56 160.93 40.74 Favored 'Trans proline' 0 N--CA 1.497 1.683 0 C-N-CA 123.116 2.544 . . . . 0.0 113.476 -179.093 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . 0.527 ' CZ ' ' OE1' ' A' ' 24' ' ' GLN . 26.9 m-85 -129.58 156.61 43.91 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 114.905 -1.043 . . . . 0.0 108.599 179.076 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 58.6 mt-10 -122.54 139.67 53.63 Favored 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 109.238 -0.652 . . . . 0.0 109.238 178.604 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -121.06 137.4 54.67 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.117 0.484 . . . . 0.0 111.74 -178.223 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . 0.597 ' NH2' ' NH2' ' A' ' 28' ' ' ARG . 51.9 mtm-85 -123.19 127.84 49.2 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 177.524 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -107.9 151.1 26.23 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 120.493 -0.483 . . . . 0.0 111.066 -178.614 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 28.9 m-85 -134.0 109.67 9.15 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.17 179.527 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.443 ' HB3' ' H ' ' A' ' 64' ' ' GLY . 1.6 tt -104.63 -82.7 0.51 Allowed 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 115.838 -0.619 . . . . 0.0 109.398 179.529 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . 0.443 ' H ' ' HB3' ' A' ' 63' ' ' LEU . . . -77.76 179.27 51.3 Favored Glycine 0 CA--C 1.523 0.533 0 N-CA-C 109.416 -1.474 . . . . 0.0 109.416 178.568 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.561 ' CD2' ' N ' ' A' ' 65' ' ' LEU . 1.9 mm? -73.78 -31.89 63.52 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 119.925 -0.71 . . . . 0.0 110.129 -179.752 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.9 p30 -103.44 9.22 37.83 Favored 'General case' 0 C--N 1.332 -0.17 0 C-N-CA 122.775 0.43 . . . . 0.0 111.198 -179.927 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 8.7 t -105.07 96.37 4.54 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.37 0 CA-C-O 121.2 0.524 . . . . 0.0 111.807 -178.78 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 1.8 tp -114.37 118.48 33.98 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 178.678 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 2.9 mt -113.9 145.0 20.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.339 -0.392 . . . . 0.0 111.353 -178.791 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 8.4 ptm180 -128.41 131.06 48.48 Favored 'General case' 0 C--O 1.24 0.562 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.078 179.033 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -139.59 147.98 41.88 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.607 -0.724 . . . . 0.0 109.953 179.451 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -112.57 118.46 35.16 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 107.661 -1.237 . . . . 0.0 107.661 178.077 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.449 ' O ' ' O ' ' A' ' 57' ' ' PHE . 3.3 pt -129.32 168.02 23.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 N-CA-C 113.466 0.913 . . . . 0.0 113.466 -176.146 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 58.7 m -121.94 150.74 41.58 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 114.961 -1.018 . . . . 0.0 109.807 178.837 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.426 ' CD1' ' CE1' ' A' ' 85' ' ' PHE . 14.3 tp -66.6 123.58 20.47 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 121.268 0.556 . . . . 0.0 110.175 -179.837 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -98.15 -45.1 6.34 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 115.448 -0.796 . . . . 0.0 111.306 178.533 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' TRP . . . . . 0.491 ' CE2' ' HA3' ' A' ' 84' ' ' GLY . 66.5 p-90 -167.82 167.41 13.05 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.224 -178.965 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -146.4 123.85 11.7 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 109.824 -0.435 . . . . 0.0 109.824 178.622 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 41.4 ttt180 -152.11 133.54 14.54 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 119.917 -0.713 . . . . 0.0 112.804 179.843 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 56.77 46.91 19.1 Favored 'General case' 0 N--CA 1.464 0.233 0 N-CA-C 114.034 1.124 . . . . 0.0 114.034 176.763 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 83.16 -26.82 4.21 Favored Glycine 0 CA--C 1.523 0.569 0 C-N-CA 120.417 -0.897 . . . . 0.0 113.01 177.166 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 4.7 mt -89.56 153.34 20.85 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 117.528 0.664 . . . . 0.0 110.514 -179.06 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 79.4 mt -126.88 135.62 51.21 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.995 -179.256 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . 0.491 ' HA3' ' CE2' ' A' ' 77' ' ' TRP . . . -106.07 149.14 16.61 Favored Glycine 0 N--CA 1.454 -0.123 0 N-CA-C 109.75 -1.34 . . . . 0.0 109.75 178.906 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' PHE . . . . . 0.426 ' CE1' ' CD1' ' A' ' 75' ' ' LEU . 78.7 m-85 -142.05 142.93 32.89 Favored 'General case' 0 C--N 1.32 -0.697 0 C-N-CA 120.824 -0.35 . . . . 0.0 110.626 -179.748 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 23.9 tt0 -103.73 128.59 51.08 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 179.246 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . 0.5 ' O ' ' CE1' ' A' ' 39' ' ' HIS . 14.7 t -68.43 120.85 15.17 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.087 0.47 . . . . 0.0 111.84 -178.463 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -95.52 -36.98 11.08 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.366 179.561 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . 0.569 ' ND1' ' N ' ' A' ' 90' ' ' ILE . 0.0 OUTLIER -161.74 141.92 10.43 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.185 179.981 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . 0.569 ' N ' ' ND1' ' A' ' 89' ' ' HIS . 6.3 tt -145.22 140.87 22.74 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-O 121.239 0.543 . . . . 0.0 110.058 -179.251 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -55.44 143.62 28.41 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-N 115.244 -0.889 . . . . 0.0 112.109 -178.325 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 3.8 tt -54.49 -42.07 70.31 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.166 -0.925 . . . . 0.0 109.956 -179.686 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -68.89 -38.7 79.8 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.604 -0.517 . . . . 0.0 109.604 179.206 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 7.4 m -64.75 -36.2 83.52 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.779 -0.646 . . . . 0.0 109.59 179.14 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 24.1 mt -59.0 -38.36 73.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.648 -0.705 . . . . 0.0 109.998 179.677 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -71.25 -42.29 69.0 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 120.312 -0.555 . . . . 0.0 111.283 -179.189 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 62.0 m-70 . . . . . 0 C--N 1.325 -0.486 0 C-N-CA 119.638 -0.825 . . . . 0.0 109.49 -179.757 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 39.5 mm . . . . . 0 C--O 1.231 0.111 0 N-CA-C 110.02 -0.363 . . . . 0.0 110.02 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -95.07 120.04 34.6 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.513 0.673 . . . . 0.0 111.649 -179.351 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 2.2 p90 -149.99 158.05 43.77 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 108.146 -1.057 . . . . 0.0 108.146 177.659 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . 0.482 ' OD1' ' N ' ' A' ' 18' ' ' ALA . 23.7 t0 -95.62 146.18 24.68 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 120.049 -0.661 . . . . 0.0 111.085 -178.822 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . 0.482 ' N ' ' OD1' ' A' ' 17' ' ' ASP . . . -179.16 175.79 0.93 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.06 179.392 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -96.17 134.11 39.65 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.688 -179.676 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.639 ' O ' ' O ' ' A' ' 31' ' ' VAL . 5.8 p -135.47 157.21 47.46 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.142 179.044 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.485 ' HB3' ' NH1' ' A' ' 28' ' ' ARG . 50.2 mt-10 -142.04 145.56 34.52 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 179.168 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 28.1 mt -123.01 136.39 59.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-O 121.168 0.508 . . . . 0.0 111.787 -178.235 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -119.58 123.38 43.79 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.562 -0.744 . . . . 0.0 110.603 179.919 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.425 ' O ' ' OE1' ' A' ' 24' ' ' GLN . 1.5 tm0? -130.51 101.91 5.92 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.404 -0.817 . . . . 0.0 109.671 178.929 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 80.33 -126.79 7.59 Favored Glycine 0 CA--C 1.524 0.624 0 N-CA-C 109.949 -1.26 . . . . 0.0 109.949 -178.715 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.3 pt-20 -100.66 11.96 38.42 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.872 0.367 . . . . 0.0 110.047 179.57 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.492 ' HB3' ' CZ2' ' A' ' 29' ' ' TRP . 38.4 mtt-85 -114.58 136.0 53.52 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 112.771 0.656 . . . . 0.0 112.771 -178.036 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.76 ' CG ' HH11 ' A' ' 28' ' ' ARG . 0.0 OUTLIER -128.11 149.64 50.32 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.261 179.1 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.539 ' NE1' ' O ' ' A' ' 48' ' ' ASP . 6.7 m-90 -146.74 155.03 42.08 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.454 -0.794 . . . . 0.0 110.297 -179.477 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 11.9 mt-10 -100.33 136.61 39.95 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.042 -0.526 . . . . 0.0 109.912 179.502 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.639 ' O ' ' O ' ' A' ' 20' ' ' SER . 17.1 m -147.38 156.93 9.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-O 121.25 0.547 . . . . 0.0 111.167 -179.552 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.678 ' H ' ' CD2' ' A' ' 32' ' ' LEU . 1.4 pt? -95.88 130.29 42.88 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 108.817 -0.808 . . . . 0.0 108.817 178.498 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.6 tt -91.7 126.0 36.63 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.267 0.556 . . . . 0.0 110.092 -179.527 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 74.5 m-70 -91.95 -27.45 17.87 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.276 -0.875 . . . . 0.0 111.803 -178.531 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -173.7 161.14 3.85 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 119.574 -0.85 . . . . 0.0 111.317 177.576 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 5.6 p -144.57 168.84 9.51 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.118 0 CA-C-N 115.584 -0.735 . . . . 0.0 111.067 -179.09 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' SER . . . . . 0.405 ' C ' ' H ' ' A' ' 39' ' ' HIS . 10.8 m -142.28 169.65 17.19 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 107.982 -1.118 . . . . 0.0 107.982 178.518 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.426 HD13 ' H ' ' A' ' 38' ' ' LEU . 2.0 mp -65.57 -1.21 2.45 Favored 'General case' 0 C--N 1.324 -0.517 0 C-N-CA 119.583 -0.847 . . . . 0.0 110.305 -179.803 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . 0.479 ' CD2' ' O ' ' A' ' 39' ' ' HIS . 47.7 p-80 -163.11 41.25 0.1 Allowed 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 120.748 -0.381 . . . . 0.0 111.469 179.813 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -176.07 152.24 12.66 Favored Glycine 0 CA--C 1.525 0.661 0 N-CA-C 110.997 -0.841 . . . . 0.0 110.997 179.835 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -147.31 148.67 16.31 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.208 0 CA-C-O 121.495 0.664 . . . . 0.0 111.647 -179.135 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -121.76 140.33 52.47 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 114.836 -1.075 . . . . 0.0 108.719 178.977 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.2 m -144.11 175.13 3.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-O 121.328 0.585 . . . . 0.0 111.752 -179.441 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -97.15 144.57 17.41 Favored Glycine 0 CA--C 1.529 0.938 0 N-CA-C 109.247 -1.541 . . . . 0.0 109.247 178.01 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . 0.523 HE21 ' C ' ' A' ' 45' ' ' GLN . 0.0 OUTLIER -87.42 115.6 63.33 Favored Pre-proline 0 N--CA 1.464 0.274 0 CA-C-N 118.127 0.963 . . . . 0.0 111.75 -178.431 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 79.4 Cg_endo -86.07 162.22 10.16 Favored 'Trans proline' 0 C--N 1.307 -1.65 0 C-N-CA 121.765 1.643 . . . . 0.0 111.462 178.931 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.498 ' OE1' ' N ' ' A' ' 47' ' ' GLN . 25.9 mp0 -65.28 -40.24 93.64 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 112.153 0.427 . . . . 0.0 112.153 -179.0 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . 0.539 ' O ' ' NE1' ' A' ' 29' ' ' TRP . 16.4 m-20 -72.56 8.41 1.44 Allowed 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.05 0.389 . . . . 0.0 112.05 -178.538 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' TRP . . . . . 0.448 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 60.7 t-105 -61.45 68.43 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 111.696 0.258 . . . . 0.0 111.696 -179.657 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . 0.52 ' N ' ' O ' ' A' ' 48' ' ' ASP . 0.5 OUTLIER -93.28 78.98 4.47 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 120.023 -0.671 . . . . 0.0 109.682 178.688 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -141.77 158.22 26.57 Favored Glycine 0 CA--C 1.525 0.696 0 N-CA-C 111.369 -0.692 . . . . 0.0 111.369 -179.501 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 33.7 t0 -93.99 111.49 53.26 Favored Pre-proline 0 CA--C 1.533 0.311 0 CA-C-N 115.744 -0.228 . . . . 0.0 110.774 -179.89 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 76.7 Cg_exo -47.24 -22.28 2.31 Favored 'Trans proline' 0 N--CA 1.496 1.63 0 C-N-CA 122.597 2.198 . . . . 0.0 112.413 179.858 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 37.3 mt-30 -79.13 -24.01 43.64 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.82 -178.581 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.55 ' O ' ' CE1' ' A' ' 57' ' ' PHE . 3.0 mpt_? -94.82 151.4 38.99 Favored Pre-proline 0 C--N 1.33 -0.257 0 C-N-CA 120.581 -0.448 . . . . 0.0 109.962 179.69 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 35.3 Cg_endo -64.3 160.86 36.83 Favored 'Trans proline' 0 N--CA 1.495 1.6 0 C-N-CA 122.816 2.344 . . . . 0.0 113.285 -178.77 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . 0.55 ' CE1' ' O ' ' A' ' 55' ' ' ARG . 44.5 m-85 -130.5 155.68 46.06 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 114.991 -1.004 . . . . 0.0 109.005 179.419 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -121.61 134.46 55.0 Favored 'General case' 0 C--O 1.22 -0.452 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 178.728 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -115.86 135.66 53.79 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.113 0.483 . . . . 0.0 112.108 -178.454 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . 0.426 ' N ' ' HD3' ' A' ' 60' ' ' ARG . 2.4 mpt_? -121.35 127.72 51.54 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 177.361 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 10.6 mt -108.93 137.15 47.3 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.914 0.387 . . . . 0.0 110.636 -179.061 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' TYR . . . . . 0.613 ' CD1' ' N ' ' A' ' 62' ' ' TYR . 1.0 OUTLIER -120.34 110.21 16.28 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.348 179.785 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.417 ' C ' ' CD2' ' A' ' 63' ' ' LEU . 2.2 tt -104.54 -84.55 0.48 Allowed 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.413 179.401 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -76.52 -176.89 43.17 Favored Glycine 0 CA--C 1.521 0.455 0 N-CA-C 109.503 -1.439 . . . . 0.0 109.503 178.62 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 3.2 mt -76.11 -32.22 59.07 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.015 -0.674 . . . . 0.0 110.319 -179.703 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . 0.446 ' N ' ' OD1' ' A' ' 66' ' ' ASP . 1.3 m-20 -104.06 8.8 36.58 Favored 'General case' 0 C--N 1.332 -0.191 0 C-N-CA 122.759 0.424 . . . . 0.0 111.105 -179.913 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 9.3 t -103.34 95.05 3.54 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.296 0 CA-C-O 121.529 0.681 . . . . 0.0 111.8 -178.759 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -112.15 117.74 33.43 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 114.753 -1.112 . . . . 0.0 108.259 178.208 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 6.0 mt -113.9 143.62 23.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.887 0.375 . . . . 0.0 110.562 -179.043 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 11.6 mtm180 -128.26 131.26 48.76 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.914 179.191 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 2.2 mtp -140.39 148.88 41.92 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.917 -0.583 . . . . 0.0 109.945 179.651 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 12.0 tm-20 -102.39 134.71 45.26 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 107.48 -1.304 . . . . 0.0 107.48 178.247 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.413 HD12 ' CG ' ' A' ' 85' ' ' PHE . 5.3 pt -143.97 157.46 15.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 N-CA-C 113.472 0.916 . . . . 0.0 113.472 -177.352 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -121.18 150.17 41.71 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 114.759 -1.109 . . . . 0.0 109.444 178.604 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.48 ' CD1' ' CZ ' ' A' ' 85' ' ' PHE . 8.7 tp -66.71 123.76 21.01 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.265 0.555 . . . . 0.0 110.242 -179.638 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -98.0 -43.99 6.84 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 115.05 -0.977 . . . . 0.0 111.011 178.138 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' TRP . . . . . 0.563 ' NE1' ' HA3' ' A' ' 84' ' ' GLY . 68.0 p-90 -168.63 168.06 11.06 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.047 -179.13 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -146.45 123.72 11.57 Favored 'General case' 0 N--CA 1.464 0.257 0 N-CA-C 109.804 -0.443 . . . . 0.0 109.804 178.291 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 6.7 ttt-85 -152.26 133.93 14.69 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 119.922 -0.711 . . . . 0.0 112.906 179.979 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 56.64 47.16 18.95 Favored 'General case' 0 N--CA 1.465 0.285 0 N-CA-C 113.649 0.981 . . . . 0.0 113.649 176.752 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 81.78 -26.49 3.66 Favored Glycine 0 CA--C 1.522 0.529 0 C-N-CA 120.506 -0.854 . . . . 0.0 113.104 177.386 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 4.7 mt -89.6 153.79 20.48 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 117.685 0.742 . . . . 0.0 110.447 -179.289 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 43.5 mt -126.27 135.5 51.62 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.981 -179.395 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . 0.563 ' HA3' ' NE1' ' A' ' 77' ' ' TRP . . . -98.83 152.61 19.72 Favored Glycine 0 N--CA 1.451 -0.31 0 N-CA-C 109.949 -1.26 . . . . 0.0 109.949 178.963 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' PHE . . . . . 0.48 ' CZ ' ' CD1' ' A' ' 75' ' ' LEU . 40.7 m-85 -145.51 136.69 24.85 Favored 'General case' 0 C--N 1.319 -0.753 0 C-N-CA 120.673 -0.411 . . . . 0.0 111.017 -179.227 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.458 ' O ' ' NE2' ' A' ' 88' ' ' GLN . 31.5 tt0 -103.66 127.61 51.08 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 179.231 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 3.7 t -73.76 124.81 26.76 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.062 0.458 . . . . 0.0 112.042 -178.445 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . 0.458 ' NE2' ' O ' ' A' ' 86' ' ' GLU . 39.1 mm-40 -99.41 -32.12 11.31 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.692 -0.685 . . . . 0.0 110.228 179.277 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . 0.57 ' ND1' ' C ' ' A' ' 89' ' ' HIS . 0.0 OUTLIER -161.75 141.8 10.35 Favored 'General case' 0 C--O 1.225 -0.222 0 CA-C-O 121.033 0.444 . . . . 0.0 110.151 179.433 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 5.7 tt -145.66 141.29 22.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-O 121.436 0.636 . . . . 0.0 110.151 -179.577 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . 0.509 ' N ' ' OD1' ' A' ' 91' ' ' ASP . 0.0 OUTLIER -54.07 140.28 32.27 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 114.873 -1.058 . . . . 0.0 112.125 -178.39 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 16.6 tp -54.18 -41.87 69.04 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.043 -0.98 . . . . 0.0 110.01 -179.78 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -69.67 -40.2 76.55 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 179.252 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' SER . . . . . 0.455 ' OG ' ' OD2' ' A' ' 91' ' ' ASP . 4.0 m -64.48 -35.87 82.35 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.956 179.459 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 30.4 mt -58.51 -37.41 64.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 115.888 -0.597 . . . . 0.0 109.786 179.487 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -70.74 -41.86 71.27 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.148 -179.121 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 64.3 m-70 . . . . . 0 C--N 1.327 -0.406 0 C-N-CA 119.41 -0.916 . . . . 0.0 109.365 179.941 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.586 ' CD1' ' N ' ' A' ' 14' ' ' ILE . 1.3 mp . . . . . 0 CA--C 1.519 -0.224 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -95.65 120.06 35.23 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.486 0.66 . . . . 0.0 112.134 -179.039 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 6.4 p90 -149.85 158.6 44.32 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 107.968 -1.123 . . . . 0.0 107.968 177.183 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -95.33 146.32 24.46 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 120.138 -0.625 . . . . 0.0 110.943 -178.809 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -178.92 176.37 0.92 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.863 179.427 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -96.62 133.82 40.63 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.831 -179.829 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.572 ' O ' ' O ' ' A' ' 31' ' ' VAL . 13.0 t -133.74 152.92 52.01 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 121.103 0.478 . . . . 0.0 110.255 178.617 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.446 ' OE1' ' OH ' ' A' ' 62' ' ' TYR . 91.0 mt-10 -132.32 151.8 51.68 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 179.497 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . 0.407 HG21 HD13 ' A' ' 22' ' ' ILE . 79.5 mt -132.71 136.38 55.92 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.468 0 C-N-CA 120.066 -0.654 . . . . 0.0 111.427 -179.568 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.444 ' CD1' ' NE ' ' A' ' 60' ' ' ARG . 0.2 OUTLIER -123.45 123.35 40.46 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.33 -0.85 . . . . 0.0 111.054 -179.398 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.548 ' OE1' ' CE2' ' A' ' 57' ' ' PHE . 18.8 tt0 -129.58 102.05 6.2 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.428 -0.805 . . . . 0.0 109.614 178.472 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 80.3 -127.22 7.82 Favored Glycine 0 CA--C 1.523 0.561 0 N-CA-C 109.847 -1.301 . . . . 0.0 109.847 -178.781 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.434 ' OE1' ' O ' ' A' ' 26' ' ' GLU . 2.9 pp20? -100.04 12.2 37.48 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.969 0.414 . . . . 0.0 110.095 179.434 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.491 ' HB3' ' CZ2' ' A' ' 29' ' ' TRP . 27.5 mtt-85 -113.77 135.25 54.16 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.883 -0.599 . . . . 0.0 112.605 -178.401 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.415 ' HG3' ' N ' ' A' ' 29' ' ' TRP . 11.1 ttt-85 -129.01 150.48 50.4 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.169 179.132 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.521 ' NE1' ' O ' ' A' ' 48' ' ' ASP . 6.7 m-90 -147.94 156.18 42.39 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.518 -179.365 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 12.4 mt-10 -99.9 138.09 37.45 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 178.978 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.572 ' O ' ' O ' ' A' ' 20' ' ' SER . 11.0 m -147.77 157.37 9.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-O 121.255 0.55 . . . . 0.0 111.214 -179.255 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.628 ' H ' ' CD2' ' A' ' 32' ' ' LEU . 0.6 OUTLIER -98.01 130.61 44.83 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 108.428 -0.953 . . . . 0.0 108.428 178.499 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.6 tt -94.35 125.05 38.75 Favored 'General case' 0 C--N 1.324 -0.524 0 C-N-CA 120.385 -0.526 . . . . 0.0 109.786 -179.679 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' HIS . . . . . 0.598 ' HE2' ' CD1' ' A' ' 32' ' ' LEU . 16.1 m-70 -90.7 -27.16 19.17 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.469 -0.787 . . . . 0.0 111.764 -178.341 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 -172.62 160.81 4.75 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 119.566 -0.854 . . . . 0.0 111.084 177.498 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 4.8 p -145.33 169.34 7.45 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.004 -178.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' SER . . . . . 0.409 ' C ' ' H ' ' A' ' 39' ' ' HIS . 24.9 t -141.64 167.84 21.19 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 107.883 -1.154 . . . . 0.0 107.883 178.262 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.543 ' H ' ' CD2' ' A' ' 38' ' ' LEU . 0.1 OUTLIER -64.77 -1.57 2.01 Favored 'General case' 0 C--N 1.321 -0.669 0 C-N-CA 119.95 -0.7 . . . . 0.0 110.562 -179.259 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . 0.553 ' NE2' ' O ' ' A' ' 87' ' ' CYS . 19.9 t60 -159.14 41.68 0.23 Allowed 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 120.786 -0.366 . . . . 0.0 111.397 -179.523 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 177.77 158.69 21.26 Favored Glycine 0 CA--C 1.527 0.798 0 N-CA-C 111.165 -0.774 . . . . 0.0 111.165 179.697 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -148.56 148.95 15.53 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.321 0 CA-C-O 121.342 0.591 . . . . 0.0 111.584 -178.856 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.6 tt -121.59 136.19 54.96 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 115.177 -0.92 . . . . 0.0 108.706 178.729 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 24.0 m -141.33 174.84 6.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-O 121.294 0.568 . . . . 0.0 111.964 -179.295 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -98.19 144.81 17.47 Favored Glycine 0 CA--C 1.529 0.912 0 N-CA-C 109.215 -1.554 . . . . 0.0 109.215 178.049 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . 0.578 ' CD ' ' O ' ' A' ' 45' ' ' GLN . 3.8 pp0? -88.03 116.72 67.05 Favored Pre-proline 0 CA--C 1.535 0.37 0 CA-C-N 118.078 0.939 . . . . 0.0 111.723 -178.349 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -84.82 162.57 12.09 Favored 'Trans proline' 0 C--N 1.305 -1.73 0 C-N-CA 121.384 1.389 . . . . 0.0 110.91 178.595 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 7.5 mp0 -64.52 -40.18 95.16 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.698 0.285 . . . . 0.0 111.539 -178.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . 0.521 ' O ' ' NE1' ' A' ' 29' ' ' TRP . 1.0 OUTLIER -70.45 8.64 0.77 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.821 -179.058 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' TRP . . . . . 0.461 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 60.7 t-105 -63.3 67.72 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 120.742 -0.383 . . . . 0.0 111.725 -179.39 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . 0.554 ' C ' HD21 ' A' ' 50' ' ' ASN . 0.5 OUTLIER -93.08 78.84 4.58 Favored 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 120.332 -0.547 . . . . 0.0 109.932 178.857 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -141.21 160.16 26.76 Favored Glycine 0 CA--C 1.525 0.696 0 N-CA-C 111.462 -0.655 . . . . 0.0 111.462 -179.528 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . 0.436 ' OD1' ' OE1' ' A' ' 54' ' ' GLN . 25.7 t0 -95.46 110.73 52.39 Favored Pre-proline 0 CA--C 1.533 0.326 0 CA-C-N 115.79 -0.205 . . . . 0.0 110.739 -179.873 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 71.4 Cg_exo -46.66 -22.66 1.92 Allowed 'Trans proline' 0 N--CA 1.496 1.671 0 C-N-CA 122.626 2.217 . . . . 0.0 112.751 -179.811 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . 0.436 ' OE1' ' OD1' ' A' ' 52' ' ' ASP . 11.0 mp0 -80.29 -23.91 40.39 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 120.541 -0.464 . . . . 0.0 111.818 -178.968 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.539 ' O ' ' CE1' ' A' ' 57' ' ' PHE . 18.2 mtt-85 -92.72 151.03 40.63 Favored Pre-proline 0 C--N 1.331 -0.224 0 C-N-CA 120.354 -0.538 . . . . 0.0 109.736 179.563 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . 0.431 ' O ' ' OE1' ' A' ' 24' ' ' GLN . 35.7 Cg_endo -64.76 160.88 38.45 Favored 'Trans proline' 0 C--N 1.308 -1.594 0 C-N-CA 122.723 2.282 . . . . 0.0 113.187 -178.735 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . 0.548 ' CE2' ' OE1' ' A' ' 24' ' ' GLN . 42.9 m-85 -130.34 154.4 47.7 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 114.889 -1.051 . . . . 0.0 108.897 179.178 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.4 ' O ' ' HA ' ' A' ' 22' ' ' ILE . 83.4 mt-10 -120.6 134.96 55.23 Favored 'General case' 0 N--CA 1.467 0.392 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 178.469 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -117.0 137.28 52.33 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.212 0.529 . . . . 0.0 112.296 -178.187 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . 0.444 ' NE ' ' CD1' ' A' ' 23' ' ' LEU . 0.9 OUTLIER -122.72 127.66 49.52 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.214 -0.903 . . . . 0.0 108.681 177.254 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 7.8 mt -110.66 139.01 46.32 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 120.73 -0.388 . . . . 0.0 110.419 -179.348 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' TYR . . . . . 0.5 ' CD1' ' N ' ' A' ' 62' ' ' TYR . 6.7 m-85 -120.27 111.24 17.54 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.935 -179.871 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 5.8 tt -105.09 -83.51 0.51 Allowed 'General case' 0 N--CA 1.462 0.15 0 CA-C-N 115.849 -0.614 . . . . 0.0 109.492 179.14 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -77.81 178.85 51.81 Favored Glycine 0 CA--C 1.523 0.542 0 N-CA-C 109.523 -1.431 . . . . 0.0 109.523 178.786 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -73.81 -33.23 64.09 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 119.898 -0.721 . . . . 0.0 110.119 -179.627 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 39.3 t0 -102.88 8.65 39.15 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.097 179.881 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 7.7 t -104.75 96.27 4.46 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.284 0 CA-C-O 121.308 0.575 . . . . 0.0 111.927 -178.812 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 6.0 tp -113.01 117.17 31.28 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 108.172 -1.048 . . . . 0.0 108.172 178.1 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 3.3 mt -111.91 143.69 21.2 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-O 120.818 0.342 . . . . 0.0 110.498 -179.061 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 24.7 mtm-85 -128.35 130.46 47.79 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.878 179.257 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' MET . . . . . 0.425 ' SD ' ' CD1' ' A' ' 90' ' ' ILE . 0.9 OUTLIER -139.48 148.78 43.16 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.858 -0.61 . . . . 0.0 109.741 179.575 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 72.1 tt0 -102.28 129.48 48.71 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 107.798 -1.186 . . . . 0.0 107.798 178.448 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.477 HD11 ' CG ' ' A' ' 85' ' ' PHE . 13.8 pt -138.16 157.54 31.79 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 C-N-CA 119.637 -0.825 . . . . 0.0 113.138 -177.491 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' SER . . . . . 0.587 ' N ' ' OE1' ' A' ' 88' ' ' GLN . 95.6 p -121.44 151.23 40.45 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 114.74 -1.118 . . . . 0.0 109.61 178.521 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.48 ' CD1' ' CZ ' ' A' ' 85' ' ' PHE . 8.0 tp -66.53 123.05 18.98 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.105 0.479 . . . . 0.0 110.431 -179.449 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -98.1 -44.38 6.64 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.964 178.042 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' TRP . . . . . 0.678 ' NE1' ' HA3' ' A' ' 84' ' ' GLY . 69.3 p-90 -164.95 170.55 15.11 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.185 -179.454 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -151.34 124.43 8.72 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 121.155 -0.218 . . . . 0.0 110.732 179.117 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . 0.492 ' CG ' HH11 ' A' ' 79' ' ' ARG . 0.0 OUTLIER -151.95 131.68 13.19 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 112.933 0.716 . . . . 0.0 112.933 179.245 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 54.26 47.06 23.91 Favored 'General case' 0 N--CA 1.468 0.425 0 N-CA-C 113.791 1.034 . . . . 0.0 113.791 176.069 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 72.15 13.06 76.36 Favored Glycine 0 CA--C 1.522 0.503 0 C-N-CA 120.18 -1.01 . . . . 0.0 111.739 178.338 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 48.8 mt -116.91 138.06 51.79 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 178.818 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 29.7 mt -125.78 135.02 51.55 Favored 'General case' 0 CA--C 1.513 -0.456 0 C-N-CA 120.382 -0.527 . . . . 0.0 111.491 -178.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . 0.678 ' HA3' ' NE1' ' A' ' 77' ' ' TRP . . . -98.4 153.95 20.02 Favored Glycine 0 N--CA 1.447 -0.629 0 N-CA-C 109.334 -1.506 . . . . 0.0 109.334 178.381 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' PHE . . . . . 0.48 ' CZ ' ' CD1' ' A' ' 75' ' ' LEU . 28.8 m-85 -145.39 131.94 19.82 Favored 'General case' 0 C--N 1.312 -1.045 0 C-N-CA 120.794 -0.362 . . . . 0.0 110.568 -179.274 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.501 ' O ' ' NE2' ' A' ' 88' ' ' GLN . 20.3 pt-20 -103.6 128.77 50.82 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 179.692 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . 0.553 ' O ' ' NE2' ' A' ' 39' ' ' HIS . 5.2 t -75.71 124.52 27.4 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 112.234 0.457 . . . . 0.0 112.234 -178.028 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . 0.667 ' CA ' HE21 ' A' ' 88' ' ' GLN . 0.0 OUTLIER -102.12 -30.42 11.16 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.088 179.124 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . 0.609 ' ND1' ' N ' ' A' ' 90' ' ' ILE . 0.0 OUTLIER -158.77 140.47 13.53 Favored 'General case' 0 C--O 1.225 -0.198 0 CA-C-O 120.989 0.424 . . . . 0.0 110.202 179.298 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . 0.609 ' N ' ' ND1' ' A' ' 89' ' ' HIS . 6.2 tt -146.18 140.73 21.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.043 -179.384 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . 0.53 ' O ' ' OG ' ' A' ' 94' ' ' SER . 0.1 OUTLIER -53.94 142.27 25.14 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 115.308 -0.86 . . . . 0.0 111.993 -178.534 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 8.0 tp -54.37 -42.3 70.17 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.238 -0.892 . . . . 0.0 110.168 -179.831 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 3.6 p30 -69.03 -42.08 76.83 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.02 179.499 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' SER . . . . . 0.53 ' OG ' ' O ' ' A' ' 91' ' ' ASP . 2.0 p -60.26 -37.74 81.37 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.975 179.606 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 63.5 mt -58.77 -38.12 70.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.128 179.53 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -70.42 -40.44 73.84 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 120.292 -0.563 . . . . 0.0 110.988 -178.87 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 68.1 m-70 . . . . . 0 C--N 1.327 -0.384 0 C-N-CA 119.978 -0.689 . . . . 0.0 109.847 179.923 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.412 ' CD1' ' N ' ' A' ' 14' ' ' ILE . 1.7 mp . . . . . 0 CA--C 1.521 -0.17 0 N-CA-C 110.093 -0.336 . . . . 0.0 110.093 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -95.14 119.76 34.2 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.307 0.575 . . . . 0.0 111.039 -179.755 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -149.66 149.26 30.36 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.109 -0.95 . . . . 0.0 108.442 178.631 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -95.54 149.28 21.6 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 120.116 -0.634 . . . . 0.0 111.335 -178.19 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . 179.06 177.96 0.49 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.466 -0.788 . . . . 0.0 109.891 179.802 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -96.22 133.94 39.93 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.622 179.95 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.58 ' O ' ' O ' ' A' ' 31' ' ' VAL . 20.5 p -134.03 154.34 51.21 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.992 0.425 . . . . 0.0 110.209 178.688 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 16.3 mt-10 -136.24 146.6 46.92 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 108.798 -0.816 . . . . 0.0 108.798 179.409 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . 0.424 ' HA ' ' O ' ' A' ' 58' ' ' GLU . 39.8 mt -125.75 136.24 61.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 C-N-CA 120.037 -0.665 . . . . 0.0 111.329 -178.982 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.435 HD13 ' H ' ' A' ' 23' ' ' LEU . 0.1 OUTLIER -120.67 123.75 43.52 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.329 -0.85 . . . . 0.0 110.846 -179.497 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.491 ' O ' ' OE1' ' A' ' 24' ' ' GLN . 1.6 tm0? -131.49 102.2 5.84 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.513 -0.767 . . . . 0.0 109.606 178.811 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 78.97 -128.15 8.42 Favored Glycine 0 CA--C 1.525 0.664 0 N-CA-C 109.912 -1.275 . . . . 0.0 109.912 -178.711 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -99.14 12.32 36.47 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.865 0.364 . . . . 0.0 110.144 179.417 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.531 ' HB3' ' CZ2' ' A' ' 29' ' ' TRP . 18.6 mtt180 -113.41 135.43 53.87 Favored 'General case' 0 C--N 1.332 -0.177 0 N-CA-C 112.439 0.533 . . . . 0.0 112.439 -178.514 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.428 ' HG2' ' N ' ' A' ' 29' ' ' TRP . 7.0 ttt85 -128.86 148.25 50.88 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.184 179.282 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.531 ' CZ2' ' HB3' ' A' ' 27' ' ' ARG . 6.9 m-90 -146.65 155.82 42.73 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.628 -179.087 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 21.5 mt-10 -100.06 137.28 38.72 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 179.124 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.58 ' O ' ' O ' ' A' ' 20' ' ' SER . 17.3 m -146.88 157.69 10.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 121.31 0.576 . . . . 0.0 111.437 -179.361 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 10.7 tp -96.55 128.88 43.89 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 178.576 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.0 tt -93.37 124.99 37.74 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.232 0.539 . . . . 0.0 109.758 179.789 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 66.3 m-70 -91.24 -24.67 19.81 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.535 -0.757 . . . . 0.0 111.776 -178.434 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -174.59 163.61 3.58 Favored 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 119.579 -0.849 . . . . 0.0 111.635 177.516 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 5.0 p -147.17 168.8 4.78 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.123 0 CA-C-N 115.434 -0.803 . . . . 0.0 111.275 -178.903 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 5.8 t -142.34 170.45 15.68 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 107.867 -1.16 . . . . 0.0 107.867 178.473 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.501 ' H ' ' CD2' ' A' ' 38' ' ' LEU . 0.1 OUTLIER -67.44 -2.58 6.56 Favored 'General case' 0 C--N 1.323 -0.566 0 C-N-CA 119.617 -0.833 . . . . 0.0 110.333 -179.687 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . 0.55 ' CD2' ' O ' ' A' ' 87' ' ' CYS . 1.6 t60 -156.67 37.97 0.32 Allowed 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 120.634 -0.426 . . . . 0.0 111.578 -179.627 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -178.73 158.4 22.74 Favored Glycine 0 CA--C 1.529 0.941 0 C-N-CA 120.505 -0.855 . . . . 0.0 111.526 179.795 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -149.82 150.17 13.97 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.362 0 CA-C-O 121.353 0.597 . . . . 0.0 111.565 -179.006 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.5 tt -122.24 141.28 51.65 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 115.06 -0.973 . . . . 0.0 108.783 178.815 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 15.9 m -145.34 175.03 2.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-O 121.202 0.525 . . . . 0.0 111.88 -179.242 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -99.56 144.85 17.25 Favored Glycine 0 CA--C 1.53 1.004 0 N-CA-C 109.68 -1.368 . . . . 0.0 109.68 178.423 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . 0.555 ' O ' ' NE2' ' A' ' 45' ' ' GLN . 0.0 OUTLIER -86.77 116.79 67.26 Favored Pre-proline 0 N--CA 1.465 0.307 0 CA-C-N 117.85 0.825 . . . . 0.0 111.939 -178.505 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 76.3 Cg_endo -87.1 151.65 8.22 Favored 'Trans proline' 0 C--N 1.309 -1.526 0 C-N-CA 121.567 1.511 . . . . 0.0 111.32 178.527 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -56.44 -13.74 2.5 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 112.658 0.614 . . . . 0.0 112.658 -178.76 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . 0.53 ' O ' ' N ' ' A' ' 50' ' ' ASN . 81.9 m-20 -97.52 8.81 43.94 Favored 'General case' 0 N--CA 1.467 0.398 0 N-CA-C 112.324 0.49 . . . . 0.0 112.324 -178.432 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' TRP . . . . . 0.444 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 58.4 t-105 -60.55 67.67 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 112.119 0.415 . . . . 0.0 112.119 -179.358 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . 0.53 ' N ' ' O ' ' A' ' 48' ' ' ASP . 0.3 OUTLIER -93.53 78.64 4.35 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 178.042 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -142.81 162.99 27.38 Favored Glycine 0 CA--C 1.524 0.609 0 N-CA-C 111.538 -0.625 . . . . 0.0 111.538 -179.146 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . 0.516 ' OD2' ' NH1' ' A' ' 55' ' ' ARG . 15.8 t0 -95.95 122.05 59.38 Favored Pre-proline 0 CA--C 1.534 0.328 0 CA-C-N 115.608 -0.296 . . . . 0.0 110.423 180.0 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -60.82 -21.71 71.28 Favored 'Trans proline' 0 N--CA 1.495 1.611 0 C-N-CA 122.472 2.115 . . . . 0.0 112.183 -179.315 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 22.9 mt-30 -78.67 -24.06 45.34 Favored 'General case' 0 C--N 1.326 -0.448 0 C-N-CA 120.435 -0.506 . . . . 0.0 111.619 -179.19 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.542 ' O ' ' CE1' ' A' ' 57' ' ' PHE . 1.2 mpp_? -93.35 153.18 41.51 Favored Pre-proline 0 N--CA 1.464 0.239 0 C-N-CA 120.595 -0.442 . . . . 0.0 110.004 179.698 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_endo -65.4 160.73 41.21 Favored 'Trans proline' 0 C--N 1.308 -1.585 0 C-N-CA 122.737 2.291 . . . . 0.0 113.273 -178.899 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . 0.542 ' CE1' ' O ' ' A' ' 55' ' ' ARG . 48.3 m-85 -130.87 155.24 47.07 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 114.891 -1.05 . . . . 0.0 109.117 179.633 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.424 ' O ' ' HA ' ' A' ' 22' ' ' ILE . 13.2 mm-40 -123.04 138.36 54.7 Favored 'General case' 0 N--CA 1.469 0.521 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 178.753 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -119.63 137.4 53.9 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.231 0.539 . . . . 0.0 112.133 -178.296 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . 0.829 ' HE ' ' HE ' ' A' ' 70' ' ' ARG . 40.0 mtt85 -124.17 128.2 48.88 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.27 -0.877 . . . . 0.0 108.788 177.729 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -113.33 146.46 39.4 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.021 0.439 . . . . 0.0 110.634 -179.25 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' TYR . . . . . 0.449 ' CD1' ' N ' ' A' ' 62' ' ' TYR . 24.0 m-85 -124.03 108.85 12.82 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.173 179.56 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.412 ' HB3' ' H ' ' A' ' 64' ' ' GLY . 1.8 tt -103.13 -86.5 0.44 Allowed 'General case' 0 C--N 1.333 -0.138 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 179.551 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . 0.412 ' H ' ' HB3' ' A' ' 63' ' ' LEU . . . -74.3 174.06 50.36 Favored Glycine 0 CA--C 1.522 0.524 0 N-CA-C 109.147 -1.581 . . . . 0.0 109.147 178.367 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.495 ' CD1' ' N ' ' A' ' 65' ' ' LEU . 7.9 mp -71.31 -33.16 69.42 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 119.94 -0.704 . . . . 0.0 110.018 -179.788 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -102.52 9.55 39.44 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.902 179.912 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . 0.402 ' HB ' ' H ' ' A' ' 64' ' ' GLY . 24.2 t -107.59 98.81 7.45 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.324 0 CA-C-O 121.204 0.526 . . . . 0.0 112.02 -178.742 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 4.4 tp -113.86 117.77 32.35 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.268 -0.878 . . . . 0.0 108.709 178.55 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 3.1 mt -112.15 144.28 20.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.935 0.398 . . . . 0.0 111.208 -179.04 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . 0.829 ' HE ' ' HE ' ' A' ' 60' ' ' ARG . 1.0 OUTLIER -128.34 131.3 48.6 Favored 'General case' 0 C--O 1.237 0.421 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.677 179.277 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 2.7 mtp -140.07 149.24 42.88 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.055 179.633 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . 0.413 ' OE1' ' OE2' ' A' ' 58' ' ' GLU . 23.9 tt0 -105.01 132.4 51.29 Favored 'General case' 0 CA--C 1.516 -0.33 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 177.995 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 1.5 pt -141.88 158.48 20.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 C-N-CA 119.521 -0.872 . . . . 0.0 113.266 -177.465 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' SER . . . . . 0.5 ' OG ' ' NE2' ' A' ' 88' ' ' GLN . 0.3 OUTLIER -118.91 149.16 42.05 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 114.966 -1.015 . . . . 0.0 109.205 178.35 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.411 ' CD1' ' CE1' ' A' ' 85' ' ' PHE . 16.2 tp -65.76 123.11 18.89 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.236 0.541 . . . . 0.0 110.199 -179.022 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -98.26 -44.62 6.5 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 115.261 -0.882 . . . . 0.0 111.257 178.423 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' TRP . . . . . 0.594 ' NE1' ' HA3' ' A' ' 84' ' ' GLY . 68.8 p-90 -166.05 169.58 14.43 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.412 -179.152 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -148.68 123.66 10.03 Favored 'General case' 0 N--CA 1.465 0.28 0 N-CA-C 109.446 -0.575 . . . . 0.0 109.446 178.222 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 37.6 ttt180 -152.37 133.54 14.3 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 119.762 -0.775 . . . . 0.0 112.809 -179.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 36.2 t0 57.24 47.15 17.47 Favored 'General case' 0 N--CA 1.465 0.276 0 N-CA-C 114.055 1.132 . . . . 0.0 114.055 176.845 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 82.9 -26.71 4.13 Favored Glycine 0 CA--C 1.521 0.452 0 C-N-CA 120.388 -0.911 . . . . 0.0 113.048 177.271 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 5.2 mt -89.66 161.6 16.03 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 117.689 0.744 . . . . 0.0 110.842 -179.057 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 40.5 mt -134.78 135.98 42.23 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.198 -179.25 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . 0.594 ' HA3' ' NE1' ' A' ' 77' ' ' TRP . . . -102.33 153.91 18.51 Favored Glycine 0 N--CA 1.453 -0.203 0 N-CA-C 109.741 -1.343 . . . . 0.0 109.741 178.529 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' PHE . . . . . 0.411 ' CE1' ' CD1' ' A' ' 75' ' ' LEU . 54.6 m-85 -145.64 139.63 26.75 Favored 'General case' 0 C--N 1.318 -0.777 0 C-N-CA 120.828 -0.349 . . . . 0.0 110.71 -179.725 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 20.4 pt-20 -103.86 130.08 51.4 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.084 -0.71 . . . . 0.0 109.084 179.764 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . 0.55 ' O ' ' CD2' ' A' ' 39' ' ' HIS . 5.2 t -77.33 124.36 27.75 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.006 0.431 . . . . 0.0 111.581 -178.556 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . 0.5 ' NE2' ' OG ' ' A' ' 74' ' ' SER . 0.0 OUTLIER -101.2 -29.67 11.97 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.206 179.685 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . 0.532 ' ND1' ' C ' ' A' ' 89' ' ' HIS . 0.0 OUTLIER -161.71 141.72 10.36 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.063 0.459 . . . . 0.0 110.273 179.471 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 6.6 tt -145.57 141.1 22.25 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-N 115.755 -0.657 . . . . 0.0 109.971 -179.547 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . 0.48 ' CG ' ' H ' ' A' ' 94' ' ' SER . 0.1 OUTLIER -53.69 141.05 27.5 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 115.164 -0.925 . . . . 0.0 111.747 -178.444 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.445 ' N ' ' OD1' ' A' ' 91' ' ' ASP . 3.1 tp -54.27 -42.53 70.1 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.122 -0.945 . . . . 0.0 110.593 -179.558 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 11.5 t0 -70.15 -36.83 75.01 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 179.476 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' SER . . . . . 0.48 ' H ' ' CG ' ' A' ' 91' ' ' ASP . 3.6 m -64.53 -37.85 88.98 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.661 -0.699 . . . . 0.0 109.784 179.162 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 50.1 mt -58.74 -37.82 68.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.056 179.529 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -70.56 -41.06 72.93 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.717 -179.167 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 64.1 m-70 . . . . . 0 C--N 1.325 -0.469 0 C-N-CA 119.932 -0.707 . . . . 0.0 109.764 179.786 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.411 HD12 HG23 ' A' ' 14' ' ' ILE . 7.2 mm . . . . . 0 N--CA 1.456 -0.164 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -95.08 120.89 36.06 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.475 0.655 . . . . 0.0 111.992 -178.926 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 23.2 p90 -149.3 158.09 43.88 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 114.873 -1.058 . . . . 0.0 108.448 177.567 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -95.55 146.38 24.5 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 120.291 -0.564 . . . . 0.0 110.314 -179.591 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . 179.94 176.77 0.69 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.075 179.788 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -96.28 133.94 40.02 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.104 -179.686 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.47 ' O ' ' O ' ' A' ' 31' ' ' VAL . 11.4 p -132.94 150.32 52.17 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.081 -0.509 . . . . 0.0 109.941 178.338 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.559 ' OE1' ' NH2' ' A' ' 28' ' ' ARG . 8.3 mm-40 -132.51 138.2 47.45 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 179.59 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 43.0 mt -119.32 136.12 57.52 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 121.353 0.597 . . . . 0.0 110.987 -179.091 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.418 HD11 ' H ' ' A' ' 23' ' ' LEU . 0.1 OUTLIER -123.73 123.2 39.98 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.33 -0.85 . . . . 0.0 111.107 -179.135 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.482 ' O ' ' OE1' ' A' ' 24' ' ' GLN . 1.4 tm0? -128.65 101.57 6.2 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.328 -0.851 . . . . 0.0 109.687 178.918 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 80.99 -125.68 6.99 Favored Glycine 0 CA--C 1.525 0.662 0 N-CA-C 110.103 -1.199 . . . . 0.0 110.103 -178.664 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -101.17 11.63 39.07 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.86 0.362 . . . . 0.0 110.06 179.404 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.505 ' HB3' ' CZ2' ' A' ' 29' ' ' TRP . 36.1 mtt85 -113.5 134.65 54.56 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 112.652 0.612 . . . . 0.0 112.652 -178.146 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.559 ' NH2' ' OE1' ' A' ' 21' ' ' GLU . 70.0 ttt-85 -128.38 149.33 50.58 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.443 179.325 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.534 ' NE1' ' O ' ' A' ' 48' ' ' ASP . 7.8 m-90 -146.5 156.25 43.13 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.386 -0.825 . . . . 0.0 110.496 -179.382 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . 0.496 ' N ' ' CD ' ' A' ' 30' ' ' GLU . 3.7 mp0 -100.77 138.85 37.27 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.975 -0.557 . . . . 0.0 109.621 179.35 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.47 ' O ' ' O ' ' A' ' 20' ' ' SER . 9.1 m -147.28 156.33 10.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-O 121.287 0.565 . . . . 0.0 110.962 -179.434 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 11.4 tp -97.04 129.92 44.42 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 108.123 -1.065 . . . . 0.0 108.123 178.631 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -92.08 124.09 35.92 Favored 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 120.29 -0.564 . . . . 0.0 110.072 -179.827 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 77.0 m-70 -90.67 -30.1 17.33 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.339 -0.846 . . . . 0.0 111.474 -178.803 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . 0.401 ' OD1' ' C ' ' A' ' 35' ' ' ASP . 2.1 p30 -170.05 160.57 8.24 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 119.538 -0.865 . . . . 0.0 110.868 177.26 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 3.4 p -144.75 169.17 8.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.055 -178.825 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 13.1 t -140.89 168.34 20.03 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 108.497 -0.927 . . . . 0.0 108.497 179.083 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.403 HD12 ' N ' ' A' ' 38' ' ' LEU . 0.3 OUTLIER -66.99 -2.02 4.82 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 119.92 -0.712 . . . . 0.0 110.687 -179.572 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -158.71 35.91 0.22 Allowed 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 120.695 -0.402 . . . . 0.0 111.185 179.889 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -174.48 157.38 24.87 Favored Glycine 0 CA--C 1.526 0.78 0 N-CA-C 110.947 -0.861 . . . . 0.0 110.947 179.681 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.412 HG21 HD12 ' A' ' 41' ' ' ILE . 0.1 OUTLIER -146.39 148.18 17.29 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.267 0 CA-C-O 121.484 0.659 . . . . 0.0 111.661 -179.239 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -122.15 134.79 54.74 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 114.936 -1.029 . . . . 0.0 108.896 178.776 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 22.0 m -139.37 174.95 8.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-O 121.227 0.537 . . . . 0.0 111.837 -179.311 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -96.77 143.33 16.67 Favored Glycine 0 CA--C 1.528 0.881 0 N-CA-C 109.331 -1.508 . . . . 0.0 109.331 178.071 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . 0.44 ' O ' ' OE1' ' A' ' 45' ' ' GLN . 2.1 tm0? -85.52 115.93 63.51 Favored Pre-proline 0 N--CA 1.465 0.275 0 CA-C-N 118.041 0.921 . . . . 0.0 111.678 -178.715 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 97.8 Cg_endo -86.27 161.5 9.86 Favored 'Trans proline' 0 C--N 1.308 -1.572 0 C-N-CA 121.543 1.495 . . . . 0.0 111.241 178.732 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 19.7 mt-30 -65.41 -40.21 93.1 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 112.591 0.589 . . . . 0.0 112.591 -178.789 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . 0.534 ' O ' ' NE1' ' A' ' 29' ' ' TRP . 1.8 m-20 -71.64 8.4 1.14 Allowed 'General case' 0 N--CA 1.465 0.286 0 N-CA-C 112.013 0.375 . . . . 0.0 112.013 -178.709 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' TRP . . . . . 0.455 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 61.7 t-105 -60.56 67.84 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 111.832 0.308 . . . . 0.0 111.832 -179.426 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . 0.53 ' N ' ' O ' ' A' ' 48' ' ' ASP . 0.3 OUTLIER -93.46 78.89 4.37 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 120.155 -0.618 . . . . 0.0 109.816 178.698 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -141.24 160.3 26.79 Favored Glycine 0 CA--C 1.525 0.706 0 N-CA-C 111.223 -0.751 . . . . 0.0 111.223 -179.656 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 59.2 t0 -97.32 108.03 42.12 Favored Pre-proline 0 CA--C 1.531 0.242 0 N-CA-C 110.627 -0.138 . . . . 0.0 110.627 -179.842 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -47.52 -22.54 2.87 Favored 'Trans proline' 0 C--N 1.311 -1.439 0 C-N-CA 122.167 1.911 . . . . 0.0 112.341 179.973 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 25.1 mt-30 -74.85 -23.99 58.51 Favored 'General case' 0 C--N 1.324 -0.512 0 C-N-CA 120.51 -0.476 . . . . 0.0 111.233 -179.237 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.546 ' O ' ' CE1' ' A' ' 57' ' ' PHE . 0.0 OUTLIER -96.77 150.09 36.53 Favored Pre-proline 0 C--N 1.331 -0.237 0 N-CA-C 109.863 -0.421 . . . . 0.0 109.863 -179.948 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 25.5 Cg_endo -61.62 160.78 26.92 Favored 'Trans proline' 0 N--CA 1.495 1.615 0 C-N-CA 122.824 2.349 . . . . 0.0 113.298 -178.487 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . 0.546 ' CE1' ' O ' ' A' ' 55' ' ' ARG . 52.5 m-85 -130.98 154.69 47.89 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.012 -0.994 . . . . 0.0 109.313 179.58 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -122.16 136.39 54.9 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 109.036 -0.728 . . . . 0.0 109.036 178.372 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -118.1 138.27 52.38 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.225 0.536 . . . . 0.0 112.19 -178.099 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 20.0 mtm-85 -124.09 127.67 48.16 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 177.813 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 12.8 mt -109.76 151.02 27.48 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.002 0.43 . . . . 0.0 111.215 -178.741 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 38.2 m-85 -132.29 108.84 9.48 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.428 179.593 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.41 ' C ' ' CD2' ' A' ' 63' ' ' LEU . 1.1 tt -102.84 -84.59 0.46 Allowed 'General case' 0 C--N 1.332 -0.155 0 N-CA-C 108.941 -0.763 . . . . 0.0 108.941 179.089 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . 0.403 ' H ' ' HB3' ' A' ' 63' ' ' LEU . . . -76.65 179.35 49.27 Favored Glycine 0 CA--C 1.523 0.548 0 N-CA-C 108.819 -1.712 . . . . 0.0 108.819 178.202 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.528 ' CD1' ' N ' ' A' ' 65' ' ' LEU . 7.5 mp -74.07 -32.3 63.22 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 119.708 -0.797 . . . . 0.0 110.251 -179.589 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . 0.401 ' O ' ' OD1' ' A' ' 66' ' ' ASP . 51.9 t0 -102.35 9.4 39.85 Favored 'General case' 0 C--N 1.332 -0.154 0 C-N-CA 122.735 0.414 . . . . 0.0 111.166 -179.865 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 8.6 t -104.36 94.36 3.12 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.238 0 CA-C-O 121.487 0.66 . . . . 0.0 111.533 -179.172 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 6.6 tp -109.74 117.44 33.9 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 114.863 -1.062 . . . . 0.0 108.214 178.542 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . 0.403 HG21 ' N ' ' A' ' 70' ' ' ARG . 7.6 mt -115.79 143.79 24.92 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.373 0 CA-C-O 121.047 0.451 . . . . 0.0 111.228 -178.632 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . 0.424 ' C ' ' HG2' ' A' ' 71' ' ' MET . 0.0 OUTLIER -128.2 130.84 48.63 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.056 179.197 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' MET . . . . . 0.424 ' HG2' ' C ' ' A' ' 70' ' ' ARG . 0.0 OUTLIER -139.91 148.04 41.44 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.625 -0.716 . . . . 0.0 109.611 179.511 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -100.43 132.78 45.62 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 107.081 -1.452 . . . . 0.0 107.081 177.731 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.444 HD13 ' CG ' ' A' ' 85' ' ' PHE . 7.7 pt -141.69 157.44 21.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 C-N-CA 119.407 -0.917 . . . . 0.0 113.458 -176.813 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' SER . . . . . 0.506 ' OG ' ' NE2' ' A' ' 88' ' ' GLN . 0.5 OUTLIER -122.78 155.97 35.45 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 114.925 -1.034 . . . . 0.0 109.877 178.736 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -65.1 119.42 10.78 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.521 -0.308 . . . . 0.0 110.632 -179.533 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -97.1 -40.27 8.91 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 177.344 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' TRP . . . . . 0.594 ' NE1' ' HA3' ' A' ' 84' ' ' GLY . 69.2 p-90 -171.68 169.78 5.85 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.143 179.674 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -150.53 123.52 8.75 Favored 'General case' 0 N--CA 1.463 0.184 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 178.239 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 24.4 ttt85 -152.44 133.79 14.42 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 119.934 -0.706 . . . . 0.0 112.75 -179.948 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . 0.424 ' O ' ' OD1' ' A' ' 80' ' ' ASP . 25.7 t0 57.07 47.46 17.36 Favored 'General case' 0 N--CA 1.463 0.196 0 N-CA-C 113.764 1.024 . . . . 0.0 113.764 176.747 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 83.17 -27.95 3.86 Favored Glycine 0 CA--C 1.522 0.53 0 C-N-CA 120.241 -0.981 . . . . 0.0 113.284 177.073 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 4.3 mt -89.61 159.24 17.26 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 117.83 0.815 . . . . 0.0 110.436 -178.88 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 39.8 mt -131.48 135.98 47.54 Favored 'General case' 0 CA--C 1.518 -0.288 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.541 -178.811 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . 0.594 ' HA3' ' NE1' ' A' ' 77' ' ' TRP . . . -100.11 153.08 19.38 Favored Glycine 0 N--CA 1.453 -0.233 0 N-CA-C 109.748 -1.341 . . . . 0.0 109.748 178.471 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' PHE . . . . . 0.444 ' CG ' HD13 ' A' ' 73' ' ' ILE . 33.6 m-85 -145.7 135.72 23.67 Favored 'General case' 0 C--N 1.318 -0.768 0 C-N-CA 120.734 -0.386 . . . . 0.0 110.612 -179.575 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -104.18 127.31 51.77 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.06 -0.719 . . . . 0.0 109.06 179.363 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -74.27 125.35 28.24 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.173 0.511 . . . . 0.0 111.542 -178.638 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . 0.506 ' NE2' ' OG ' ' A' ' 74' ' ' SER . 0.0 OUTLIER -102.5 -29.82 11.36 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.032 179.817 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . 0.636 ' ND1' ' N ' ' A' ' 90' ' ' ILE . 0.0 OUTLIER -158.38 140.23 13.81 Favored 'General case' 0 C--O 1.226 -0.163 0 N-CA-C 109.891 -0.411 . . . . 0.0 109.891 178.735 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . 0.636 ' N ' ' ND1' ' A' ' 89' ' ' HIS . 7.0 tt -146.15 141.08 21.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-O 121.352 0.596 . . . . 0.0 109.988 -179.444 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . 0.494 ' CB ' ' OG ' ' A' ' 94' ' ' SER . 0.1 OUTLIER -53.75 142.03 24.84 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.287 -0.87 . . . . 0.0 112.05 -178.381 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 6.0 tp -54.43 -42.36 70.45 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.178 -0.919 . . . . 0.0 109.968 -179.993 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . 0.425 ' OD2' ' OD2' ' A' ' 91' ' ' ASP . 3.5 p30 -68.36 -42.49 79.13 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.145 -0.48 . . . . 0.0 109.97 179.636 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' SER . . . . . 0.494 ' OG ' ' CB ' ' A' ' 91' ' ' ASP . 1.9 p -62.31 -36.24 81.55 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.037 -0.529 . . . . 0.0 109.998 179.373 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 36.7 mt -58.86 -37.97 70.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.157 179.664 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -70.24 -39.71 74.89 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.257 -0.577 . . . . 0.0 110.914 -178.758 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 60.4 m-70 . . . . . 0 C--N 1.326 -0.431 0 C-N-CA 119.515 -0.874 . . . . 0.0 109.108 179.753 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.502 ' CD1' ' N ' ' A' ' 14' ' ' ILE . 1.7 mp . . . . . 0 CA--C 1.518 -0.264 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -94.42 120.41 34.61 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.403 0.621 . . . . 0.0 111.676 -178.963 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 1.6 p90 -149.67 158.09 43.85 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 114.768 -1.105 . . . . 0.0 108.212 177.85 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 31.4 m-20 -95.37 146.42 24.4 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 120.14 -0.624 . . . . 0.0 110.432 -179.22 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -179.27 176.83 0.82 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.967 -0.56 . . . . 0.0 109.742 179.652 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -96.66 134.43 39.91 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.195 -179.666 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.595 ' O ' ' O ' ' A' ' 31' ' ' VAL . 16.9 p -133.43 153.98 51.16 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.01 0.434 . . . . 0.0 109.875 178.445 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.4 mt-10 -134.61 140.43 46.06 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 179.658 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 2.7 mm -118.93 135.66 58.63 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-O 121.489 0.661 . . . . 0.0 110.404 -179.639 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -127.23 123.06 35.68 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.04 -0.982 . . . . 0.0 110.482 -179.254 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.581 ' O ' ' OE1' ' A' ' 24' ' ' GLN . 1.4 tm0? -128.39 102.22 6.56 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.444 -0.798 . . . . 0.0 109.485 178.935 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 80.23 -124.22 6.39 Favored Glycine 0 CA--C 1.524 0.629 0 N-CA-C 110.204 -1.158 . . . . 0.0 110.204 -178.797 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -102.38 11.62 37.76 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.78 0.324 . . . . 0.0 110.288 179.915 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.553 ' HB3' ' CZ2' ' A' ' 29' ' ' TRP . 46.5 mtt180 -114.34 136.53 52.87 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 112.844 0.683 . . . . 0.0 112.844 -177.962 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 27.7 ttt180 -129.05 149.55 50.82 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.104 0.478 . . . . 0.0 110.272 179.344 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.553 ' CZ2' ' HB3' ' A' ' 27' ' ' ARG . 5.6 m-90 -150.26 125.66 10.15 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.682 -178.859 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -75.06 143.29 43.53 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 119.853 -0.739 . . . . 0.0 109.692 -179.0 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.595 ' O ' ' O ' ' A' ' 20' ' ' SER . 6.1 m -148.4 158.94 7.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-O 121.262 0.553 . . . . 0.0 111.176 -179.019 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.701 ' H ' ' CD2' ' A' ' 32' ' ' LEU . 1.5 pt? -99.05 130.35 45.37 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 108.816 -0.809 . . . . 0.0 108.816 178.729 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -94.24 124.94 38.58 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.311 0.577 . . . . 0.0 109.544 -179.939 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 71.1 m-70 -89.49 -26.18 21.05 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.379 -0.828 . . . . 0.0 111.882 -178.241 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -174.03 162.98 3.92 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 119.739 -0.784 . . . . 0.0 111.326 177.842 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 4.8 p -146.71 168.81 5.49 Favored 'Isoleucine or valine' 0 C--O 1.231 0.104 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.041 -179.097 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' SER . . . . . 0.454 ' C ' ' H ' ' A' ' 39' ' ' HIS . 67.5 p -142.28 168.08 20.58 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 107.321 -1.363 . . . . 0.0 107.321 177.851 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -62.41 -0.81 0.63 Allowed 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 119.33 -0.948 . . . . 0.0 110.697 -179.239 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . 0.454 ' H ' ' C ' ' A' ' 37' ' ' SER . 0.4 OUTLIER -164.92 45.62 0.09 Allowed 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 120.628 -0.429 . . . . 0.0 111.425 179.978 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -179.17 150.98 9.81 Favored Glycine 0 CA--C 1.529 0.919 0 N-CA-C 110.812 -0.915 . . . . 0.0 110.812 179.75 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -146.36 148.14 17.35 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.267 0 CA-C-O 121.445 0.64 . . . . 0.0 111.903 -179.175 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -122.52 126.62 48.19 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 114.921 -1.036 . . . . 0.0 108.963 179.059 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 30.5 m -131.3 174.96 12.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 121.392 0.615 . . . . 0.0 111.742 -179.379 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -98.28 145.61 17.83 Favored Glycine 0 CA--C 1.528 0.883 0 N-CA-C 109.638 -1.385 . . . . 0.0 109.638 178.393 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 6.9 tt0 -87.41 113.98 56.58 Favored Pre-proline 0 N--CA 1.466 0.346 0 CA-C-N 117.886 0.843 . . . . 0.0 111.992 -178.486 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -84.58 161.37 12.57 Favored 'Trans proline' 0 C--N 1.308 -1.575 0 C-N-CA 121.663 1.575 . . . . 0.0 111.359 178.474 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 4.8 tt0 -65.43 -40.06 92.87 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 112.279 0.474 . . . . 0.0 112.279 -178.894 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . 0.524 ' O ' ' N ' ' A' ' 50' ' ' ASN . 57.7 t0 -73.18 8.39 1.68 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.528 -0.306 . . . . 0.0 111.62 -178.755 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' TRP . . . . . 0.465 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 62.6 t-105 -60.93 68.2 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.564 -0.289 . . . . 0.0 111.567 -179.667 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . 0.555 ' ND2' ' C ' ' A' ' 50' ' ' ASN . 0.6 OUTLIER -93.69 78.69 4.26 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 178.468 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -138.58 161.43 25.75 Favored Glycine 0 CA--C 1.524 0.602 0 C-N-CA 120.875 -0.679 . . . . 0.0 111.721 -179.429 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . 0.464 ' H ' ' NE2' ' A' ' 24' ' ' GLN . 0.4 OUTLIER -96.14 120.39 62.81 Favored Pre-proline 0 CA--C 1.535 0.385 0 N-CA-C 109.836 -0.431 . . . . 0.0 109.836 179.774 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_endo -63.86 -22.29 68.99 Favored 'Trans proline' 0 N--CA 1.492 1.44 0 C-N-CA 122.172 1.914 . . . . 0.0 112.48 -179.368 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 42.5 mm-40 -75.95 -23.84 55.43 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 120.353 -0.539 . . . . 0.0 111.12 -179.492 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.518 ' O ' ' CE1' ' A' ' 57' ' ' PHE . 80.6 mtt180 -96.87 146.79 31.91 Favored Pre-proline 0 CA--C 1.532 0.258 0 C-N-CA 120.748 -0.381 . . . . 0.0 110.396 179.956 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_exo -57.87 160.97 13.77 Favored 'Trans proline' 0 N--CA 1.496 1.653 0 C-N-CA 122.665 2.244 . . . . 0.0 113.177 -179.332 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . 0.518 ' CE1' ' O ' ' A' ' 55' ' ' ARG . 33.9 m-85 -129.62 154.88 46.66 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 114.973 -1.012 . . . . 0.0 108.766 179.049 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 28.3 mt-10 -122.25 137.93 54.67 Favored 'General case' 0 N--CA 1.465 0.279 0 N-CA-C 109.319 -0.623 . . . . 0.0 109.319 178.54 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -121.41 139.47 53.41 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.033 0.444 . . . . 0.0 112.167 -178.026 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . 0.491 ' CG ' HH11 ' A' ' 60' ' ' ARG . 1.9 mtt-85 -123.12 127.31 48.52 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 177.03 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 9.6 mp -106.52 151.07 25.47 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 120.777 -0.369 . . . . 0.0 110.255 -179.433 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' TYR . . . . . 0.464 ' HH ' ' CB ' ' A' ' 60' ' ' ARG . 28.4 m-85 -134.11 110.0 9.31 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.735 179.963 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.413 ' C ' ' CD2' ' A' ' 63' ' ' LEU . 2.2 tt -104.37 -82.39 0.51 Allowed 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 115.698 -0.683 . . . . 0.0 109.346 179.513 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -79.43 179.18 53.23 Favored Glycine 0 CA--C 1.523 0.535 0 N-CA-C 109.343 -1.503 . . . . 0.0 109.343 178.561 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 1.6 mt -73.58 -34.5 65.14 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 119.767 -0.773 . . . . 0.0 110.426 -179.463 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -99.96 9.23 43.27 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.954 179.908 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 9.6 t -106.35 96.04 4.29 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.228 0 CA-C-O 121.168 0.509 . . . . 0.0 111.96 -178.616 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 1.2 tp -114.97 118.06 32.38 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 178.216 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 3.1 mt -112.46 146.15 17.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-O 120.846 0.355 . . . . 0.0 111.791 -178.193 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . 0.482 ' NH2' ' OD2' ' A' ' 91' ' ' ASP . 33.8 ptt180 -128.04 132.23 49.1 Favored 'General case' 0 C--O 1.237 0.444 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.053 179.254 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -143.95 150.18 37.94 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.341 -0.845 . . . . 0.0 110.26 -179.965 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -106.33 126.81 52.7 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 178.332 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.556 ' C ' HE21 ' A' ' 88' ' ' GLN . 10.5 pt -134.75 158.97 41.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 C-N-CA 119.77 -0.772 . . . . 0.0 113.01 -177.521 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' SER . . . . . 0.579 ' OG ' ' NE2' ' A' ' 88' ' ' GLN . 0.5 OUTLIER -122.77 155.87 35.64 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 115.048 -0.978 . . . . 0.0 110.172 179.209 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -65.66 119.23 10.78 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.311 -179.902 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -96.98 -40.75 8.73 Favored 'General case' 0 C--N 1.331 -0.203 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 177.648 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' TRP . . . . . 0.557 ' NE1' ' HA3' ' A' ' 84' ' ' GLY . 68.1 p-90 -171.28 169.3 6.4 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.517 -0.765 . . . . 0.0 109.809 179.8 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -149.43 123.79 9.62 Favored 'General case' 0 N--CA 1.464 0.245 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 178.728 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 26.7 ttt180 -152.35 134.36 14.91 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 119.706 -0.798 . . . . 0.0 113.017 179.791 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . 0.515 ' O ' ' OD1' ' A' ' 80' ' ' ASP . 11.8 t0 57.07 47.51 17.27 Favored 'General case' 0 N--CA 1.463 0.18 0 N-CA-C 113.861 1.06 . . . . 0.0 113.861 176.702 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 82.54 -27.61 3.68 Favored Glycine 0 CA--C 1.523 0.548 0 C-N-CA 120.356 -0.926 . . . . 0.0 113.491 177.121 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 4.7 mt -89.62 157.19 18.13 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 117.756 0.778 . . . . 0.0 110.285 -179.156 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 26.3 mt -128.22 135.43 49.69 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.0 -179.077 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . 0.557 ' HA3' ' NE1' ' A' ' 77' ' ' TRP . . . -98.39 152.52 19.8 Favored Glycine 0 N--CA 1.45 -0.378 0 N-CA-C 109.65 -1.38 . . . . 0.0 109.65 178.734 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 22.4 m-85 -145.66 135.31 23.32 Favored 'General case' 0 C--N 1.317 -0.819 0 C-N-CA 120.642 -0.423 . . . . 0.0 110.913 -179.199 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -104.26 126.22 51.18 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 178.843 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 2.2 t -69.13 122.39 18.68 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.956 0.407 . . . . 0.0 111.679 -178.451 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . 0.579 ' NE2' ' OG ' ' A' ' 74' ' ' SER . 24.3 mt-30 -96.17 -33.52 12.01 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.18 179.411 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . 0.5 ' ND1' ' C ' ' A' ' 89' ' ' HIS . 0.0 OUTLIER -162.99 142.54 8.89 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.394 -179.905 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 6.2 tt -145.21 141.08 22.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-N 115.856 -0.611 . . . . 0.0 109.695 -179.844 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . 0.483 ' OD1' ' N ' ' A' ' 93' ' ' ASP . 7.0 t70 -56.6 145.72 27.52 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 115.54 -0.755 . . . . 0.0 111.807 -178.109 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.435 ' N ' ' OD1' ' A' ' 91' ' ' ASP . 48.5 tp -54.24 -42.21 69.63 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 115.272 -0.877 . . . . 0.0 110.446 -179.144 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . 0.483 ' N ' ' OD1' ' A' ' 91' ' ' ASP . 1.3 m-20 -70.16 -33.07 71.32 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 179.523 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 13.3 m -69.06 -37.81 78.73 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.838 -0.619 . . . . 0.0 109.84 179.309 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 56.6 mt -58.87 -38.12 70.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.19 179.623 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -70.6 -42.06 71.5 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.421 -0.512 . . . . 0.0 111.364 -178.538 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 60.9 m-70 . . . . . 0 C--N 1.324 -0.53 0 C-N-CA 119.143 -1.023 . . . . 0.0 109.126 179.51 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.598 ' CD1' ' N ' ' A' ' 14' ' ' ILE . 1.2 mp . . . . . 0 CA--C 1.52 -0.2 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -94.96 120.25 34.86 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.582 0.706 . . . . 0.0 112.035 -178.924 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 2.5 p90 -149.77 158.79 44.5 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 114.686 -1.143 . . . . 0.0 107.959 177.605 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -95.26 147.11 23.83 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 119.981 -0.688 . . . . 0.0 110.574 -178.963 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -179.67 178.48 0.64 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.902 -0.59 . . . . 0.0 109.763 179.915 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -96.55 134.04 40.26 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 120.786 -0.365 . . . . 0.0 110.976 179.987 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.583 ' O ' ' O ' ' A' ' 31' ' ' VAL . 7.6 p -135.78 157.04 47.84 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.18 179.044 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.406 ' C ' ' OE1' ' A' ' 21' ' ' GLU . 0.8 OUTLIER -144.74 144.38 31.16 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.122 -0.696 . . . . 0.0 109.122 178.702 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 1.2 mm -119.24 136.75 55.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-O 121.133 0.492 . . . . 0.0 111.591 -177.995 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -121.63 123.15 41.24 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.617 -0.72 . . . . 0.0 111.017 -179.882 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.466 ' O ' ' OE1' ' A' ' 24' ' ' GLN . 1.4 tm0? -130.34 102.39 6.17 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.096 179.342 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 80.07 -126.06 7.24 Favored Glycine 0 CA--C 1.523 0.564 0 N-CA-C 109.821 -1.312 . . . . 0.0 109.821 -178.707 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -100.19 11.87 38.36 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 179.151 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.46 ' HB3' ' CZ2' ' A' ' 29' ' ' TRP . 2.2 mtt180 -112.74 131.25 55.76 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.846 -0.615 . . . . 0.0 112.364 -177.267 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.435 HH11 ' HD3' ' A' ' 28' ' ' ARG . 36.4 ttt180 -126.24 148.47 49.47 Favored 'General case' 0 CA--C 1.519 -0.238 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.783 178.875 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.53 ' NE1' ' O ' ' A' ' 48' ' ' ASP . 7.1 m-90 -147.47 156.44 42.85 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.459 -178.894 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . 0.504 ' N ' ' CD ' ' A' ' 30' ' ' GLU . 3.1 mp0 -102.4 140.89 36.08 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.162 -0.472 . . . . 0.0 109.9 179.58 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.583 ' O ' ' O ' ' A' ' 20' ' ' SER . 12.4 m -150.25 157.25 6.16 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-O 121.159 0.504 . . . . 0.0 110.904 -179.697 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.496 HD12 ' N ' ' A' ' 33' ' ' LEU . 6.7 tp -94.23 128.54 40.74 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 107.475 -1.306 . . . . 0.0 107.475 178.144 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.496 ' N ' HD12 ' A' ' 32' ' ' LEU . 0.4 OUTLIER -90.22 126.01 35.68 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.57 -0.53 . . . . 0.0 109.57 -179.727 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 40.0 m-70 -93.06 -28.64 16.24 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.558 -0.747 . . . . 0.0 111.962 -178.218 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 2.0 p-10 -172.75 158.76 4.08 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 119.483 -0.887 . . . . 0.0 110.862 177.418 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 7.1 p -143.54 169.27 11.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.494 -0.775 . . . . 0.0 110.878 -178.904 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 17.1 t -140.91 170.72 15.2 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 178.814 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 1.1 pp -67.4 -0.11 3.39 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 119.976 -0.689 . . . . 0.0 111.11 -179.397 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . 0.514 ' NE2' ' O ' ' A' ' 87' ' ' CYS . 1.6 t60 -162.22 35.12 0.12 Allowed 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 120.73 -0.388 . . . . 0.0 111.217 179.776 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -171.66 156.06 25.23 Favored Glycine 0 CA--C 1.526 0.731 0 N-CA-C 110.759 -0.936 . . . . 0.0 110.759 179.903 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -148.03 150.37 14.43 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 CA-C-O 121.597 0.713 . . . . 0.0 112.606 -178.839 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -123.0 140.51 52.96 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 114.665 -1.152 . . . . 0.0 109.191 178.849 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 10.6 m -145.58 174.99 2.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-O 121.091 0.472 . . . . 0.0 111.092 179.95 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -96.96 145.38 17.84 Favored Glycine 0 CA--C 1.526 0.775 0 N-CA-C 109.47 -1.452 . . . . 0.0 109.47 178.237 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 45.2 tt0 -86.6 115.63 62.99 Favored Pre-proline 0 N--CA 1.462 0.154 0 CA-C-N 117.732 0.766 . . . . 0.0 111.79 -178.538 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 66.4 Cg_endo -85.13 161.33 11.53 Favored 'Trans proline' 0 C--N 1.306 -1.67 0 C-N-CA 121.569 1.513 . . . . 0.0 111.134 178.856 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 58.7 mt-30 -65.17 -40.14 93.89 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 112.128 0.418 . . . . 0.0 112.128 -178.885 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . 0.562 ' O ' ' N ' ' A' ' 50' ' ' ASN . 0.9 OUTLIER -72.21 8.63 1.24 Allowed 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 111.85 0.315 . . . . 0.0 111.85 -178.794 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' TRP . . . . . 0.486 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 64.9 t-105 -59.57 67.17 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 111.825 0.305 . . . . 0.0 111.825 -179.738 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . 0.562 ' N ' ' O ' ' A' ' 48' ' ' ASP . 0.2 OUTLIER -93.33 78.34 4.47 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 120.159 -0.616 . . . . 0.0 109.59 178.325 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -144.58 144.34 13.18 Favored Glycine 0 CA--C 1.523 0.533 0 N-CA-C 111.17 -0.772 . . . . 0.0 111.17 -179.38 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 23.0 t0 -77.94 113.33 31.94 Favored Pre-proline 0 CA--C 1.533 0.318 0 CA-C-N 115.878 -0.161 . . . . 0.0 111.102 -179.709 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -50.07 -22.63 8.12 Favored 'Trans proline' 0 N--CA 1.495 1.584 0 C-N-CA 122.522 2.148 . . . . 0.0 112.673 179.578 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 16.7 mm100 -77.51 -23.99 50.12 Favored 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 120.642 -0.423 . . . . 0.0 111.769 -178.853 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.575 ' O ' ' CE1' ' A' ' 57' ' ' PHE . 66.8 mtm180 -92.94 151.04 40.34 Favored Pre-proline 0 C--N 1.33 -0.252 0 C-N-CA 120.671 -0.412 . . . . 0.0 110.077 179.741 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -62.94 160.73 32.32 Favored 'Trans proline' 0 N--CA 1.495 1.596 0 C-N-CA 122.834 2.356 . . . . 0.0 113.436 -178.701 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . 0.575 ' CE1' ' O ' ' A' ' 55' ' ' ARG . 41.6 m-85 -130.59 155.18 46.97 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 114.897 -1.047 . . . . 0.0 109.147 179.343 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 14.3 mt-10 -123.06 139.07 54.46 Favored 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 178.777 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -118.66 135.93 54.2 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 112.501 0.556 . . . . 0.0 112.501 -177.772 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 2.1 mmt85 -122.74 127.67 49.5 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 108.261 -1.014 . . . . 0.0 108.261 177.107 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.429 ' CD1' ' N ' ' A' ' 61' ' ' LEU . 7.9 mp -111.48 151.22 28.85 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 120.67 -0.412 . . . . 0.0 111.241 -178.558 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 9.8 m-85 -131.76 110.09 10.61 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.625 179.446 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.423 ' C ' ' CD2' ' A' ' 63' ' ' LEU . 2.0 tt -103.78 -85.43 0.46 Allowed 'General case' 0 C--N 1.333 -0.143 0 N-CA-C 108.991 -0.744 . . . . 0.0 108.991 178.968 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . 0.411 ' H ' ' HB3' ' A' ' 63' ' ' LEU . . . -75.28 179.84 45.1 Favored Glycine 0 CA--C 1.522 0.508 0 N-CA-C 109.017 -1.633 . . . . 0.0 109.017 178.338 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.565 ' CD2' ' N ' ' A' ' 65' ' ' LEU . 2.5 mm? -74.42 -32.44 62.66 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 119.709 -0.796 . . . . 0.0 110.232 -179.479 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 24.7 m-20 -102.53 9.27 39.59 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 122.734 0.414 . . . . 0.0 111.063 -179.827 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 8.5 t -103.22 93.76 2.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-O 121.34 0.59 . . . . 0.0 111.667 -178.905 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 4.4 tp -109.99 117.66 34.37 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 178.272 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 6.3 mt -115.78 143.99 24.45 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.278 0 CA-C-O 120.982 0.42 . . . . 0.0 111.374 -178.88 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . 0.502 ' NH2' ' OD2' ' A' ' 91' ' ' ASP . 28.5 ptt-85 -128.38 130.73 48.13 Favored 'General case' 0 C--O 1.237 0.441 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.007 179.223 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 1.5 mtm -139.95 148.19 41.58 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 115.934 -0.576 . . . . 0.0 109.691 179.453 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -101.97 132.68 47.65 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 107.87 -1.159 . . . . 0.0 107.87 178.718 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.488 ' O ' ' O ' ' A' ' 57' ' ' PHE . 4.1 pt -142.7 157.41 18.5 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 C-N-CA 119.44 -0.904 . . . . 0.0 112.977 -177.666 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' SER . . . . . 0.624 ' N ' HE22 ' A' ' 88' ' ' GLN . 3.3 t -121.91 155.45 35.42 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 115.47 -0.786 . . . . 0.0 109.763 179.032 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -65.02 118.43 9.11 Favored 'General case' 0 CA--C 1.521 -0.162 0 CA-C-O 121.161 0.505 . . . . 0.0 110.603 -178.575 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -97.22 -40.99 8.51 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.064 177.446 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' TRP . . . . . 0.471 ' NE1' ' HA3' ' A' ' 84' ' ' GLY . 68.8 p-90 -170.42 169.76 7.33 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.79 -179.819 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -151.07 123.99 8.65 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 116.299 -0.409 . . . . 0.0 109.948 178.658 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -152.04 132.03 13.42 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 120.043 -0.663 . . . . 0.0 112.364 179.593 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 55.67 47.19 21.14 Favored 'General case' 0 N--CA 1.465 0.287 0 N-CA-C 113.089 0.774 . . . . 0.0 113.089 176.85 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 68.17 12.67 63.44 Favored Glycine 0 CA--C 1.523 0.547 0 C-N-CA 120.343 -0.932 . . . . 0.0 111.902 178.385 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 29.1 mt -115.74 136.13 53.36 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 108.474 -0.935 . . . . 0.0 108.474 178.488 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 37.6 mt -124.48 136.41 53.99 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.497 -178.928 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . 0.471 ' HA3' ' NE1' ' A' ' 77' ' ' TRP . . . -123.36 134.58 9.49 Favored Glycine 0 CA--C 1.519 0.337 0 N-CA-C 109.481 -1.448 . . . . 0.0 109.481 178.551 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 26.0 m-85 -122.65 157.78 31.46 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.964 0.412 . . . . 0.0 110.096 -179.805 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -104.8 130.55 52.89 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 178.314 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . 0.514 ' O ' ' NE2' ' A' ' 39' ' ' HIS . 44.5 t -74.78 124.23 26.42 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.826 0.346 . . . . 0.0 111.336 -178.976 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . 0.624 HE22 ' N ' ' A' ' 74' ' ' SER . 0.0 OUTLIER -100.73 -31.2 11.31 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.458 179.598 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . 0.611 ' ND1' ' N ' ' A' ' 90' ' ' ILE . 0.0 OUTLIER -159.2 141.0 13.4 Favored 'General case' 0 C--O 1.225 -0.203 0 CA-C-O 120.909 0.385 . . . . 0.0 110.08 179.283 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . 0.611 ' N ' ' ND1' ' A' ' 89' ' ' HIS . 7.7 tt -145.31 140.51 22.47 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-O 121.438 0.637 . . . . 0.0 110.15 -178.947 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . 0.502 ' OD2' ' NH2' ' A' ' 70' ' ' ARG . 0.1 OUTLIER -55.02 140.85 36.34 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 115.033 -0.985 . . . . 0.0 112.334 -178.058 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 6.6 tp -54.56 -42.62 71.21 Favored 'General case' 0 N--CA 1.462 0.136 0 CA-C-N 115.075 -0.966 . . . . 0.0 110.321 -179.642 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . 0.414 ' OD1' ' N ' ' A' ' 94' ' ' SER . 0.5 OUTLIER -71.93 -35.8 69.75 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 179.557 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' SER . . . . . 0.414 ' N ' ' OD1' ' A' ' 93' ' ' ASP . 1.5 t -64.53 -38.26 90.39 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.427 179.078 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 22.0 mt -59.01 -37.49 68.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.372 179.133 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -70.19 -40.12 74.83 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.096 -0.641 . . . . 0.0 110.612 -178.938 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 59.7 m-70 . . . . . 0 C--N 1.324 -0.51 0 C-N-CA 119.475 -0.89 . . . . 0.0 109.097 179.315 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.577 ' CD1' ' N ' ' A' ' 14' ' ' ILE . 1.5 mp . . . . . 0 C--O 1.231 0.126 0 N-CA-C 109.762 -0.459 . . . . 0.0 109.762 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -95.5 120.68 36.17 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.307 0.575 . . . . 0.0 112.497 -178.806 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 28.9 p90 -149.74 158.71 44.43 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.009 -0.996 . . . . 0.0 108.316 177.199 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -95.42 147.59 23.37 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 120.152 -0.619 . . . . 0.0 110.74 -179.174 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . 179.27 176.79 0.58 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.097 179.879 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -96.26 134.16 39.71 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.946 -179.927 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.492 ' O ' ' O ' ' A' ' 31' ' ' VAL . 11.7 p -134.44 153.37 51.95 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.925 0.393 . . . . 0.0 110.375 178.952 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 68.6 mt-10 -133.49 140.02 47.0 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 109.136 -0.69 . . . . 0.0 109.136 179.437 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -119.9 135.77 59.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-O 121.311 0.577 . . . . 0.0 110.639 -179.47 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -123.71 123.26 40.14 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.407 -0.815 . . . . 0.0 111.113 -179.075 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.496 ' OE1' ' NH1' ' A' ' 27' ' ' ARG . 1.5 tm0? -129.62 102.09 6.21 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.377 -0.828 . . . . 0.0 110.042 179.079 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 81.06 -126.44 7.38 Favored Glycine 0 CA--C 1.523 0.549 0 N-CA-C 109.961 -1.256 . . . . 0.0 109.961 -178.87 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 14.7 pt-20 -100.18 11.66 38.83 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 179.269 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.496 ' NH1' ' OE1' ' A' ' 24' ' ' GLN . 0.2 OUTLIER -114.51 133.07 56.05 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.604 -0.726 . . . . 0.0 112.607 -176.443 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.433 ' O ' ' CD1' ' A' ' 29' ' ' TRP . 41.8 ttt-85 -128.12 153.0 47.33 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.334 179.555 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.433 ' CD1' ' O ' ' A' ' 28' ' ' ARG . 6.3 m-90 -150.51 156.48 41.5 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.276 -0.875 . . . . 0.0 110.501 -179.41 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . 0.453 ' N ' ' CD ' ' A' ' 30' ' ' GLU . 4.7 mp0 -100.72 138.59 37.57 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.692 -0.485 . . . . 0.0 109.692 179.462 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.492 ' O ' ' O ' ' A' ' 20' ' ' SER . 18.4 m -148.34 158.69 7.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 121.232 0.539 . . . . 0.0 111.357 -179.241 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 15.9 tp -96.52 128.16 43.19 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 108.392 -0.966 . . . . 0.0 108.392 178.732 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -91.08 125.85 35.99 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.249 0.547 . . . . 0.0 110.061 -179.885 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 72.2 m-70 -92.1 -28.24 17.24 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.308 -0.86 . . . . 0.0 111.76 -178.809 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 3.6 p30 -173.78 162.47 4.02 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 119.409 -0.916 . . . . 0.0 111.449 177.677 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 3.3 p -145.35 168.84 7.93 Favored 'Isoleucine or valine' 0 C--O 1.231 0.124 0 CA-C-N 115.564 -0.744 . . . . 0.0 111.098 -179.063 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' SER . . . . . 0.471 ' C ' ' H ' ' A' ' 39' ' ' HIS . 30.1 t -140.99 169.32 17.84 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 107.93 -1.137 . . . . 0.0 107.93 178.694 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.404 ' CD1' ' H ' ' A' ' 38' ' ' LEU . 5.9 mp -64.65 0.21 1.19 Allowed 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 119.44 -0.904 . . . . 0.0 110.241 -179.256 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . 0.471 ' H ' ' C ' ' A' ' 37' ' ' SER . 32.9 p-80 -163.36 43.81 0.11 Allowed 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 120.633 -0.427 . . . . 0.0 111.581 179.995 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 178.78 158.18 20.79 Favored Glycine 0 CA--C 1.53 0.977 0 C-N-CA 120.716 -0.754 . . . . 0.0 111.525 179.784 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -149.34 149.19 15.01 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.352 0 CA-C-O 121.364 0.602 . . . . 0.0 111.751 -178.759 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.432 HD23 ' N ' ' A' ' 43' ' ' VAL . 1.1 tt -121.88 127.75 50.82 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 114.93 -1.032 . . . . 0.0 108.442 178.325 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . 0.432 ' N ' HD23 ' A' ' 42' ' ' LEU . 23.2 m -130.9 174.72 12.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-O 121.3 0.571 . . . . 0.0 111.543 -179.028 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -96.81 144.15 17.16 Favored Glycine 0 CA--C 1.526 0.774 0 N-CA-C 109.164 -1.574 . . . . 0.0 109.164 178.062 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . 0.523 HE21 ' C ' ' A' ' 45' ' ' GLN . 0.0 OUTLIER -85.4 115.49 61.59 Favored Pre-proline 0 N--CA 1.464 0.239 0 CA-C-N 117.995 0.897 . . . . 0.0 111.713 -178.633 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 78.2 Cg_endo -85.47 160.63 11.01 Favored 'Trans proline' 0 C--N 1.307 -1.616 0 C-N-CA 121.685 1.59 . . . . 0.0 111.259 178.923 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 16.5 pt20 -65.43 -30.59 71.4 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.127 0.417 . . . . 0.0 112.127 -179.106 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . 0.543 ' O ' ' N ' ' A' ' 50' ' ' ASN . 40.7 m-20 -80.5 8.45 7.72 Favored 'General case' 0 N--CA 1.465 0.278 0 N-CA-C 111.957 0.355 . . . . 0.0 111.957 -178.699 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' TRP . . . . . 0.441 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 61.8 t-105 -60.1 66.75 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 112.089 0.403 . . . . 0.0 112.089 -179.389 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . 0.543 ' N ' ' O ' ' A' ' 48' ' ' ASP . 0.2 OUTLIER -93.25 78.9 4.48 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 120.002 -0.679 . . . . 0.0 109.555 178.386 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -143.9 160.27 27.73 Favored Glycine 0 CA--C 1.523 0.535 0 N-CA-C 111.098 -0.801 . . . . 0.0 111.098 -179.45 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -95.03 109.22 43.18 Favored Pre-proline 0 CA--C 1.534 0.358 0 CA-C-N 115.63 -0.285 . . . . 0.0 110.694 -179.756 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -48.68 -22.53 4.56 Favored 'Trans proline' 0 N--CA 1.494 1.51 0 C-N-CA 122.391 2.061 . . . . 0.0 112.549 179.831 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 8.2 mt-30 -75.71 -24.02 56.18 Favored 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 120.497 -0.481 . . . . 0.0 111.413 -179.13 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.518 ' O ' ' CE1' ' A' ' 57' ' ' PHE . 21.7 mtm180 -94.77 155.79 38.92 Favored Pre-proline 0 C--N 1.33 -0.242 0 C-N-CA 120.838 -0.345 . . . . 0.0 110.085 179.777 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -67.05 160.8 45.61 Favored 'Trans proline' 0 C--N 1.308 -1.569 0 C-N-CA 122.753 2.302 . . . . 0.0 112.935 -179.063 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . 0.518 ' CE1' ' O ' ' A' ' 55' ' ' ARG . 58.8 m-85 -130.53 156.0 45.54 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.142 -0.936 . . . . 0.0 108.953 179.418 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -122.5 138.61 54.5 Favored 'General case' 0 C--O 1.221 -0.434 0 N-CA-C 109.063 -0.717 . . . . 0.0 109.063 178.483 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -119.86 138.3 53.48 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 112.463 0.542 . . . . 0.0 112.463 -177.876 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . 0.505 ' CZ ' ' OH ' ' A' ' 62' ' ' TYR . 31.3 mtm180 -123.92 127.68 48.34 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 177.681 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 11.2 mp -108.73 151.16 26.57 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.0 0.429 . . . . 0.0 111.053 -178.798 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' TYR . . . . . 0.505 ' OH ' ' CZ ' ' A' ' 60' ' ' ARG . 36.8 m-85 -133.42 108.6 8.77 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.29 179.539 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.446 ' CD1' ' N ' ' A' ' 63' ' ' LEU . 8.8 mp -104.47 -90.11 0.4 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.165 179.436 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -70.12 177.23 32.45 Favored Glycine 0 CA--C 1.523 0.538 0 N-CA-C 109.166 -1.574 . . . . 0.0 109.166 178.304 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.493 ' H ' ' CD1' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -73.21 -32.61 64.88 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 119.824 -0.75 . . . . 0.0 110.219 -179.544 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -102.42 9.65 39.55 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 122.846 0.459 . . . . 0.0 111.251 -179.763 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 34.3 t -106.03 96.51 4.67 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.378 0 CA-C-O 121.441 0.639 . . . . 0.0 111.997 -178.747 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 6.5 tp -113.22 117.61 32.36 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.078 -0.965 . . . . 0.0 108.421 178.514 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . 0.4 HG22 ' N ' ' A' ' 70' ' ' ARG . 3.7 mt -114.16 145.19 20.31 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-O 120.933 0.397 . . . . 0.0 111.56 -178.707 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . 0.4 ' N ' HG22 ' A' ' 69' ' ' ILE . 6.9 ptm180 -128.01 135.47 49.93 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.801 179.018 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -146.33 149.54 34.0 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.426 -179.597 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -102.96 135.62 44.29 Favored 'General case' 0 N--CA 1.463 0.184 0 N-CA-C 108.01 -1.107 . . . . 0.0 108.01 178.166 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 1.9 pt -144.37 157.89 15.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 C-N-CA 119.467 -0.893 . . . . 0.0 113.163 -177.59 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 1.3 t -123.07 155.86 36.07 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.067 178.805 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.406 ' CD1' ' C ' ' A' ' 75' ' ' LEU . 0.2 OUTLIER -65.2 118.66 9.56 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.951 0.405 . . . . 0.0 110.338 -179.65 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -97.1 -40.83 8.63 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.047 177.658 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' TRP . . . . . 0.526 ' NE1' ' HA3' ' A' ' 84' ' ' GLY . 67.2 p-90 -171.04 169.23 6.66 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.316 -179.956 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -151.27 123.86 8.47 Favored 'General case' 0 N--CA 1.464 0.226 0 N-CA-C 109.97 -0.382 . . . . 0.0 109.97 178.778 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 2.7 ttm180 -152.27 134.08 14.78 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 119.827 -0.749 . . . . 0.0 113.016 179.651 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 40.6 m-20 56.56 47.34 18.78 Favored 'General case' 0 N--CA 1.463 0.219 0 N-CA-C 113.983 1.105 . . . . 0.0 113.983 176.485 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 84.36 -27.76 4.52 Favored Glycine 0 CA--C 1.523 0.581 0 C-N-CA 120.408 -0.901 . . . . 0.0 113.452 177.23 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 4.0 mt -89.58 155.76 19.05 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 117.847 0.824 . . . . 0.0 110.439 -179.008 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 44.1 mt -128.62 135.57 49.5 Favored 'General case' 0 CA--C 1.52 -0.208 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.456 -179.136 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . 0.526 ' HA3' ' NE1' ' A' ' 77' ' ' TRP . . . -98.98 151.51 19.5 Favored Glycine 0 N--CA 1.453 -0.199 0 N-CA-C 109.691 -1.363 . . . . 0.0 109.691 178.615 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 46.5 m-85 -145.97 136.77 24.35 Favored 'General case' 0 C--N 1.32 -0.702 0 C-N-CA 120.655 -0.418 . . . . 0.0 110.46 -179.716 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -104.06 127.28 51.63 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.411 -0.588 . . . . 0.0 109.411 179.822 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 43.3 t -77.55 128.31 33.96 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.071 0.462 . . . . 0.0 111.21 -179.065 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -103.98 -27.37 12.19 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.191 179.962 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . 0.601 ' ND1' ' N ' ' A' ' 90' ' ' ILE . 0.0 OUTLIER -159.67 140.74 12.55 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.063 0.458 . . . . 0.0 110.281 179.484 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . 0.601 ' N ' ' ND1' ' A' ' 89' ' ' HIS . 8.8 tt -146.06 141.15 21.52 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 115.741 -0.663 . . . . 0.0 109.817 -179.942 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -53.71 140.41 29.61 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.086 -0.961 . . . . 0.0 112.242 -178.004 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 6.4 tt -54.63 -42.22 70.97 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.148 -0.933 . . . . 0.0 109.847 179.822 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -68.27 -36.73 79.84 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 179.225 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 4.1 m -67.59 -36.4 80.81 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.595 -0.729 . . . . 0.0 109.738 179.146 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -58.66 -38.55 72.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.757 -0.656 . . . . 0.0 109.936 179.284 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -70.9 -38.48 72.99 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.281 -0.568 . . . . 0.0 111.281 -178.735 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 60.4 m-70 . . . . . 0 C--N 1.323 -0.548 0 C-N-CA 118.929 -1.108 . . . . 0.0 108.821 179.456 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 20.5 mm . . . . . 0 CA--C 1.522 -0.113 0 CA-C-O 120.534 0.207 . . . . 0.0 110.53 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -95.25 119.72 34.24 Favored 'General case' 0 C--N 1.331 -0.225 0 C-N-CA 120.157 -0.617 . . . . 0.0 111.694 -179.744 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 6.2 p90 -150.36 159.03 44.75 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 114.876 -1.057 . . . . 0.0 108.201 177.206 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -94.99 146.47 24.23 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 119.935 -0.706 . . . . 0.0 111.176 -178.503 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -178.23 175.86 1.16 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.867 -0.606 . . . . 0.0 109.964 179.646 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -96.22 134.79 38.89 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.083 -179.615 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.58 ' O ' ' O ' ' A' ' 31' ' ' VAL . 11.4 p -134.87 154.07 51.8 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.035 0.445 . . . . 0.0 110.428 178.861 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -133.94 142.61 47.77 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 108.904 -0.776 . . . . 0.0 108.904 179.419 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 53.3 mt -122.61 136.8 58.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-O 121.429 0.633 . . . . 0.0 111.108 -179.541 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -121.94 123.81 42.56 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.133 -0.94 . . . . 0.0 110.949 -179.158 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.557 ' OE1' ' CE2' ' A' ' 57' ' ' PHE . 5.9 tt0 -126.77 131.2 51.35 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 107.876 -1.157 . . . . 0.0 107.876 178.339 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 47.47 -120.5 5.75 Favored Glycine 0 CA--C 1.528 0.876 0 N-CA-C 110.451 -1.06 . . . . 0.0 110.451 -179.234 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -105.08 13.21 31.18 Favored 'General case' 0 N--CA 1.463 0.225 0 N-CA-C 111.637 0.236 . . . . 0.0 111.637 -179.503 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.583 ' HB3' ' CZ2' ' A' ' 29' ' ' TRP . 2.6 mpt_? -111.95 133.1 54.35 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 -179.023 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.468 ' HG3' ' N ' ' A' ' 29' ' ' TRP . 0.0 OUTLIER -125.18 145.04 50.15 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.02 -0.536 . . . . 0.0 109.799 179.261 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.594 ' NE1' ' O ' ' A' ' 48' ' ' ASP . 6.3 m-90 -145.52 156.53 43.77 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.364 -0.835 . . . . 0.0 110.705 -179.03 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 16.4 mt-10 -100.6 137.94 38.34 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 178.773 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.58 ' O ' ' O ' ' A' ' 20' ' ' SER . 26.3 m -147.74 159.05 8.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-O 121.199 0.523 . . . . 0.0 111.287 -179.548 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.629 ' H ' ' CD2' ' A' ' 32' ' ' LEU . 1.4 pt? -98.38 130.04 45.03 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 108.79 -0.818 . . . . 0.0 108.79 178.652 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -93.31 126.58 38.5 Favored 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 120.179 -0.608 . . . . 0.0 109.661 -179.762 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 76.1 m-70 -91.82 -26.14 18.66 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.366 -0.834 . . . . 0.0 111.959 -178.31 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -174.01 161.03 3.6 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 119.38 -0.928 . . . . 0.0 111.354 177.443 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 3.4 p -144.22 168.74 10.39 Favored 'Isoleucine or valine' 0 C--O 1.232 0.135 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.987 -179.128 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' SER . . . . . 0.485 ' C ' ' H ' ' A' ' 39' ' ' HIS . 6.3 t -142.2 168.42 19.79 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 107.621 -1.251 . . . . 0.0 107.621 178.659 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.586 ' CD1' ' ND1' ' A' ' 39' ' ' HIS . 0.3 OUTLIER -63.81 1.02 0.69 Allowed 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 119.216 -0.994 . . . . 0.0 110.549 -179.625 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . 0.586 ' ND1' ' CD1' ' A' ' 38' ' ' LEU . 21.9 p-80 -166.53 44.51 0.06 Allowed 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 120.718 -0.393 . . . . 0.0 111.226 179.35 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -176.97 152.04 11.81 Favored Glycine 0 CA--C 1.526 0.719 0 N-CA-C 111.012 -0.835 . . . . 0.0 111.012 179.68 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -148.01 149.01 15.69 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.259 0 CA-C-O 121.545 0.688 . . . . 0.0 111.581 -179.337 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -121.34 135.04 55.14 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 114.873 -1.058 . . . . 0.0 108.191 178.488 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 20.2 m -140.61 174.71 7.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 C-N-CA 120.261 -0.576 . . . . 0.0 111.826 -178.887 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -97.41 143.99 17.05 Favored Glycine 0 CA--C 1.526 0.746 0 N-CA-C 109.497 -1.441 . . . . 0.0 109.497 178.305 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . 0.54 ' CD ' ' O ' ' A' ' 45' ' ' GLN . 0.0 OUTLIER -86.58 115.91 64.02 Favored Pre-proline 0 CA--C 1.533 0.327 0 CA-C-N 117.74 0.77 . . . . 0.0 111.729 -178.569 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 89.7 Cg_endo -84.62 161.14 12.49 Favored 'Trans proline' 0 C--N 1.308 -1.557 0 C-N-CA 121.42 1.414 . . . . 0.0 111.262 179.003 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.2 pt20 -65.3 -38.34 89.9 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 112.437 0.532 . . . . 0.0 112.437 -178.745 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . 0.594 ' O ' ' NE1' ' A' ' 29' ' ' TRP . 1.3 m-20 -74.66 8.36 2.42 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 111.87 0.322 . . . . 0.0 111.87 -178.647 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' TRP . . . . . 0.463 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 65.4 t-105 -58.57 67.98 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 112.03 0.382 . . . . 0.0 112.03 -179.534 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . 0.561 ' N ' ' O ' ' A' ' 48' ' ' ASP . 0.2 OUTLIER -93.22 78.73 4.51 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 120.086 -0.646 . . . . 0.0 109.585 178.484 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -146.15 143.75 11.98 Favored Glycine 0 CA--C 1.526 0.733 0 N-CA-C 111.242 -0.743 . . . . 0.0 111.242 -179.492 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -77.46 122.22 85.62 Favored Pre-proline 0 CA--C 1.536 0.43 0 CA-C-N 115.77 -0.215 . . . . 0.0 110.939 -179.813 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 12.7 Cg_endo -58.35 -22.69 59.43 Favored 'Trans proline' 0 N--CA 1.496 1.654 0 C-N-CA 122.698 2.266 . . . . 0.0 112.362 -179.441 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 22.2 mp0 -78.77 -23.86 45.04 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.337 -0.545 . . . . 0.0 111.69 -179.183 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.522 ' O ' ' CE1' ' A' ' 57' ' ' PHE . 42.2 mtt180 -91.1 155.41 44.77 Favored Pre-proline 0 N--CA 1.463 0.201 0 C-N-CA 120.471 -0.492 . . . . 0.0 109.921 179.772 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 44.6 Cg_endo -67.81 160.59 47.63 Favored 'Trans proline' 0 C--N 1.308 -1.601 0 C-N-CA 122.762 2.308 . . . . 0.0 113.243 -178.846 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . 0.557 ' CE2' ' OE1' ' A' ' 24' ' ' GLN . 51.5 m-85 -130.64 156.54 44.72 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 114.935 -1.029 . . . . 0.0 108.953 179.433 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 19.5 mt-10 -121.95 135.07 54.84 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 108.852 -0.796 . . . . 0.0 108.852 178.466 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -116.49 136.92 52.58 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.088 0.47 . . . . 0.0 111.56 -178.431 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . 0.503 ' CB ' ' HH ' ' A' ' 62' ' ' TYR . 7.0 mtt180 -123.65 127.77 48.7 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 108.538 -0.912 . . . . 0.0 108.538 177.848 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 6.6 mt -107.07 144.82 33.19 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.593 -0.443 . . . . 0.0 110.54 -179.184 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' TYR . . . . . 0.517 ' CD1' ' N ' ' A' ' 62' ' ' TYR . 6.5 m-85 -128.58 110.3 12.13 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.719 179.899 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 9.1 mp -105.57 -91.15 0.4 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.257 179.294 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -68.84 178.8 24.35 Favored Glycine 0 CA--C 1.521 0.461 0 N-CA-C 109.484 -1.446 . . . . 0.0 109.484 178.689 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.42 ' CD1' ' C ' ' A' ' 65' ' ' LEU . 0.9 OUTLIER -74.0 -31.4 62.94 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.015 -0.674 . . . . 0.0 110.122 -179.893 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . 0.416 ' OD1' ' O ' ' A' ' 66' ' ' ASP . 37.5 t0 -103.39 9.23 37.94 Favored 'General case' 0 C--N 1.333 -0.141 0 C-N-CA 122.663 0.385 . . . . 0.0 111.272 -179.802 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 16.4 t -104.08 95.26 3.68 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.3 0 CA-C-O 121.4 0.619 . . . . 0.0 111.761 -178.876 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 3.7 tp -111.51 117.19 32.32 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 107.859 -1.163 . . . . 0.0 107.859 178.128 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 5.1 mt -114.37 144.12 22.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-O 120.959 0.409 . . . . 0.0 111.086 -178.812 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . 0.402 HH11 ' HD3' ' A' ' 70' ' ' ARG . 4.1 ptt180 -128.28 130.6 48.1 Favored 'General case' 0 C--O 1.238 0.48 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.828 179.189 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' MET . . . . . 0.433 ' SD ' ' CD1' ' A' ' 90' ' ' ILE . 1.2 mtm -140.01 147.47 40.44 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.66 -0.7 . . . . 0.0 109.622 179.583 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -99.68 132.59 44.92 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 107.627 -1.249 . . . . 0.0 107.627 178.529 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.557 HD13 ' CG ' ' A' ' 85' ' ' PHE . 13.1 pt -142.0 157.21 20.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 C-N-CA 119.109 -1.036 . . . . 0.0 113.132 -177.467 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 2.7 p -123.65 155.48 37.67 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 114.983 -1.008 . . . . 0.0 110.021 179.219 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.476 ' CD1' ' CZ ' ' A' ' 85' ' ' PHE . 5.6 tp -66.01 119.45 11.38 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.0 0.429 . . . . 0.0 110.802 -179.699 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -97.22 -41.05 8.48 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.342 177.796 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' TRP . . . . . 0.552 ' NE1' ' HA3' ' A' ' 84' ' ' GLY . 67.8 p-90 -171.0 170.73 6.13 Favored 'General case' 0 N--CA 1.466 0.375 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.051 -179.782 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -151.28 124.11 8.58 Favored 'General case' 0 N--CA 1.465 0.289 0 N-CA-C 110.197 -0.298 . . . . 0.0 110.197 178.89 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 1.2 ttp180 -152.37 134.07 14.69 Favored 'General case' 0 CA--C 1.533 0.326 0 N-CA-C 113.148 0.796 . . . . 0.0 113.148 179.795 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 57.11 47.41 17.34 Favored 'General case' 0 N--CA 1.463 0.225 0 N-CA-C 114.124 1.157 . . . . 0.0 114.124 176.434 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 84.55 -28.64 4.28 Favored Glycine 0 CA--C 1.523 0.571 0 C-N-CA 120.382 -0.913 . . . . 0.0 113.157 177.184 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 6.4 mt -89.5 157.81 17.94 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 117.574 0.687 . . . . 0.0 110.57 -178.927 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 38.0 mt -128.74 135.25 48.94 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.833 -0.622 . . . . 0.0 111.016 -179.397 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . 0.552 ' HA3' ' NE1' ' A' ' 77' ' ' TRP . . . -95.04 152.1 20.32 Favored Glycine 0 N--CA 1.45 -0.392 0 N-CA-C 109.471 -1.451 . . . . 0.0 109.471 178.544 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' PHE . . . . . 0.557 ' CG ' HD13 ' A' ' 73' ' ' ILE . 22.5 m-85 -145.74 132.44 19.96 Favored 'General case' 0 C--N 1.32 -0.716 0 C-N-CA 120.641 -0.424 . . . . 0.0 110.675 -179.247 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.412 ' O ' ' CG ' ' A' ' 86' ' ' GLU . 7.4 pt-20 -104.02 127.45 51.58 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 179.67 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 1.8 t -74.8 125.69 29.33 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.16 0.505 . . . . 0.0 111.824 -178.685 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -100.79 -29.22 12.38 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.162 179.327 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . 0.622 ' ND1' ' N ' ' A' ' 90' ' ' ILE . 0.0 OUTLIER -160.39 141.18 11.9 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.958 0.409 . . . . 0.0 110.143 179.512 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . 0.622 ' N ' ' ND1' ' A' ' 89' ' ' HIS . 6.5 tt -145.65 140.71 22.02 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.096 -179.23 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -56.33 139.64 47.77 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 115.21 -0.905 . . . . 0.0 112.373 -178.079 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 5.5 tp -54.29 -42.29 69.88 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 115.145 -0.934 . . . . 0.0 110.431 -180.0 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 25.6 t0 -69.06 -37.76 78.69 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 179.277 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 1.2 t -68.54 -35.19 77.1 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.639 179.183 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 20.3 mt -58.64 -37.27 64.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.771 179.233 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -70.33 -40.71 73.97 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 120.278 -0.569 . . . . 0.0 110.669 -178.999 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 61.6 m-70 . . . . . 0 C--N 1.326 -0.451 0 C-N-CA 119.499 -0.88 . . . . 0.0 109.149 179.454 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.451 ' CD1' ' N ' ' A' ' 14' ' ' ILE . 1.8 mp . . . . . 0 CA--C 1.52 -0.203 0 CA-C-O 121.008 0.432 . . . . 0.0 110.21 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -94.91 120.57 35.35 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.954 -179.834 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -149.48 153.43 37.23 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.058 -0.974 . . . . 0.0 108.453 178.399 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -95.36 149.64 21.15 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 120.299 -0.56 . . . . 0.0 111.149 -178.503 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . 178.39 178.78 0.38 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.802 -0.635 . . . . 0.0 109.99 179.626 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -96.36 134.71 39.16 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.892 -179.941 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.67 ' O ' ' O ' ' A' ' 31' ' ' VAL . 5.8 p -136.5 159.03 43.02 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.34 179.169 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.414 ' C ' ' OE1' ' A' ' 21' ' ' GLU . 0.5 OUTLIER -146.71 146.23 30.26 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 178.674 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 1.1 mm -120.37 136.47 57.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-O 121.208 0.528 . . . . 0.0 111.645 -178.091 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -121.25 123.11 41.42 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.836 -179.902 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.575 ' OE1' ' CE2' ' A' ' 57' ' ' PHE . 22.9 tt0 -130.39 102.27 6.11 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.303 -0.862 . . . . 0.0 109.775 179.028 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 79.89 -126.51 7.48 Favored Glycine 0 CA--C 1.525 0.657 0 N-CA-C 110.053 -1.219 . . . . 0.0 110.053 -179.022 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.4 pm0 -100.61 10.89 40.58 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.816 0.341 . . . . 0.0 110.213 179.444 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.545 ' HB3' ' CZ2' ' A' ' 29' ' ' TRP . 6.5 mtt180 -112.56 133.82 54.4 Favored 'General case' 0 CA--C 1.52 -0.175 0 N-CA-C 112.228 0.455 . . . . 0.0 112.228 -178.758 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 74.7 ttt180 -128.02 149.2 50.47 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.182 179.417 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.545 ' CZ2' ' HB3' ' A' ' 27' ' ' ARG . 6.7 m-90 -147.15 155.54 42.22 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.246 -179.079 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . 0.519 ' CD ' ' H ' ' A' ' 30' ' ' GLU . 3.0 mp0 -101.5 137.89 39.23 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 179.566 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.67 ' O ' ' O ' ' A' ' 20' ' ' SER . 19.2 m -146.71 157.45 10.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 121.261 0.553 . . . . 0.0 111.16 -179.768 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.714 ' H ' ' CD2' ' A' ' 32' ' ' LEU . 1.6 pt? -96.17 130.27 43.27 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 108.614 -0.884 . . . . 0.0 108.614 178.363 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.478 ' N ' ' HG ' ' A' ' 20' ' ' SER . 1.7 tt -91.47 125.97 36.39 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.241 0.543 . . . . 0.0 110.088 -179.329 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 75.2 m-70 -91.85 -28.57 17.24 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.225 -0.898 . . . . 0.0 111.86 -178.5 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 2.0 p30 -173.39 162.99 4.42 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 119.412 -0.915 . . . . 0.0 111.461 177.632 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 7.3 p -145.48 168.01 8.65 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.084 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.777 -179.193 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 6.5 t -141.78 170.39 15.81 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 107.907 -1.145 . . . . 0.0 107.907 179.042 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -66.11 -0.62 2.55 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 119.488 -0.885 . . . . 0.0 110.832 -178.909 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . 0.43 ' NE2' ' O ' ' A' ' 87' ' ' CYS . 3.0 t60 -163.09 40.03 0.1 Allowed 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 120.682 -0.407 . . . . 0.0 111.128 179.713 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -175.05 155.38 20.46 Favored Glycine 0 CA--C 1.526 0.749 0 N-CA-C 111.144 -0.782 . . . . 0.0 111.144 179.849 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -148.2 148.94 15.69 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.204 0 CA-C-O 121.359 0.599 . . . . 0.0 111.375 -179.17 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -122.09 137.33 54.85 Favored 'General case' 0 N--CA 1.462 0.134 0 CA-C-N 115.133 -0.94 . . . . 0.0 108.642 178.932 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 19.8 m -141.39 174.88 6.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 C-N-CA 120.27 -0.572 . . . . 0.0 111.788 -179.181 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -96.58 145.25 17.75 Favored Glycine 0 CA--C 1.529 0.968 0 N-CA-C 109.572 -1.411 . . . . 0.0 109.572 178.257 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.4 tm0? -87.34 114.18 57.45 Favored Pre-proline 0 N--CA 1.465 0.283 0 CA-C-N 117.877 0.839 . . . . 0.0 111.947 -178.518 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 94.3 Cg_endo -85.26 161.42 11.34 Favored 'Trans proline' 0 C--N 1.309 -1.524 0 C-N-CA 121.714 1.609 . . . . 0.0 111.723 179.082 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.428 ' HG2' ' H ' ' A' ' 48' ' ' ASP . 0.5 OUTLIER -65.57 -40.32 92.63 Favored 'General case' 0 CA--C 1.532 0.277 0 N-CA-C 112.439 0.533 . . . . 0.0 112.439 -179.081 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . 0.531 ' O ' ' NE1' ' A' ' 29' ' ' TRP . 37.7 m-20 -72.85 8.06 1.7 Allowed 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 111.839 0.311 . . . . 0.0 111.839 -178.565 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' TRP . . . . . 0.448 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 60.3 t-105 -60.67 68.28 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.712 -179.58 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . 0.531 ' N ' ' O ' ' A' ' 48' ' ' ASP . 0.6 OUTLIER -93.22 78.78 4.51 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 120.207 -0.597 . . . . 0.0 109.572 178.643 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -141.45 159.54 26.77 Favored Glycine 0 CA--C 1.524 0.638 0 N-CA-C 111.31 -0.716 . . . . 0.0 111.31 -179.381 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 22.4 t0 -94.47 110.34 48.29 Favored Pre-proline 0 CA--C 1.533 0.291 0 CA-C-N 115.823 -0.189 . . . . 0.0 110.546 -179.98 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_exo -46.39 -22.72 1.76 Allowed 'Trans proline' 0 N--CA 1.495 1.579 0 C-N-CA 122.647 2.232 . . . . 0.0 112.393 -179.919 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . 0.612 HE21 ' NH1' ' A' ' 55' ' ' ARG . 16.0 mt-30 -79.61 -24.05 42.24 Favored 'General case' 0 C--N 1.326 -0.444 0 C-N-CA 120.648 -0.421 . . . . 0.0 111.815 -178.751 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.612 ' NH1' HE21 ' A' ' 54' ' ' GLN . 0.0 OUTLIER -93.55 150.72 39.32 Favored Pre-proline 0 C--N 1.329 -0.283 0 C-N-CA 120.531 -0.468 . . . . 0.0 110.166 179.941 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . 0.453 ' O ' ' OE1' ' A' ' 24' ' ' GLN . 35.9 Cg_endo -64.43 160.68 38.18 Favored 'Trans proline' 0 N--CA 1.495 1.582 0 C-N-CA 122.841 2.361 . . . . 0.0 113.421 -178.655 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . 0.578 ' CE1' ' O ' ' A' ' 55' ' ' ARG . 50.4 m-85 -131.22 157.02 44.34 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 114.845 -1.07 . . . . 0.0 109.134 179.594 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 83.5 mt-10 -122.72 137.18 54.99 Favored 'General case' 0 N--CA 1.468 0.444 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 178.535 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -116.29 135.41 53.91 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.026 0.441 . . . . 0.0 111.894 -178.44 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 39.2 mmt-85 -122.05 127.22 49.96 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 107.757 -1.201 . . . . 0.0 107.757 177.141 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.413 ' CD1' ' N ' ' A' ' 61' ' ' LEU . 9.0 mp -112.07 151.23 29.63 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.945 0.402 . . . . 0.0 111.21 -178.447 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 9.4 m-85 -131.32 108.45 9.66 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.447 179.471 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -103.93 -84.58 0.47 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.65 -0.704 . . . . 0.0 109.232 179.521 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -76.09 175.96 51.94 Favored Glycine 0 CA--C 1.521 0.438 0 N-CA-C 108.76 -1.736 . . . . 0.0 108.76 178.065 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 9.8 mt -72.5 -32.64 66.33 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 119.537 -0.865 . . . . 0.0 110.103 -179.557 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -102.84 9.53 38.88 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 122.912 0.485 . . . . 0.0 111.034 -179.842 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 9.1 t -106.71 96.61 4.76 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.343 0 CA-C-O 121.4 0.619 . . . . 0.0 111.738 -179.108 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 6.4 tp -112.24 117.35 32.29 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 108.032 -1.099 . . . . 0.0 108.032 178.168 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 5.7 mt -112.55 143.43 22.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.86 0.362 . . . . 0.0 111.222 -178.648 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 11.1 mtm180 -128.05 130.65 48.6 Favored 'General case' 0 C--O 1.238 0.463 0 CA-C-O 121.224 0.535 . . . . 0.0 111.346 179.715 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 2.4 mtp -140.28 148.56 41.62 Favored 'General case' 0 C--N 1.334 -0.1 0 CA-C-N 115.535 -0.757 . . . . 0.0 109.881 179.666 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 27.8 tt0 -106.51 125.54 51.12 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 107.793 -1.188 . . . . 0.0 107.793 177.997 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.457 HD13 ' CG ' ' A' ' 85' ' ' PHE . 9.9 pt -133.09 160.26 42.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 N-CA-C 113.279 0.844 . . . . 0.0 113.279 -176.945 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 37.6 m -121.67 151.87 39.98 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 114.564 -1.198 . . . . 0.0 109.357 178.763 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.515 ' CD1' ' CZ ' ' A' ' 85' ' ' PHE . 6.3 tp -67.09 123.02 19.08 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.297 0.57 . . . . 0.0 110.5 -179.679 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -97.81 -41.84 7.86 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 115.146 -0.934 . . . . 0.0 110.667 178.241 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' TRP . . . . . 0.56 ' NE1' ' HA3' ' A' ' 84' ' ' GLY . 67.5 p-90 -170.51 168.64 7.66 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.356 -179.349 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -147.46 123.87 10.98 Favored 'General case' 0 N--CA 1.465 0.299 0 N-CA-C 109.95 -0.389 . . . . 0.0 109.95 178.67 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 38.6 ttt180 -152.3 133.76 14.52 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 119.944 -0.703 . . . . 0.0 112.826 179.931 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . 0.452 ' O ' ' OD1' ' A' ' 80' ' ' ASP . 33.4 t0 56.98 47.22 18.04 Favored 'General case' 0 N--CA 1.463 0.181 0 N-CA-C 113.951 1.093 . . . . 0.0 113.951 176.585 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 82.29 -27.42 3.62 Favored Glycine 0 CA--C 1.524 0.597 0 C-N-CA 120.397 -0.906 . . . . 0.0 113.162 177.28 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 6.9 mt -89.5 156.73 18.45 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 117.672 0.736 . . . . 0.0 110.447 -179.084 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 36.2 mt -128.88 135.51 49.17 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.202 -179.282 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . 0.56 ' HA3' ' NE1' ' A' ' 77' ' ' TRP . . . -96.18 153.19 20.46 Favored Glycine 0 N--CA 1.45 -0.424 0 N-CA-C 109.576 -1.409 . . . . 0.0 109.576 178.692 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' PHE . . . . . 0.515 ' CZ ' ' CD1' ' A' ' 75' ' ' LEU . 26.6 m-85 -145.62 132.36 20.0 Favored 'General case' 0 C--N 1.317 -0.808 0 C-N-CA 120.792 -0.363 . . . . 0.0 110.733 -179.298 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.463 ' CG ' HE21 ' A' ' 88' ' ' GLN . 6.5 pt-20 -103.66 126.21 50.66 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 108.632 -0.877 . . . . 0.0 108.632 179.059 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . 0.43 ' O ' ' NE2' ' A' ' 39' ' ' HIS . 7.8 t -64.55 119.6 10.77 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 112.278 0.473 . . . . 0.0 112.278 -177.984 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . 0.463 HE21 ' CG ' ' A' ' 86' ' ' GLU . 46.8 mm-40 -89.32 -37.82 14.62 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.693 179.323 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . 0.412 ' ND1' ' N ' ' A' ' 90' ' ' ILE . 0.0 OUTLIER -164.66 144.85 7.55 Favored 'General case' 0 C--O 1.222 -0.375 0 CA-C-N 115.716 -0.674 . . . . 0.0 109.82 179.928 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . 0.412 ' N ' ' ND1' ' A' ' 89' ' ' HIS . 7.2 tt -143.81 140.45 25.47 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-O 121.407 0.623 . . . . 0.0 110.063 -179.814 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . 0.503 ' CB ' ' OG ' ' A' ' 94' ' ' SER . 0.2 OUTLIER -57.38 141.08 48.46 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 115.001 -1.0 . . . . 0.0 112.084 -178.001 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 3.2 tp -54.36 -42.06 69.85 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.254 -0.885 . . . . 0.0 110.403 -179.84 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -65.1 -42.94 93.55 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 179.295 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' SER . . . . . 0.503 ' OG ' ' CB ' ' A' ' 91' ' ' ASP . 1.1 p -66.86 -35.45 80.07 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.718 179.184 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 31.3 mt -58.73 -38.33 71.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.248 179.769 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -69.79 -37.7 76.41 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 119.876 -0.73 . . . . 0.0 111.422 -177.945 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 60.3 m-70 . . . . . 0 C--N 1.326 -0.435 0 C-N-CA 119.567 -0.853 . . . . 0.0 109.578 179.767 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.61 ' N ' HE22 ' A' ' 4' ' ' GLN . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.613 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.501 ' H ' ' CD ' ' A' ' 4' ' ' GLN . 39.9 t -101.97 -119.45 0.18 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.385 -0.371 . . . . 0.0 110.363 179.964 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . 0.407 ' N ' ' OG ' ' A' ' 2' ' ' SER . 6.0 m-20 -92.85 26.95 2.54 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.916 179.828 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . 0.679 ' O ' ' N ' ' A' ' 6' ' ' ASP . 0.0 OUTLIER -112.78 -18.02 12.4 Favored 'General case' 0 N--CA 1.463 0.188 0 C-N-CA 120.83 -0.348 . . . . 0.0 110.56 179.517 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . 0.614 ' N ' HE21 ' A' ' 4' ' ' GLN . 0.1 OUTLIER 31.43 27.77 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 120.99 0.424 . . . . 0.0 110.793 -179.719 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . 0.679 ' N ' ' O ' ' A' ' 4' ' ' GLN . 36.2 m-20 43.43 74.57 0.11 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.384 -179.93 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -82.1 128.12 33.81 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.731 -179.393 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.628 ' NH2' ' N11' ' A' ' 501' ' ' C2E . 0.0 OUTLIER -124.88 -6.22 7.36 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 116.037 -0.528 . . . . 0.0 112.119 -179.065 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.67 ' O ' ' N ' ' A' ' 11' ' ' PHE . 1.1 ptt85 -108.27 88.79 2.81 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 120.684 -0.406 . . . . 0.0 110.212 179.811 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.569 ' C ' ' O ' ' A' ' 9' ' ' ARG . 0.0 OUTLIER 8.79 -71.28 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 115.21 -0.904 . . . . 0.0 111.608 -179.714 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . 0.67 ' N ' ' O ' ' A' ' 9' ' ' ARG . 1.5 m-85 -124.85 158.37 33.61 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 121.155 0.502 . . . . 0.0 111.235 -179.782 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . 0.556 ' ND1' ' N21' ' A' ' 502' ' ' C2E . 6.7 m-70 -54.48 -172.38 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.242 179.828 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.549 ' NH1' ' C6 ' ' A' ' 501' ' ' C2E . 31.7 mtm180 -135.95 127.06 27.98 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.068 179.892 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.51 ' H ' ' CD1' ' A' ' 14' ' ' ILE . 1.8 mp -46.5 100.06 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.093 179.874 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -95.02 120.16 34.76 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.338 0.59 . . . . 0.0 111.262 -179.675 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 5.1 p90 -150.25 158.92 44.68 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 177.668 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . 0.437 ' OD1' ' N ' ' A' ' 17' ' ' ASP . 0.1 OUTLIER -95.49 146.03 24.74 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 120.304 -0.558 . . . . 0.0 110.858 -179.028 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -178.49 176.56 1.02 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.783 179.148 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -96.54 133.63 40.76 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.023 -179.454 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.538 ' O ' ' O ' ' A' ' 31' ' ' VAL . 4.9 p -132.51 149.9 52.25 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.316 0.579 . . . . 0.0 110.201 178.378 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 12.5 mm-40 -131.0 138.97 49.92 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.435 -0.802 . . . . 0.0 108.838 179.708 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 1.1 mm -120.27 136.39 57.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-O 121.282 0.563 . . . . 0.0 110.704 -179.374 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.462 ' CD1' ' N ' ' A' ' 23' ' ' LEU . 0.0 OUTLIER -126.12 123.4 38.23 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.393 -0.821 . . . . 0.0 111.014 -179.133 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.539 ' OE1' ' CE2' ' A' ' 57' ' ' PHE . 22.1 tt0 -129.35 102.18 6.31 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.094 -0.957 . . . . 0.0 109.676 178.826 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 80.3 -127.33 7.88 Favored Glycine 0 CA--C 1.524 0.606 0 N-CA-C 109.94 -1.264 . . . . 0.0 109.94 -178.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -100.22 11.32 39.66 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.833 0.349 . . . . 0.0 110.179 179.586 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.555 ' HB3' ' CZ2' ' A' ' 29' ' ' TRP . 35.4 mtt180 -113.14 133.82 54.85 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 112.423 0.527 . . . . 0.0 112.423 -178.34 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.434 ' HG2' ' N ' ' A' ' 29' ' ' TRP . 17.2 ttt180 -128.35 149.22 50.61 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.582 179.786 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.555 ' CZ2' ' HB3' ' A' ' 27' ' ' ARG . 6.8 m-90 -146.7 155.79 42.68 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.505 -179.286 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.539 ' OE1' ' N ' ' A' ' 30' ' ' GLU . 1.9 mp0 -100.56 135.44 42.0 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.774 179.459 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.538 ' O ' ' O ' ' A' ' 20' ' ' SER . 15.4 m -145.61 157.33 12.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-O 121.315 0.579 . . . . 0.0 111.026 -179.612 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.736 ' H ' ' CD2' ' A' ' 32' ' ' LEU . 1.5 pt? -96.86 130.57 44.12 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 178.759 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -91.97 125.0 36.5 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.278 0.561 . . . . 0.0 109.908 -179.512 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 69.6 m-70 -91.4 -28.54 17.61 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.307 -0.861 . . . . 0.0 111.662 -178.695 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 -172.66 161.07 4.76 Favored 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 119.484 -0.886 . . . . 0.0 111.08 177.577 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 4.6 p -145.56 169.08 7.3 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.243 -178.894 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' SER . . . . . 0.494 ' CB ' HN22 ' A' ' 501' ' ' C2E . 32.1 t -142.18 169.59 17.31 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 107.894 -1.15 . . . . 0.0 107.894 178.348 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 2.6 mt -66.36 -0.82 2.88 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 119.793 -0.763 . . . . 0.0 110.856 -179.461 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . 0.546 ' CE1' ' O ' ' A' ' 87' ' ' CYS . 36.3 t60 -159.72 40.17 0.2 Allowed 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 120.664 -0.415 . . . . 0.0 111.472 -179.908 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . 0.473 ' HA3' ' N3 ' ' A' ' 501' ' ' C2E . . . -179.83 157.74 20.82 Favored Glycine 0 CA--C 1.525 0.681 0 N-CA-C 111.021 -0.832 . . . . 0.0 111.021 179.803 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -148.47 148.83 15.67 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.259 0 CA-C-O 121.382 0.61 . . . . 0.0 111.628 -178.804 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -121.95 137.4 54.81 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 115.016 -0.993 . . . . 0.0 108.759 178.664 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 32.7 m -141.98 174.53 6.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-O 121.214 0.531 . . . . 0.0 111.534 -179.447 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -96.43 145.48 17.85 Favored Glycine 0 CA--C 1.528 0.882 0 N-CA-C 109.506 -1.438 . . . . 0.0 109.506 178.39 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . 0.463 ' O ' ' OE1' ' A' ' 45' ' ' GLN . 1.9 tm0? -86.86 115.19 61.62 Favored Pre-proline 0 N--CA 1.464 0.235 0 CA-C-N 117.88 0.84 . . . . 0.0 111.838 -178.492 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 97.4 Cg_endo -84.92 160.55 11.86 Favored 'Trans proline' 0 C--N 1.307 -1.613 0 C-N-CA 121.51 1.473 . . . . 0.0 111.22 178.715 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.601 ' H ' ' NE2' ' A' ' 47' ' ' GLN . 3.7 mp0 -65.33 -40.4 93.66 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 112.422 0.527 . . . . 0.0 112.422 -178.677 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . 0.549 ' O ' ' N ' ' A' ' 50' ' ' ASN . 46.8 t0 -73.09 8.37 1.65 Allowed 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 111.89 0.33 . . . . 0.0 111.89 -178.592 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' TRP . . . . . 0.444 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 60.6 t-105 -59.3 69.62 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 111.828 0.307 . . . . 0.0 111.828 -179.579 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . 0.549 ' N ' ' O ' ' A' ' 48' ' ' ASP . 0.5 OUTLIER -93.21 79.06 4.5 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 120.439 -0.505 . . . . 0.0 110.024 178.909 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -142.94 161.25 27.54 Favored Glycine 0 CA--C 1.526 0.765 0 N-CA-C 111.417 -0.673 . . . . 0.0 111.417 -179.44 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -95.44 109.94 48.08 Favored Pre-proline 0 CA--C 1.535 0.366 0 N-CA-C 110.512 -0.181 . . . . 0.0 110.512 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 78.7 Cg_exo -46.32 -22.98 1.8 Allowed 'Trans proline' 0 N--CA 1.498 1.769 0 C-N-CA 122.713 2.275 . . . . 0.0 112.813 -179.785 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 3.4 mm100 -79.86 -24.23 41.4 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 120.354 -0.539 . . . . 0.0 111.652 -178.718 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.578 ' O ' ' CE1' ' A' ' 57' ' ' PHE . 82.1 mtt180 -92.15 148.81 37.49 Favored Pre-proline 0 C--N 1.33 -0.246 0 C-N-CA 120.721 -0.391 . . . . 0.0 110.403 -179.978 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . 0.442 ' O ' ' OE1' ' A' ' 24' ' ' GLN . 29.8 Cg_endo -63.23 160.87 32.79 Favored 'Trans proline' 0 N--CA 1.497 1.724 0 C-N-CA 123.07 2.514 . . . . 0.0 113.436 -178.761 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . 0.578 ' CE1' ' O ' ' A' ' 55' ' ' ARG . 49.0 m-85 -131.12 157.3 43.49 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 114.971 -1.013 . . . . 0.0 109.161 179.419 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 64.8 mt-10 -122.21 138.46 54.47 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 178.245 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -118.98 137.08 53.76 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.316 0.487 . . . . 0.0 112.316 -178.116 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 9.4 mtm180 -123.11 127.73 49.13 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 108.379 -0.971 . . . . 0.0 108.379 177.237 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -109.88 144.16 38.75 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 120.638 -0.425 . . . . 0.0 110.736 -178.898 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' TYR . . . . . 0.431 ' CD1' ' N ' ' A' ' 62' ' ' TYR . 14.3 m-85 -125.47 109.47 12.75 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.694 179.862 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -106.17 -85.87 0.49 Allowed 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.39 -0.823 . . . . 0.0 109.488 179.579 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -74.65 176.06 48.89 Favored Glycine 0 CA--C 1.521 0.428 0 N-CA-C 109.168 -1.573 . . . . 0.0 109.168 178.46 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 2.0 mt -73.12 -33.18 65.39 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 119.667 -0.813 . . . . 0.0 110.011 -179.587 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 51.4 t0 -102.35 8.82 40.17 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.869 179.858 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 13.2 t -106.05 96.68 4.81 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.283 0 CA-C-O 121.364 0.602 . . . . 0.0 111.833 -178.832 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 7.9 tp -113.04 117.4 31.92 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 107.977 -1.12 . . . . 0.0 107.977 178.089 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 8.5 mt -111.64 142.54 23.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-O 120.909 0.385 . . . . 0.0 110.881 -178.541 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 26.3 ttp180 -128.49 130.64 47.8 Favored 'General case' 0 C--O 1.24 0.553 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.343 179.824 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' MET . . . . . 0.433 ' SD ' ' CD1' ' A' ' 90' ' ' ILE . 1.4 mtm -139.42 147.63 41.69 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.739 -0.664 . . . . 0.0 109.575 179.238 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 22.0 tt0 -104.75 124.5 49.52 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 107.529 -1.286 . . . . 0.0 107.529 178.273 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 2.7 pt -134.34 160.75 41.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 C-N-CA 119.673 -0.811 . . . . 0.0 113.0 -177.162 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 35.5 m -121.13 152.2 39.0 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.057 -0.974 . . . . 0.0 109.46 178.804 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.46 ' CD1' ' CZ ' ' A' ' 85' ' ' PHE . 10.2 tp -66.44 123.36 19.8 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.274 0.559 . . . . 0.0 109.97 -179.659 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -97.68 -41.7 7.98 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.854 178.373 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' TRP . . . . . 0.535 ' NE1' ' HA3' ' A' ' 84' ' ' GLY . 65.9 p-90 -171.22 165.04 7.3 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.556 -179.121 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -143.59 123.98 13.89 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 109.622 -0.511 . . . . 0.0 109.622 178.437 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 6.7 ttt180 -152.1 133.46 14.5 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 119.634 -0.826 . . . . 0.0 112.96 179.868 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 3.6 t70 57.01 47.03 18.32 Favored 'General case' 0 N--CA 1.462 0.139 0 N-CA-C 113.735 1.013 . . . . 0.0 113.735 176.804 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 82.56 -26.68 3.98 Favored Glycine 0 CA--C 1.523 0.532 0 C-N-CA 120.445 -0.883 . . . . 0.0 113.263 177.238 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 5.0 mt -89.66 159.21 17.24 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 117.631 0.715 . . . . 0.0 110.362 -179.11 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 44.0 mt -132.0 135.73 46.75 Favored 'General case' 0 CA--C 1.516 -0.356 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.344 -179.16 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . 0.535 ' HA3' ' NE1' ' A' ' 77' ' ' TRP . . . -102.58 154.0 18.39 Favored Glycine 0 N--CA 1.452 -0.278 0 N-CA-C 109.758 -1.337 . . . . 0.0 109.758 178.714 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . 0.46 ' CZ ' ' CD1' ' A' ' 75' ' ' LEU . 50.5 m-85 -145.36 136.55 24.89 Favored 'General case' 0 C--N 1.318 -0.763 0 C-N-CA 120.921 -0.312 . . . . 0.0 110.45 -179.66 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -104.01 128.96 51.6 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 179.53 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . 0.546 ' O ' ' CE1' ' A' ' 39' ' ' HIS . 42.9 t -69.38 120.45 15.2 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 112.378 0.51 . . . . 0.0 112.378 -178.237 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . 0.538 HE21 ' C ' ' A' ' 87' ' ' CYS . 5.0 mm-40 -94.58 -34.79 12.51 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.075 178.935 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . 0.449 ' ND1' ' C ' ' A' ' 89' ' ' HIS . 0.0 OUTLIER -161.41 141.89 10.9 Favored 'General case' 0 C--O 1.223 -0.338 0 CA-C-N 116.187 -0.46 . . . . 0.0 109.848 179.761 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . 0.433 ' CD1' ' SD ' ' A' ' 71' ' ' MET . 6.0 tt -145.04 140.9 23.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-O 121.332 0.587 . . . . 0.0 110.465 -178.833 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -56.9 142.86 39.78 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 115.153 -0.931 . . . . 0.0 112.297 -178.455 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 5.0 tp -54.28 -42.04 69.57 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 114.892 -1.049 . . . . 0.0 110.319 -179.343 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 26.3 t0 -68.3 -42.65 79.15 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.04 179.603 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 14.8 m -60.07 -38.39 82.7 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.062 179.5 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 50.8 mt -58.79 -38.46 72.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.317 179.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -70.97 -40.79 71.73 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.235 -0.586 . . . . 0.0 111.157 -179.204 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' HIS . . . . . 0.483 ' ND1' ' NH2' ' A' ' 100' ' ' ARG . 60.0 m-70 -61.52 -34.86 76.26 Favored 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 119.177 -1.009 . . . . 0.0 108.704 179.87 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.2 -34.03 76.64 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 108.592 -0.892 . . . . 0.0 108.592 177.09 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.412 ' O ' ' OE2' ' A' ' 103' ' ' GLU . 3.4 mtt180 -66.02 -41.23 91.24 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 177.933 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . 0.483 ' NH2' ' ND1' ' A' ' 97' ' ' HIS . 26.3 mtm180 -59.77 -42.98 94.51 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.632 178.585 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.429 ' N ' HD22 ' A' ' 101' ' ' LEU . 3.9 mm? -64.53 -39.5 93.88 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.022 -0.535 . . . . 0.0 109.971 -179.476 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 77.4 t -68.61 -43.56 83.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.99 179.759 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . 0.563 ' OE1' ' N ' ' A' ' 103' ' ' GLU . 0.2 OUTLIER -62.76 -47.66 82.57 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.528 -179.179 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 14.4 mt -66.31 -38.56 88.01 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.814 -0.354 . . . . 0.0 110.702 -179.452 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 15.3 m120 -70.45 -26.26 63.56 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.611 179.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 3.7 tt -63.83 -43.72 95.36 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.206 -0.452 . . . . 0.0 109.983 179.759 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 94.97 -107.11 3.5 Favored Glycine 0 CA--C 1.523 0.578 0 N-CA-C 110.592 -1.003 . . . . 0.0 110.592 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -163.91 -177.17 4.94 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.704 0.288 . . . . 0.0 110.314 179.817 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -45.34 143.31 1.8 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.446 179.918 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 4.5 pt-20 -145.28 -168.67 3.01 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.556 -179.857 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . 0.562 ' C ' ' H ' ' A' ' 113' ' ' GLU . 1.1 mp -114.09 -130.79 0.31 Allowed 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.82 -179.621 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.647 ' O ' ' N ' ' A' ' 114' ' ' ARG . 7.9 mt 59.17 -1.07 0.13 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.743 -179.833 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . 0.562 ' H ' ' C ' ' A' ' 111' ' ' LEU . 4.5 mm-40 36.06 -83.22 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.353 179.798 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . 0.647 ' N ' ' O ' ' A' ' 112' ' ' LEU . 8.5 mpt_? -24.0 -68.43 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.457 -179.533 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 43.2 mm-40 -39.65 -43.88 1.42 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.947 -179.646 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.557 ' N ' ' O ' ' A' ' 113' ' ' GLU . 6.0 tp -67.21 -42.44 84.12 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.838 -179.945 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' ALA . . . . . 0.524 ' O ' ' CG2' ' A' ' 120' ' ' VAL . . . -68.97 -23.06 64.08 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.234 179.67 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 58.0 mt -53.71 -30.35 43.37 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 120.808 -0.357 . . . . 0.0 110.462 -178.841 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 21.5 mt -57.63 -24.91 59.04 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 178.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . 0.524 ' CG2' ' O ' ' A' ' 117' ' ' ALA . 63.7 t -58.39 -43.72 87.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 115.397 -0.819 . . . . 0.0 111.571 -179.782 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 54.3 p -65.61 -11.32 43.38 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 112.273 0.471 . . . . 0.0 112.273 -178.023 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -111.02 -86.9 0.54 Allowed 'General case' 0 N--CA 1.464 0.246 0 C-N-CA 120.314 -0.554 . . . . 0.0 111.72 -179.471 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . 0.758 ' CG ' ' H ' ' A' ' 124' ' ' ASP . 5.0 t-80 -127.58 -154.55 0.64 Allowed 'General case' 0 N--CA 1.464 0.249 0 CA-C-O 121.213 0.53 . . . . 0.0 112.297 -178.526 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . 0.758 ' H ' ' CG ' ' A' ' 123' ' ' HIS . 99.4 m-20 27.9 51.66 0.05 OUTLIER 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 114.965 -1.016 . . . . 0.0 111.027 -179.319 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' ASP . . . . . 0.46 ' CB ' ' O ' ' A' ' 124' ' ' ASP . 1.8 m-20 . . . . . 0 C--O 1.22 -0.468 0 CA-C-O 118.057 -0.973 . . . . 0.0 110.742 179.312 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 501' ' ' C2E . . . . . 0.904 ' O21' " H4'" ' A' ' 501' ' ' C2E . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 502' ' ' C2E . . . . . 0.556 ' N21' ' ND1' ' A' ' 12' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.532 ' N ' ' SD ' ' A' ' 1' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.555 0 N-CA-C 109.341 -0.614 . . . . 0.0 109.341 . . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.448 ' O ' ' NE2' ' A' ' 4' ' ' GLN . 3.5 m -166.76 43.59 0.06 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.719 -179.89 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -99.45 107.64 19.9 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 178.353 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . 0.787 ' O ' ' CG ' ' A' ' 5' ' ' HIS . 1.1 mp0 -113.92 -20.35 11.1 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.148 -0.933 . . . . 0.0 109.724 178.308 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . 0.787 ' CG ' ' O ' ' A' ' 4' ' ' GLN . 1.6 p-80 117.28 7.33 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.516 0 O-C-N 124.41 1.069 . . . . 0.0 109.438 -179.628 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . 0.443 ' O ' ' O ' ' A' ' 5' ' ' HIS . 78.9 m-20 -37.96 158.29 0.01 OUTLIER 'General case' 0 C--O 1.231 0.107 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.42 -179.586 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.564 ' CD ' ' H ' ' A' ' 7' ' ' GLU . 0.7 OUTLIER -95.04 134.7 37.44 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.162 0.506 . . . . 0.0 111.701 -178.945 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.619 ' NH2' ' N11' ' A' ' 501' ' ' C2E . 0.0 OUTLIER -120.68 -7.7 9.57 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.558 179.763 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.706 ' O ' ' N ' ' A' ' 11' ' ' PHE . 2.6 ptt180 -108.64 93.61 4.61 Favored 'General case' 0 N--CA 1.464 0.266 0 N-CA-C 109.667 -0.494 . . . . 0.0 109.667 179.613 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.592 HH21 ' P11' ' A' ' 501' ' ' C2E . 0.3 OUTLIER 17.76 -73.75 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 115.208 -0.906 . . . . 0.0 111.758 -179.276 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . 0.706 ' N ' ' O ' ' A' ' 9' ' ' ARG . 10.1 m-85 -150.61 168.65 23.66 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-O 120.815 0.34 . . . . 0.0 110.587 179.581 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . 0.443 ' H ' ' CD2' ' A' ' 12' ' ' HIS . 4.1 p80 -44.51 130.85 6.71 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.043 -179.841 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.58 ' NH1' ' C6 ' ' A' ' 501' ' ' C2E . 0.1 OUTLIER -89.02 149.22 23.35 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.212 179.583 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 12.2 mm -48.8 86.04 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.085 179.507 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.562 ' N ' ' O ' ' A' ' 13' ' ' ARG . . . -93.67 120.55 34.08 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.506 0.669 . . . . 0.0 111.714 -179.221 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 2.9 p90 -149.37 156.9 42.78 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 114.803 -1.09 . . . . 0.0 108.2 178.298 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -95.51 146.18 24.63 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 120.009 -0.676 . . . . 0.0 110.82 -179.106 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . 179.57 176.75 0.63 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.065 179.865 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -96.47 134.23 39.92 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.731 -179.659 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.508 ' O ' ' O ' ' A' ' 31' ' ' VAL . 6.5 p -134.06 151.89 51.6 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.16 0.505 . . . . 0.0 110.451 178.914 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 22.8 mm-40 -129.27 144.43 51.22 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.679 -0.691 . . . . 0.0 109.169 179.654 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . 0.411 HG22 HD11 ' A' ' 22' ' ' ILE . 75.4 mt -126.9 136.46 60.73 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.326 0 C-N-CA 120.352 -0.539 . . . . 0.0 110.869 -179.782 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -125.46 123.27 38.85 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.538 -0.756 . . . . 0.0 111.256 -178.893 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.548 ' OE1' ' CE2' ' A' ' 57' ' ' PHE . 23.8 tt0 -129.58 102.33 6.32 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.453 -0.794 . . . . 0.0 109.717 178.715 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 80.41 -126.23 7.31 Favored Glycine 0 CA--C 1.523 0.564 0 N-CA-C 109.789 -1.324 . . . . 0.0 109.789 -178.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -101.42 11.77 38.54 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.816 0.341 . . . . 0.0 110.277 179.58 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.536 ' HB3' ' CZ2' ' A' ' 29' ' ' TRP . 48.0 mtt180 -114.29 134.18 55.13 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 112.664 0.616 . . . . 0.0 112.664 -178.189 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 56.5 ttt180 -127.88 149.48 50.28 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.421 179.288 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.554 ' NE1' ' O ' ' A' ' 48' ' ' ASP . 7.2 m-90 -146.31 156.04 43.07 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.477 -179.568 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -100.7 135.23 42.47 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.585 179.22 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.508 ' O ' ' O ' ' A' ' 20' ' ' SER . 28.9 m -145.73 156.3 12.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 C-N-CA 120.652 -0.419 . . . . 0.0 110.83 -179.663 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -95.12 130.32 41.87 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 108.518 -0.919 . . . . 0.0 108.518 178.429 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.423 ' CB ' ' HG ' ' A' ' 20' ' ' SER . 1.5 tt -90.1 126.01 35.63 Favored 'General case' 0 C--N 1.325 -0.492 0 C-N-CA 120.203 -0.599 . . . . 0.0 110.179 -179.478 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 79.3 m-70 -90.29 -30.98 17.15 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.055 -0.975 . . . . 0.0 111.704 -178.811 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -173.67 162.31 4.08 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 119.632 -0.827 . . . . 0.0 111.434 178.303 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 4.1 p -144.75 168.77 9.21 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.112 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.117 -179.549 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' SER . . . . . 0.51 ' C ' ' H ' ' A' ' 39' ' ' HIS . 18.8 t -142.33 167.27 22.49 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 107.402 -1.333 . . . . 0.0 107.402 178.262 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 1.7 mp -62.42 1.4 0.35 Allowed 'General case' 0 C--N 1.322 -0.588 0 C-N-CA 119.412 -0.915 . . . . 0.0 110.635 -179.483 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . 0.51 ' H ' ' C ' ' A' ' 37' ' ' SER . 0.3 OUTLIER -168.34 44.89 0.04 OUTLIER 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 120.655 -0.418 . . . . 0.0 111.338 179.868 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -177.71 150.44 9.99 Favored Glycine 0 CA--C 1.527 0.782 0 N-CA-C 110.573 -1.011 . . . . 0.0 110.573 179.768 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -147.02 148.65 16.45 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.222 0 CA-C-O 121.317 0.579 . . . . 0.0 111.656 -179.082 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.1 tt -121.87 139.69 53.32 Favored 'General case' 0 N--CA 1.464 0.262 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 178.596 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 18.8 m -143.72 175.15 3.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 C-N-CA 120.129 -0.628 . . . . 0.0 112.058 -178.8 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -98.13 143.98 16.99 Favored Glycine 0 CA--C 1.528 0.853 0 N-CA-C 109.224 -1.55 . . . . 0.0 109.224 177.845 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . 0.499 ' CD ' ' O ' ' A' ' 45' ' ' GLN . 0.0 OUTLIER -86.25 120.16 72.11 Favored Pre-proline 0 CA--C 1.532 0.262 0 CA-C-N 118.075 0.938 . . . . 0.0 112.046 -178.224 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_endo -86.24 159.64 9.83 Favored 'Trans proline' 0 C--N 1.308 -1.564 0 C-N-CA 121.797 1.665 . . . . 0.0 110.906 178.278 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 65.7 mt-30 -65.38 -40.23 93.25 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.315 0.487 . . . . 0.0 112.315 -178.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . 0.554 ' O ' ' NE1' ' A' ' 29' ' ' TRP . 29.5 m-20 -73.59 8.4 1.87 Allowed 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 111.975 0.361 . . . . 0.0 111.975 -178.71 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' TRP . . . . . 0.445 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 58.9 t-105 -59.51 69.57 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 111.914 0.338 . . . . 0.0 111.914 -179.308 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . 0.551 ' N ' ' O ' ' A' ' 48' ' ' ASP . 0.2 OUTLIER -93.39 78.92 4.41 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 120.159 -0.616 . . . . 0.0 109.953 178.729 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -142.88 159.93 27.42 Favored Glycine 0 CA--C 1.524 0.632 0 N-CA-C 111.548 -0.621 . . . . 0.0 111.548 -179.647 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -94.2 111.25 52.65 Favored Pre-proline 0 CA--C 1.536 0.422 0 CA-C-N 115.543 -0.329 . . . . 0.0 110.744 -179.817 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_exo -47.99 -23.31 4.21 Favored 'Trans proline' 0 N--CA 1.497 1.721 0 C-N-CA 122.473 2.116 . . . . 0.0 112.366 179.762 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 1.7 mm100 -78.25 -24.01 47.07 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.782 -178.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.558 ' O ' ' CE1' ' A' ' 57' ' ' PHE . 44.3 mtp85 -94.54 148.9 35.72 Favored Pre-proline 0 C--N 1.331 -0.232 0 C-N-CA 120.598 -0.441 . . . . 0.0 110.138 179.94 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . 0.423 ' O ' ' OE1' ' A' ' 24' ' ' GLN . 31.1 Cg_endo -63.43 160.82 33.74 Favored 'Trans proline' 0 N--CA 1.494 1.527 0 C-N-CA 122.93 2.42 . . . . 0.0 113.337 -178.598 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . 0.558 ' CE1' ' O ' ' A' ' 55' ' ' ARG . 34.2 m-85 -130.5 158.42 39.99 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 114.8 -1.091 . . . . 0.0 108.922 179.346 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 69.3 mt-10 -121.39 135.34 55.08 Favored 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 108.644 -0.873 . . . . 0.0 108.644 178.175 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -118.02 138.15 52.41 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.281 0.562 . . . . 0.0 111.645 -177.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 47.6 mtm180 -124.71 128.11 48.29 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 178.024 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 10.2 mt -107.16 143.0 35.97 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 120.431 -0.508 . . . . 0.0 111.098 -178.522 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' TYR . . . . . 0.473 ' CD1' ' N ' ' A' ' 62' ' ' TYR . 7.7 m-85 -125.93 107.78 10.79 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.242 179.471 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.42 ' HB3' ' H ' ' A' ' 64' ' ' GLY . 1.9 tt -104.53 -85.37 0.47 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.441 -0.799 . . . . 0.0 109.436 179.688 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . 0.42 ' H ' ' HB3' ' A' ' 63' ' ' LEU . . . -74.23 178.09 44.79 Favored Glycine 0 CA--C 1.522 0.482 0 N-CA-C 109.139 -1.584 . . . . 0.0 109.139 178.403 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.518 ' CD1' ' N ' ' A' ' 65' ' ' LEU . 7.9 mp -74.63 -31.44 61.98 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 119.846 -0.742 . . . . 0.0 110.151 -179.777 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -103.84 9.5 36.86 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 123.054 0.542 . . . . 0.0 110.798 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 20.7 t -105.71 96.06 4.3 Favored 'Isoleucine or valine' 0 C--O 1.234 0.277 0 CA-C-O 121.206 0.527 . . . . 0.0 111.855 -178.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 3.8 tp -113.14 117.3 31.55 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 108.128 -1.064 . . . . 0.0 108.128 178.405 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . 0.451 HD12 HG23 ' A' ' 69' ' ' ILE . 17.7 mm -112.5 143.82 21.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 120.926 0.393 . . . . 0.0 111.049 -178.677 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.451 ' C ' ' HG2' ' A' ' 71' ' ' MET . 59.2 mtp180 -127.64 130.31 48.74 Favored 'General case' 0 C--O 1.239 0.516 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.374 179.3 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' MET . . . . . 0.451 ' HG2' ' C ' ' A' ' 70' ' ' ARG . 0.1 OUTLIER -142.4 147.69 36.61 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.223 -0.898 . . . . 0.0 109.476 -179.576 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -102.05 128.89 48.31 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 108.017 -1.105 . . . . 0.0 108.017 178.587 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.478 HD13 ' CG ' ' A' ' 85' ' ' PHE . 25.9 pt -136.77 157.62 36.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 C-N-CA 119.836 -0.746 . . . . 0.0 112.836 -177.611 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 2.0 p -122.63 155.41 36.42 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 115.068 -0.969 . . . . 0.0 109.414 178.393 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.524 ' CD1' ' CZ ' ' A' ' 85' ' ' PHE . 7.1 tp -70.43 126.13 28.76 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.591 0.71 . . . . 0.0 110.782 -179.752 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -98.36 -43.66 6.84 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 114.515 -1.22 . . . . 0.0 111.138 178.103 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' TRP . . . . . 0.649 ' NE1' ' HA3' ' A' ' 84' ' ' GLY . 69.3 p-90 -167.71 172.4 9.28 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.425 -178.884 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -151.36 123.69 8.32 Favored 'General case' 0 N--CA 1.467 0.39 0 N-CA-C 110.032 -0.358 . . . . 0.0 110.032 178.373 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 61.4 ttt180 -152.58 133.54 14.11 Favored 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 112.91 0.708 . . . . 0.0 112.91 179.842 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 25.7 t0 56.71 47.22 18.66 Favored 'General case' 0 N--CA 1.464 0.229 0 N-CA-C 114.055 1.132 . . . . 0.0 114.055 176.154 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 83.98 -27.51 4.41 Favored Glycine 0 CA--C 1.522 0.529 0 C-N-CA 120.385 -0.912 . . . . 0.0 113.242 177.128 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 4.4 mt -89.52 161.26 16.31 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 117.664 0.732 . . . . 0.0 110.41 -178.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 42.3 mt -133.93 135.36 43.52 Favored 'General case' 0 CA--C 1.518 -0.272 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.242 -179.236 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . 0.649 ' HA3' ' NE1' ' A' ' 77' ' ' TRP . . . -94.84 152.36 20.47 Favored Glycine 0 N--CA 1.451 -0.331 0 N-CA-C 109.962 -1.255 . . . . 0.0 109.962 178.999 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . 0.524 ' CZ ' ' CD1' ' A' ' 75' ' ' LEU . 29.0 m-85 -145.47 133.77 21.75 Favored 'General case' 0 C--N 1.319 -0.754 0 C-N-CA 120.985 -0.286 . . . . 0.0 110.492 -179.602 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -103.8 127.93 51.25 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 108.555 -0.905 . . . . 0.0 108.555 179.242 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 2.3 t -67.69 119.89 13.16 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.925 0.393 . . . . 0.0 111.704 -178.595 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -89.33 -36.35 15.59 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.973 179.782 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . 0.485 ' ND1' ' C ' ' A' ' 89' ' ' HIS . 0.0 OUTLIER -166.43 147.8 6.45 Favored 'General case' 0 C--O 1.224 -0.237 0 CA-C-N 116.028 -0.533 . . . . 0.0 109.921 179.371 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . 0.409 ' CD1' ' SD ' ' A' ' 71' ' ' MET . 10.4 tt -145.27 141.1 22.7 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-O 121.418 0.628 . . . . 0.0 110.568 -178.984 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . 0.504 ' CB ' ' OG ' ' A' ' 94' ' ' SER . 0.0 OUTLIER -55.6 141.56 37.04 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 115.045 -0.98 . . . . 0.0 112.27 -178.077 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 5.2 tp -54.72 -42.33 71.42 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.192 -0.913 . . . . 0.0 110.294 -179.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -68.62 -42.9 77.43 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.264 -0.425 . . . . 0.0 109.93 179.625 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' SER . . . . . 0.504 ' OG ' ' CB ' ' A' ' 91' ' ' ASP . 1.5 p -60.24 -36.32 77.47 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.022 -0.536 . . . . 0.0 109.918 179.303 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 38.2 mt -60.35 -38.77 78.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.16 179.894 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -70.44 -37.53 74.39 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 120.342 -0.543 . . . . 0.0 110.852 -178.856 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' HIS . . . . . 0.519 ' O ' ' HB2' ' A' ' 100' ' ' ARG . 67.2 m-70 -66.92 -45.53 77.6 Favored 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 119.666 -0.814 . . . . 0.0 109.385 179.668 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 2.4 tt -61.0 -33.71 73.68 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 177.906 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 9.6 mtt-85 -56.81 -37.06 70.67 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 178.309 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . 0.519 ' HB2' ' O ' ' A' ' 97' ' ' HIS . 2.3 mmp_? -56.01 -43.58 77.84 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.178 0.513 . . . . 0.0 109.849 178.517 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.471 ' CD2' ' N ' ' A' ' 101' ' ' LEU . 3.9 mm? -64.21 -39.29 93.66 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.451 -0.795 . . . . 0.0 111.022 -179.503 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . 0.58 ' O ' ' ND2' ' A' ' 105' ' ' ASN . 0.4 OUTLIER -68.3 -46.47 80.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 C-N-CA 120.504 -0.478 . . . . 0.0 110.64 -179.665 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . 0.465 ' N ' ' CG1' ' A' ' 102' ' ' VAL . 44.1 mt-10 -66.17 -43.66 86.3 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.723 -179.635 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 10.4 mt -68.31 -40.66 81.63 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 111.991 0.367 . . . . 0.0 111.991 -178.473 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . 0.58 ' ND2' ' O ' ' A' ' 102' ' ' VAL . 0.0 OUTLIER -73.94 -26.6 60.58 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.449 -0.5 . . . . 0.0 110.745 -179.542 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 2.1 mt -67.37 -42.61 83.13 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.136 179.783 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 150.88 -83.1 0.17 Allowed Glycine 0 CA--C 1.525 0.708 0 N-CA-C 110.847 -0.901 . . . . 0.0 110.847 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -170.46 123.42 0.67 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.746 0.308 . . . . 0.0 110.508 179.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . 0.555 ' O ' ' N ' ' A' ' 111' ' ' LEU . 8.0 tp10 66.33 5.72 3.86 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.019 -179.699 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 25.2 tt0 57.49 -74.28 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.789 -0.641 . . . . 0.0 111.085 179.804 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . 0.555 ' N ' ' O ' ' A' ' 109' ' ' GLU . 1.8 tp 66.07 114.15 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 -179.377 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.44 ' O ' ' O ' ' A' ' 111' ' ' LEU . 9.1 mp 60.04 129.12 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.207 -179.477 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 18.9 mt-10 -43.21 -51.64 6.0 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.808 -179.886 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . 0.473 ' HG2' ' H ' ' A' ' 115' ' ' GLU . 11.5 ttm-85 63.45 172.35 0.16 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.226 -179.767 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . 0.561 ' O ' ' CE2' ' A' ' 11' ' ' PHE . 11.3 mt-10 56.5 -92.01 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.728 180.0 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 6.9 mt -54.48 -35.48 63.13 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.561 -179.752 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -68.54 -35.58 77.64 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 119.852 -0.739 . . . . 0.0 109.843 179.823 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . 0.435 ' O ' ' O ' ' A' ' 122' ' ' ALA . 19.5 mt -54.14 -49.43 69.23 Favored 'General case' 0 N--CA 1.463 0.175 0 CA-C-N 115.48 -0.782 . . . . 0.0 111.095 -176.802 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . 0.407 ' HA ' ' O ' ' A' ' 122' ' ' ALA . 4.8 mt -65.99 -47.97 72.76 Favored 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 120.31 -0.556 . . . . 0.0 110.319 179.865 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 70.9 t -56.99 -47.46 83.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.667 -176.787 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 73.7 m -70.48 -41.11 73.15 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 119.536 -0.866 . . . . 0.0 110.33 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . 0.455 ' O ' ' OD2' ' A' ' 124' ' ' ASP . . . -148.77 159.36 44.22 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.834 -0.621 . . . . 0.0 109.855 179.796 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . 0.846 ' CG ' ' H ' ' A' ' 124' ' ' ASP . 1.9 p80 -63.32 -69.74 0.25 Allowed 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 119.666 -0.814 . . . . 0.0 109.399 178.192 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . 0.846 ' H ' ' CG ' ' A' ' 123' ' ' HIS . 2.3 m-20 66.65 57.12 0.69 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.229 179.225 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 1.2 p30 . . . . . 0 C--O 1.221 -0.447 0 CA-C-O 117.975 -1.012 . . . . 0.0 110.573 179.639 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 501' ' ' C2E . . . . . 0.619 ' N11' ' NH2' ' A' ' 8' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 502' ' ' C2E . . . . . 0.527 ' C4 ' ' CE2' ' A' ' 77' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.649 ' O ' ' CB ' ' A' ' 2' ' ' SER . 39.7 mtt . . . . . 0 N--CA 1.489 1.513 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.649 ' CB ' ' O ' ' A' ' 1' ' ' MET . 52.8 m 129.21 153.53 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.598 0 O-C-N 123.891 0.744 . . . . 0.0 110.21 179.772 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 8.8 p30 -86.14 28.34 0.83 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.013 0.435 . . . . 0.0 109.991 179.417 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . 0.561 ' O ' ' NE2' ' A' ' 4' ' ' GLN . 0.0 OUTLIER -112.4 2.24 16.34 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.19 179.534 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . 0.522 ' CD2' ' C ' ' A' ' 4' ' ' GLN . 0.6 OUTLIER 50.47 103.66 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.075 179.897 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -40.9 144.5 0.27 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.486 -179.436 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.402 ' OE1' ' N ' ' A' ' 7' ' ' GLU . 14.1 pm0 -75.91 135.49 40.1 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.408 0.623 . . . . 0.0 111.136 -179.565 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.834 ' H ' ' C61' ' A' ' 502' ' ' C2E . 0.0 OUTLIER -118.42 -12.71 9.82 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.306 179.404 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.638 ' O ' ' N ' ' A' ' 11' ' ' PHE . 9.3 mtm180 -96.91 76.83 2.75 Favored 'General case' 0 CA--C 1.514 -0.418 0 N-CA-C 109.927 -0.397 . . . . 0.0 109.927 179.914 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.702 ' NE ' ' N ' ' A' ' 10' ' ' ARG . 0.0 OUTLIER 29.17 -84.56 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.58 -0.737 . . . . 0.0 110.77 179.816 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . 0.638 ' N ' ' O ' ' A' ' 9' ' ' ARG . 0.1 OUTLIER -132.7 147.19 52.32 Favored 'General case' 0 CA--C 1.53 0.182 0 N-CA-C 109.878 -0.415 . . . . 0.0 109.878 179.19 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . 0.413 ' C ' ' O ' ' A' ' 11' ' ' PHE . 17.4 p80 -36.25 155.28 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.288 -179.467 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.558 ' CZ ' ' NH1' ' A' ' 9' ' ' ARG . 3.9 mtm180 -111.3 -176.15 2.88 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.394 179.935 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 41.1 mm -90.66 94.4 4.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.386 179.52 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -91.82 120.22 32.33 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.416 0.627 . . . . 0.0 110.99 179.907 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 3.1 p90 -149.8 158.65 44.37 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.034 -0.984 . . . . 0.0 108.423 178.18 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 3.1 p30 -95.34 144.67 25.7 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 120.184 -0.606 . . . . 0.0 110.051 -179.62 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -177.49 175.7 1.39 Allowed 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 179.697 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -96.37 134.24 39.77 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.704 -179.716 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.542 ' O ' ' O ' ' A' ' 31' ' ' VAL . 10.7 p -134.04 152.7 51.95 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.109 0.481 . . . . 0.0 110.293 178.851 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 12.0 mm-40 -129.5 141.53 50.98 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 179.625 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -122.21 135.72 61.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 C-N-CA 120.096 -0.642 . . . . 0.0 110.371 179.771 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -126.12 123.15 37.66 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.32 -0.854 . . . . 0.0 110.934 -179.133 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.582 ' OE1' ' CE2' ' A' ' 57' ' ' PHE . 22.2 tt0 -128.79 101.82 6.28 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.245 -0.889 . . . . 0.0 109.678 178.849 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 80.11 -126.77 7.59 Favored Glycine 0 CA--C 1.523 0.55 0 N-CA-C 110.138 -1.185 . . . . 0.0 110.138 -178.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -99.65 11.31 39.53 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.844 0.354 . . . . 0.0 110.325 179.57 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.527 ' HB3' ' CZ2' ' A' ' 29' ' ' TRP . 67.7 mtt180 -113.24 134.97 54.32 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 112.422 0.527 . . . . 0.0 112.422 -178.369 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 28.0 ttt180 -129.29 150.62 50.58 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.51 179.65 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.527 ' CZ2' ' HB3' ' A' ' 27' ' ' ARG . 7.0 m-90 -149.0 156.5 42.35 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.675 -178.919 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 14.7 mt-10 -100.28 134.59 42.99 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.003 179.292 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.542 ' O ' ' O ' ' A' ' 20' ' ' SER . 16.8 m -145.9 158.03 12.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 121.104 0.478 . . . . 0.0 111.306 -179.628 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.716 ' H ' ' CD2' ' A' ' 32' ' ' LEU . 1.4 pt? -97.0 130.21 44.36 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 178.505 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.4 tt -93.29 126.63 38.5 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.27 0.557 . . . . 0.0 109.731 -179.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 45.8 m-70 -92.31 -26.09 18.27 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.397 -0.819 . . . . 0.0 111.923 -178.36 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . 0.405 ' OD1' ' CZ ' ' A' ' 13' ' ' ARG . 2.3 p30 -174.24 159.45 3.15 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 119.528 -0.869 . . . . 0.0 111.12 177.652 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 6.7 p -142.82 168.89 13.14 Favored 'Isoleucine or valine' 0 C--O 1.231 0.099 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.84 -179.178 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' SER . . . . . 0.444 ' CB ' HN22 ' A' ' 501' ' ' C2E . 22.9 t -142.36 169.15 18.12 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 107.889 -1.152 . . . . 0.0 107.889 178.926 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 91.4 mt -66.23 -1.25 3.12 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 119.642 -0.823 . . . . 0.0 110.941 -179.438 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . 0.513 ' NE2' ' O ' ' A' ' 87' ' ' CYS . 3.7 t60 -161.32 38.98 0.14 Allowed 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 120.839 -0.344 . . . . 0.0 111.179 -179.847 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . 0.476 ' HA3' ' N3 ' ' A' ' 501' ' ' C2E . . . -175.77 154.67 17.98 Favored Glycine 0 CA--C 1.527 0.825 0 N-CA-C 110.929 -0.868 . . . . 0.0 110.929 179.88 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.435 HG22 HD11 ' A' ' 41' ' ' ILE . 0.1 OUTLIER -148.04 148.87 15.82 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.345 0 CA-C-O 121.389 0.614 . . . . 0.0 111.809 -178.87 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.8 tt -122.22 140.85 52.11 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 115.088 -0.96 . . . . 0.0 109.1 178.836 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 20.8 m -145.42 174.84 2.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-O 121.12 0.486 . . . . 0.0 111.633 -179.568 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -97.9 145.77 17.93 Favored Glycine 0 CA--C 1.529 0.913 0 N-CA-C 109.961 -1.256 . . . . 0.0 109.961 178.86 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 1.6 tm0? -87.64 113.76 55.85 Favored Pre-proline 0 N--CA 1.463 0.184 0 CA-C-N 117.923 0.862 . . . . 0.0 111.841 -178.574 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 77.2 Cg_endo -85.26 163.37 11.32 Favored 'Trans proline' 0 C--N 1.305 -1.752 0 C-N-CA 121.625 1.55 . . . . 0.0 111.289 178.899 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -65.39 -40.52 93.56 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 116.519 -0.309 . . . . 0.0 111.815 -179.054 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . 0.53 ' O ' ' N ' ' A' ' 50' ' ' ASN . 86.0 m-20 -71.28 8.63 0.96 Allowed 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 111.926 0.343 . . . . 0.0 111.926 -178.819 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' TRP . . . . . 0.46 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 61.8 t-105 -61.56 67.4 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 111.856 0.317 . . . . 0.0 111.856 -179.576 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . 0.533 ' ND2' ' C ' ' A' ' 50' ' ' ASN . 0.7 OUTLIER -93.1 78.71 4.57 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 178.569 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -142.7 159.34 27.28 Favored Glycine 0 CA--C 1.523 0.583 0 N-CA-C 111.239 -0.745 . . . . 0.0 111.239 -179.581 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 14.3 t0 -92.91 121.57 65.58 Favored Pre-proline 0 CA--C 1.534 0.362 0 N-CA-C 110.321 -0.251 . . . . 0.0 110.321 179.886 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -61.29 -22.38 74.44 Favored 'Trans proline' 0 N--CA 1.495 1.587 0 C-N-CA 122.477 2.118 . . . . 0.0 112.075 -179.513 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 18.7 mt-30 -77.45 -20.08 55.04 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.12 -179.492 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.471 ' O ' ' CE1' ' A' ' 57' ' ' PHE . 1.3 mtt85 -97.85 157.32 34.82 Favored Pre-proline 0 CA--C 1.531 0.215 0 CA-C-O 120.745 0.307 . . . . 0.0 110.23 179.926 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . 0.443 ' O ' ' OE1' ' A' ' 24' ' ' GLN . 55.7 Cg_endo -70.22 161.0 47.62 Favored 'Trans proline' 0 N--CA 1.495 1.606 0 C-N-CA 122.913 2.409 . . . . 0.0 113.298 -178.766 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . 0.582 ' CE2' ' OE1' ' A' ' 24' ' ' GLN . 53.3 m-85 -131.16 155.63 46.7 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.053 -0.976 . . . . 0.0 109.142 179.605 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -121.34 137.74 54.56 Favored 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 178.517 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -119.74 137.82 53.7 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.143 0.497 . . . . 0.0 111.963 -178.201 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.567 ' HE ' ' CD1' ' A' ' 68' ' ' LEU . 7.0 mmm-85 -123.43 127.56 48.6 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 108.404 -0.961 . . . . 0.0 108.404 177.612 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 12.4 mt -107.18 149.08 28.09 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.906 0.384 . . . . 0.0 110.836 -178.965 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 10.3 m-85 -134.14 111.8 10.61 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.711 -179.735 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.42 ' C ' ' CD2' ' A' ' 63' ' ' LEU . 2.9 tt -105.94 -83.35 0.52 Allowed 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 115.812 -0.631 . . . . 0.0 109.5 179.444 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . 0.404 ' H ' ' HB ' ' A' ' 67' ' ' VAL . . . -76.81 -177.12 44.42 Favored Glycine 0 CA--C 1.521 0.436 0 N-CA-C 109.326 -1.509 . . . . 0.0 109.326 178.699 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.452 ' CD1' ' N ' ' A' ' 65' ' ' LEU . 7.3 mp -75.45 -33.2 60.86 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 119.988 -0.685 . . . . 0.0 110.477 -179.612 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -102.63 8.96 39.59 Favored 'General case' 0 C--N 1.332 -0.168 0 C-N-CA 122.67 0.388 . . . . 0.0 111.323 -179.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . 0.404 ' HB ' ' H ' ' A' ' 64' ' ' GLY . 9.5 t -101.49 93.56 2.89 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.245 0 CA-C-O 121.197 0.523 . . . . 0.0 111.694 -178.864 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.567 ' CD1' ' HE ' ' A' ' 60' ' ' ARG . 1.9 tp -111.69 117.81 33.9 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 108.446 -0.946 . . . . 0.0 108.446 178.62 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 3.6 mt -115.28 144.78 22.09 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.247 0 CA-C-O 120.945 0.402 . . . . 0.0 111.155 -178.815 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -128.46 134.42 48.73 Favored 'General case' 0 C--O 1.238 0.492 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.251 179.417 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -143.75 148.15 35.22 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.439 -0.8 . . . . 0.0 109.557 179.472 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -110.82 121.49 45.47 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 107.975 -1.12 . . . . 0.0 107.975 178.509 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 4.2 pt -132.19 165.41 32.12 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 N-CA-C 113.627 0.973 . . . . 0.0 113.627 -176.621 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 3.3 p -120.09 148.96 42.96 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 114.926 -1.033 . . . . 0.0 109.642 178.71 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.439 ' CD1' ' CZ ' ' A' ' 85' ' ' PHE . 14.2 tp -66.1 124.4 22.48 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-O 121.239 0.542 . . . . 0.0 110.542 -179.002 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -98.58 -44.89 6.28 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 115.307 -0.861 . . . . 0.0 111.429 178.205 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' TRP . . . . . 0.568 ' NE1' ' HA3' ' A' ' 84' ' ' GLY . 69.2 p-90 -164.91 172.34 12.96 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.808 -179.091 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -151.3 123.78 8.4 Favored 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 178.117 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . 0.547 ' O ' ' OD1' ' A' ' 80' ' ' ASP . 5.2 ttm180 -152.2 131.81 13.1 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 119.916 -0.713 . . . . 0.0 112.617 179.891 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . 0.563 ' OD2' ' O ' ' A' ' 80' ' ' ASP . 0.6 OUTLIER 53.61 46.76 25.36 Favored 'General case' 0 N--CA 1.467 0.418 0 N-CA-C 113.699 0.999 . . . . 0.0 113.699 177.117 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 72.32 12.15 76.38 Favored Glycine 0 CA--C 1.521 0.461 0 C-N-CA 120.433 -0.889 . . . . 0.0 111.856 178.114 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 52.4 mt -116.24 140.27 49.49 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 178.734 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 35.2 mt -128.17 135.72 50.13 Favored 'General case' 0 CA--C 1.512 -0.501 0 C-N-CA 120.715 -0.394 . . . . 0.0 111.339 -178.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . 0.568 ' HA3' ' NE1' ' A' ' 77' ' ' TRP . . . -110.66 156.67 15.43 Favored Glycine 0 N--CA 1.448 -0.558 0 N-CA-C 109.317 -1.513 . . . . 0.0 109.317 178.301 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . 0.439 ' CZ ' ' CD1' ' A' ' 75' ' ' LEU . 78.4 m-85 -145.37 143.94 30.4 Favored 'General case' 0 C--N 1.312 -1.028 0 N-CA-C 110.001 -0.37 . . . . 0.0 110.001 -179.53 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 52.4 tt0 -103.64 130.16 51.06 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 179.355 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . 0.513 ' O ' ' NE2' ' A' ' 39' ' ' HIS . 4.6 t -69.26 118.67 12.44 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.492 0.553 . . . . 0.0 112.492 -177.926 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 58.7 mm-40 -92.43 -36.76 12.93 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.77 178.876 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . 0.449 ' ND1' ' C ' ' A' ' 89' ' ' HIS . 0.0 OUTLIER -164.0 143.79 8.06 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.966 179.955 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . 0.604 ' CD1' ' HG ' ' A' ' 94' ' ' SER . 9.0 tt -145.61 141.3 22.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-O 121.254 0.55 . . . . 0.0 109.994 -179.592 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -58.5 141.04 53.03 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 115.272 -0.876 . . . . 0.0 112.434 -178.029 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 6.3 tp -54.15 -41.73 68.77 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 114.853 -1.067 . . . . 0.0 110.725 -179.491 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . 0.524 ' OD1' ' N ' ' A' ' 94' ' ' SER . 2.8 p30 -68.5 -37.18 79.86 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 179.469 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' SER . . . . . 0.604 ' HG ' ' CD1' ' A' ' 90' ' ' ILE . 1.6 t -67.2 -38.45 85.36 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.08 179.337 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 56.4 mt -58.65 -37.81 67.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.324 179.886 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -70.24 -40.66 74.32 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.158 -0.617 . . . . 0.0 111.195 -178.489 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 61.2 m-70 -61.66 -36.22 80.19 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 119.359 -0.936 . . . . 0.0 109.207 179.767 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 35.6 mt -66.82 -34.13 77.14 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 177.651 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.14 -40.93 95.11 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 108.504 -0.924 . . . . 0.0 108.504 177.893 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 2.7 mmp_? -60.23 -45.28 93.78 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.157 -0.929 . . . . 0.0 110.31 178.776 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.431 ' O ' ' OD1' ' A' ' 105' ' ' ASN . 5.3 mp -63.01 -36.23 82.88 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.988 -179.803 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 71.5 t -68.31 -47.3 78.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.527 179.749 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 26.8 tt0 -65.57 -40.48 92.82 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.947 -0.569 . . . . 0.0 111.486 -179.399 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 12.5 mt -75.44 -42.57 53.07 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.718 -0.393 . . . . 0.0 111.175 -179.066 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . 0.431 ' OD1' ' O ' ' A' ' 101' ' ' LEU . 16.9 m120 -61.29 -34.23 74.88 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 120.814 -0.354 . . . . 0.0 110.711 -179.714 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 17.8 tp -59.3 -39.7 83.86 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.335 179.883 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 82.98 31.11 29.78 Favored Glycine 0 CA--C 1.524 0.63 0 N-CA-C 111.001 -0.839 . . . . 0.0 111.001 179.903 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . 0.545 ' CG ' ' H ' ' A' ' 109' ' ' GLU . 23.0 t70 -165.85 -173.64 2.75 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.853 0.359 . . . . 0.0 110.427 179.954 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . 0.545 ' H ' ' CG ' ' A' ' 108' ' ' ASP . 0.2 OUTLIER -159.17 -167.88 2.19 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.425 179.875 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 24.6 mt-10 56.88 42.59 26.19 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.033 0.444 . . . . 0.0 110.085 -179.565 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -140.39 105.93 5.1 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.049 179.911 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.568 ' N ' ' CD2' ' A' ' 112' ' ' LEU . 3.4 mm? -78.07 -113.45 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.728 -179.696 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . 0.455 ' O ' ' O ' ' A' ' 114' ' ' ARG . 56.8 mt-10 -90.99 -119.15 0.07 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.73 -179.79 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . 0.455 ' O ' ' O ' ' A' ' 113' ' ' GLU . 2.4 mtm105 55.13 110.64 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.235 -179.713 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -96.83 -31.81 12.42 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.854 0.359 . . . . 0.0 110.823 -179.68 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -66.75 -38.49 86.74 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.915 -179.712 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' ALA . . . . . 0.5 ' O ' ' CG2' ' A' ' 120' ' ' VAL . . . -69.55 -23.92 63.64 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.64 179.481 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 80.8 mt -54.78 -37.49 66.09 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.446 -0.502 . . . . 0.0 111.167 -177.898 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . 0.629 ' C ' ' H ' ' A' ' 121' ' ' SER . 2.9 mm? -56.24 -15.74 4.34 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 120.123 -0.631 . . . . 0.0 110.001 -178.439 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . 0.5 ' CG2' ' O ' ' A' ' 117' ' ' ALA . 57.4 t -56.85 0.18 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 121.014 0.435 . . . . 0.0 110.446 179.805 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' SER . . . . . 0.629 ' H ' ' C ' ' A' ' 119' ' ' LEU . 11.2 p -101.9 -33.03 9.93 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.263 179.553 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . 0.529 ' N ' ' HG ' ' A' ' 121' ' ' SER . . . -166.61 112.35 0.8 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.29 179.901 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . 0.688 ' CG ' ' N ' ' A' ' 124' ' ' ASP . 7.7 p80 -67.11 -56.95 7.84 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.811 -179.634 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . 0.688 ' N ' ' CG ' ' A' ' 123' ' ' HIS . 0.4 OUTLIER 55.62 -1.82 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.71 -179.667 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 125' ' ' ASP . . . . . 0.628 ' H ' ' C ' ' A' ' 123' ' ' HIS . 14.7 m-20 . . . . . 0 C--O 1.22 -0.488 0 CA-C-O 117.986 -1.007 . . . . 0.0 110.68 -179.853 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 501' ' ' C2E . . . . . 0.859 ' O21' " H4'" ' A' ' 501' ' ' C2E . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 502' ' ' C2E . . . . . 0.834 ' C61' ' H ' ' A' ' 8' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.444 ' C ' ' H ' ' A' ' 3' ' ' ASP . 12.1 mmt . . . . . 0 N--CA 1.491 1.582 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.424 ' C ' ' H ' ' A' ' 4' ' ' GLN . 37.3 m -78.6 35.54 0.24 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.322 179.864 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . 0.444 ' H ' ' C ' ' A' ' 1' ' ' MET . 5.3 m-20 -80.66 20.74 0.71 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.446 179.886 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . 0.716 ' O ' ' N ' ' A' ' 6' ' ' ASP . 14.8 tm0? -111.0 -11.94 14.26 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.112 179.968 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . 0.566 ' CD2' ' N ' ' A' ' 5' ' ' HIS . 0.1 OUTLIER -14.48 73.3 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 115.564 -0.744 . . . . 0.0 111.705 179.41 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . 0.716 ' N ' ' O ' ' A' ' 4' ' ' GLN . 1.6 m-20 19.98 91.87 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.14 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.598 179.794 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.432 ' OE1' ' OG ' ' A' ' 121' ' ' SER . 6.1 tt0 -95.68 125.69 40.44 Favored 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 110.093 -0.336 . . . . 0.0 110.093 179.792 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.694 ' NH2' ' N11' ' A' ' 501' ' ' C2E . 0.0 OUTLIER -125.26 -5.42 7.24 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.775 -178.947 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.525 ' O ' ' C ' ' A' ' 10' ' ' ARG . 1.1 ptt85 -111.61 84.53 1.96 Allowed 'General case' 0 N--CA 1.467 0.41 0 CA-C-O 121.119 0.485 . . . . 0.0 110.225 179.829 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.525 ' C ' ' O ' ' A' ' 9' ' ' ARG . 0.0 OUTLIER 17.33 -91.18 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 114.945 -1.025 . . . . 0.0 111.769 -179.892 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 5.2 m-85 -115.02 169.55 9.01 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-O 120.789 0.328 . . . . 0.0 110.464 -179.895 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . 0.536 ' ND1' ' N21' ' A' ' 502' ' ' C2E . 14.8 m-70 -63.39 143.13 58.07 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.499 179.964 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.525 ' NH1' ' C6 ' ' A' ' 501' ' ' C2E . 19.7 mtm180 -86.32 164.71 16.93 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.095 -179.997 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.552 ' CD1' ' N ' ' A' ' 14' ' ' ILE . 1.8 mp -73.17 97.25 0.81 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 N-CA-C 109.863 -0.421 . . . . 0.0 109.863 179.772 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -95.19 120.5 35.53 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.506 0.669 . . . . 0.0 111.623 -179.363 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -149.73 155.57 40.39 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 114.791 -1.095 . . . . 0.0 108.363 178.022 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -95.44 146.81 24.13 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 120.159 -0.616 . . . . 0.0 110.863 -178.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.405 ' O ' ' CD1' ' A' ' 32' ' ' LEU . . . -179.79 176.99 0.72 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.9 -0.591 . . . . 0.0 109.926 179.598 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -96.12 133.88 39.86 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.79 -179.855 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.583 ' O ' ' O ' ' A' ' 31' ' ' VAL . 13.0 t -133.8 152.86 52.0 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.186 0.517 . . . . 0.0 110.215 178.692 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.538 ' OE1' ' NH2' ' A' ' 28' ' ' ARG . 97.0 mt-10 -129.09 155.67 45.09 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 109.136 -0.691 . . . . 0.0 109.136 179.291 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . 0.463 ' HA ' ' O ' ' A' ' 58' ' ' GLU . 34.2 mt -138.47 136.36 43.94 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.437 0 C-N-CA 120.005 -0.678 . . . . 0.0 111.263 -179.603 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.561 ' CD1' ' HE ' ' A' ' 60' ' ' ARG . 0.0 OUTLIER -125.29 127.79 47.23 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.419 -0.809 . . . . 0.0 111.261 -178.793 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.469 ' O ' ' OE1' ' A' ' 24' ' ' GLN . 1.6 tm0? -132.49 101.95 5.53 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.082 -0.963 . . . . 0.0 109.532 178.519 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 80.71 -126.51 7.43 Favored Glycine 0 CA--C 1.523 0.554 0 N-CA-C 110.111 -1.195 . . . . 0.0 110.111 -178.729 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.613 ' OE1' ' N ' ' A' ' 26' ' ' GLU . 6.0 pm0 -100.68 13.21 35.58 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 110.084 -0.339 . . . . 0.0 110.084 179.583 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.529 ' HB3' ' CZ2' ' A' ' 29' ' ' TRP . 33.5 mtt180 -114.54 135.83 53.69 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 112.755 0.65 . . . . 0.0 112.755 -178.312 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.538 ' NH2' ' OE1' ' A' ' 21' ' ' GLU . 26.7 ttt180 -128.74 148.7 50.87 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.174 179.206 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.529 ' CZ2' ' HB3' ' A' ' 27' ' ' ARG . 6.7 m-90 -147.2 156.13 42.7 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.655 -179.144 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 18.8 mt-10 -100.34 138.54 37.27 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 178.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.583 ' O ' ' O ' ' A' ' 20' ' ' SER . 12.0 m -148.06 157.96 8.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-O 121.223 0.535 . . . . 0.0 111.274 -179.454 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.405 ' CD1' ' O ' ' A' ' 18' ' ' ALA . 8.3 tp -98.31 130.03 45.0 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 108.301 -1.0 . . . . 0.0 108.301 178.816 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.4 ' N ' HD11 ' A' ' 32' ' ' LEU . 0.8 OUTLIER -92.12 125.96 37.01 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 120.334 -0.547 . . . . 0.0 109.881 179.895 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 73.3 m-70 -90.48 -28.74 18.36 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.418 -0.81 . . . . 0.0 111.742 -178.706 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -171.98 162.23 5.88 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 119.493 -0.883 . . . . 0.0 111.283 177.568 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 4.8 p -146.04 168.88 6.64 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.11 0 CA-C-N 115.782 -0.645 . . . . 0.0 111.193 -178.798 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' SER . . . . . 0.472 ' CB ' HN22 ' A' ' 501' ' ' C2E . 23.0 t -142.11 168.46 19.69 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 107.632 -1.247 . . . . 0.0 107.632 178.513 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 3.6 tp -64.41 -0.6 1.36 Allowed 'General case' 0 C--N 1.322 -0.588 0 C-N-CA 119.555 -0.858 . . . . 0.0 110.795 -179.277 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . 0.422 ' H ' ' C ' ' A' ' 37' ' ' SER . 2.0 p80 -162.25 43.16 0.13 Allowed 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 120.693 -0.403 . . . . 0.0 111.41 179.747 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . 0.448 ' HA3' ' N3 ' ' A' ' 501' ' ' C2E . . . 179.83 156.58 18.18 Favored Glycine 0 CA--C 1.528 0.898 0 N-CA-C 111.039 -0.824 . . . . 0.0 111.039 179.765 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -148.57 148.76 15.69 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.355 0 CA-C-O 121.453 0.644 . . . . 0.0 111.664 -178.745 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -121.83 132.29 54.51 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 115.069 -0.969 . . . . 0.0 108.53 178.79 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 31.7 m -136.62 174.84 11.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 121.316 0.579 . . . . 0.0 112.078 -179.172 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -98.57 144.56 17.3 Favored Glycine 0 CA--C 1.526 0.725 0 N-CA-C 109.263 -1.535 . . . . 0.0 109.263 178.109 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . 0.516 ' CD ' ' O ' ' A' ' 45' ' ' GLN . 0.0 OUTLIER -87.16 117.73 69.01 Favored Pre-proline 0 CA--C 1.534 0.33 0 CA-C-N 118.052 0.926 . . . . 0.0 111.862 -178.284 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 74.6 Cg_endo -85.85 160.16 10.43 Favored 'Trans proline' 0 C--N 1.306 -1.673 0 C-N-CA 121.772 1.648 . . . . 0.0 111.576 178.89 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 24.0 mm-40 -65.2 -25.33 67.66 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 112.291 0.478 . . . . 0.0 112.291 -178.888 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . 0.532 ' O ' ' N ' ' A' ' 50' ' ' ASN . 3.3 m-20 -86.68 8.82 20.84 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 111.661 0.245 . . . . 0.0 111.661 -178.897 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' TRP . . . . . 0.463 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 59.3 t-105 -60.56 66.9 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 112.265 0.468 . . . . 0.0 112.265 -179.421 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . 0.557 ' C ' HD21 ' A' ' 50' ' ' ASN . 0.2 OUTLIER -93.16 78.66 4.54 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 120.047 -0.661 . . . . 0.0 109.246 178.105 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -145.65 146.25 16.24 Favored Glycine 0 CA--C 1.523 0.54 0 N-CA-C 111.601 -0.6 . . . . 0.0 111.601 -179.07 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -77.75 121.97 84.99 Favored Pre-proline 0 C--N 1.328 -0.365 0 CA-C-N 115.427 -0.386 . . . . 0.0 110.714 -179.969 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 21.5 Cg_endo -62.12 -22.41 74.16 Favored 'Trans proline' 0 N--CA 1.496 1.634 0 C-N-CA 122.61 2.207 . . . . 0.0 112.113 -179.757 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 15.8 mt-30 -77.19 -24.19 51.41 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 120.477 -0.489 . . . . 0.0 111.429 -179.2 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.535 ' O ' ' CE1' ' A' ' 57' ' ' PHE . 17.1 mtp85 -92.88 155.42 41.56 Favored Pre-proline 0 C--N 1.331 -0.223 0 C-N-CA 120.836 -0.345 . . . . 0.0 110.383 -179.955 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_endo -68.0 161.16 45.42 Favored 'Trans proline' 0 N--CA 1.497 1.694 0 C-N-CA 123.059 2.506 . . . . 0.0 113.03 -179.057 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . 0.535 ' CE1' ' O ' ' A' ' 55' ' ' ARG . 43.5 m-85 -131.09 157.31 43.42 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.35 -0.841 . . . . 0.0 109.415 179.595 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.463 ' O ' ' HA ' ' A' ' 22' ' ' ILE . 42.0 mt-10 -123.13 139.23 54.28 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 109.095 -0.706 . . . . 0.0 109.095 178.319 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -124.92 142.08 51.7 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 112.817 0.673 . . . . 0.0 112.817 -177.531 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.561 ' HE ' ' CD1' ' A' ' 23' ' ' LEU . 0.0 OUTLIER -124.95 128.08 48.05 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.115 -0.948 . . . . 0.0 109.288 177.215 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 7.4 mt -108.59 129.38 55.32 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 120.569 -0.452 . . . . 0.0 110.431 -179.658 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' TYR . . . . . 0.43 ' CD1' ' N ' ' A' ' 62' ' ' TYR . 19.9 m-85 -110.67 109.66 20.02 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.002 0.429 . . . . 0.0 110.742 -179.957 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.408 ' HB3' ' H ' ' A' ' 64' ' ' GLY . 3.5 tt -104.19 -85.03 0.47 Allowed 'General case' 0 C--N 1.333 -0.116 0 CA-C-N 115.76 -0.655 . . . . 0.0 109.545 179.476 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . 0.414 ' H ' ' HB ' ' A' ' 67' ' ' VAL . . . -76.3 176.89 51.49 Favored Glycine 0 CA--C 1.523 0.585 0 N-CA-C 109.337 -1.505 . . . . 0.0 109.337 178.7 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.449 ' CD1' ' C ' ' A' ' 65' ' ' LEU . 3.0 tm? -71.93 -37.31 70.05 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 120.031 -0.668 . . . . 0.0 109.604 -179.636 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.427 ' OD1' ' O ' ' A' ' 66' ' ' ASP . 55.6 t0 -98.52 9.2 43.72 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.105 179.49 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . 0.414 ' HB ' ' H ' ' A' ' 64' ' ' GLY . 8.7 t -106.06 96.15 4.37 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.305 0 CA-C-O 121.405 0.621 . . . . 0.0 111.741 -178.875 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 7.8 tp -113.24 117.55 32.18 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 108.102 -1.073 . . . . 0.0 108.102 178.221 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . 0.437 ' CG2' ' OG ' ' A' ' 94' ' ' SER . 3.6 mt -112.64 144.76 19.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 120.798 0.333 . . . . 0.0 110.948 -178.974 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.409 ' N ' HG22 ' A' ' 69' ' ' ILE . 9.8 ptt180 -128.16 130.98 48.92 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.835 179.214 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 2.0 mtp -140.18 148.14 41.16 Favored 'General case' 0 C--O 1.227 -0.117 0 CA-C-N 115.719 -0.673 . . . . 0.0 109.902 179.836 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -103.78 126.54 50.98 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 107.627 -1.249 . . . . 0.0 107.627 178.143 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.406 HD12 HG22 ' A' ' 73' ' ' ILE . 11.2 pt -134.83 157.68 41.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 N-CA-C 112.953 0.723 . . . . 0.0 112.953 -177.44 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -122.52 154.69 37.53 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.023 -0.99 . . . . 0.0 109.623 178.723 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.523 ' CD1' ' CZ ' ' A' ' 85' ' ' PHE . 5.2 tp -66.47 120.74 13.9 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.226 0.536 . . . . 0.0 110.558 -179.828 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -97.69 -41.75 7.96 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.422 177.927 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' TRP . . . . . 0.569 ' NE1' ' HA3' ' A' ' 84' ' ' GLY . 67.6 p-90 -170.45 168.52 7.81 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 115.485 -0.78 . . . . 0.0 109.898 -179.647 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -148.15 123.89 10.53 Favored 'General case' 0 N--CA 1.464 0.27 0 N-CA-C 109.932 -0.395 . . . . 0.0 109.932 178.795 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 38.4 ttt85 -152.37 133.68 14.41 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 113.215 0.82 . . . . 0.0 113.215 179.863 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 13.3 t70 56.92 47.15 18.3 Favored 'General case' 0 N--CA 1.464 0.246 0 N-CA-C 114.227 1.195 . . . . 0.0 114.227 176.405 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 83.77 -28.08 4.12 Favored Glycine 0 CA--C 1.524 0.656 0 C-N-CA 120.314 -0.946 . . . . 0.0 113.153 177.114 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 3.5 mt -89.69 157.89 17.8 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 117.637 0.719 . . . . 0.0 110.206 -179.283 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 36.5 mt -129.62 135.34 48.42 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.308 -179.078 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . 0.569 ' HA3' ' NE1' ' A' ' 77' ' ' TRP . . . -96.29 152.4 20.21 Favored Glycine 0 N--CA 1.451 -0.347 0 N-CA-C 109.894 -1.283 . . . . 0.0 109.894 178.935 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . 0.523 ' CZ ' ' CD1' ' A' ' 75' ' ' LEU . 23.8 m-85 -145.67 132.75 20.36 Favored 'General case' 0 C--N 1.318 -0.772 0 C-N-CA 120.79 -0.364 . . . . 0.0 110.892 -179.2 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.501 ' O ' ' NE2' ' A' ' 88' ' ' GLN . 42.3 tt0 -103.92 126.32 50.95 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 178.994 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . 0.408 ' C ' HE21 ' A' ' 88' ' ' GLN . 5.6 t -68.72 122.12 17.89 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.015 0.436 . . . . 0.0 112.007 -178.408 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . 0.501 ' NE2' ' O ' ' A' ' 86' ' ' GLU . 20.1 mm-40 -95.14 -34.05 12.42 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.078 179.348 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . 0.442 ' ND1' ' C ' ' A' ' 89' ' ' HIS . 0.0 OUTLIER -161.5 141.69 10.65 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.031 179.66 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . 0.46 HD12 HG22 ' A' ' 90' ' ' ILE . 7.1 tt -143.36 139.33 26.52 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-O 121.169 0.509 . . . . 0.0 109.988 -179.045 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -57.21 142.69 42.0 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 115.508 -0.769 . . . . 0.0 112.057 -178.312 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 3.3 tp -54.1 -42.05 68.98 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.222 -0.899 . . . . 0.0 110.457 -179.337 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . 0.522 ' OD1' ' N ' ' A' ' 94' ' ' SER . 1.4 p30 -67.07 -39.07 86.79 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 179.273 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' SER . . . . . 0.522 ' N ' ' OD1' ' A' ' 93' ' ' ASP . 6.7 t -66.24 -37.0 84.47 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.573 -0.74 . . . . 0.0 110.185 179.268 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 38.5 mt -58.61 -38.3 70.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.137 179.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -70.88 -41.54 71.23 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.354 -0.538 . . . . 0.0 111.203 -179.003 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 60.7 m-70 -61.67 -35.4 77.86 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 119.408 -0.917 . . . . 0.0 109.303 179.791 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 5.5 mp -67.53 -34.04 76.29 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 177.475 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -64.3 -38.69 91.94 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 178.522 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 53.2 mtp85 -58.06 -37.93 75.36 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.943 179.131 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.471 ' O ' ' ND2' ' A' ' 105' ' ' ASN . 6.7 mp -69.91 -36.24 75.22 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.124 -179.657 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 86.5 t -68.67 -40.84 82.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.911 179.739 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 14.5 tt0 -64.94 -47.86 76.16 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.447 -179.269 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.468 ' CD1' ' N ' ' A' ' 104' ' ' LEU . 5.3 mp -69.24 -43.05 74.77 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 120.976 -0.29 . . . . 0.0 111.416 -179.668 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . 0.471 ' ND2' ' O ' ' A' ' 101' ' ' LEU . 18.6 m-80 -62.13 -26.24 68.2 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.684 -0.407 . . . . 0.0 110.596 -179.756 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 2.4 tp -55.9 -18.92 10.16 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.885 0.374 . . . . 0.0 110.016 179.803 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -132.02 171.31 21.42 Favored Glycine 0 CA--C 1.526 0.759 0 N-CA-C 110.81 -0.916 . . . . 0.0 110.81 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . 0.478 ' CG ' ' N ' ' A' ' 109' ' ' GLU . 4.5 p-10 -135.39 -54.69 0.79 Allowed 'General case' 0 C--N 1.333 -0.152 0 CA-C-O 120.703 0.287 . . . . 0.0 110.576 -179.942 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . 0.478 ' N ' ' CG ' ' A' ' 108' ' ' ASP . 2.3 tp10 -169.98 -34.56 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.378 -0.373 . . . . 0.0 110.942 179.991 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -144.66 -136.41 0.09 Allowed 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.576 -0.284 . . . . 0.0 110.677 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . 0.41 ' HB2' ' H ' ' A' ' 112' ' ' LEU . 2.4 mp -97.93 -94.57 0.23 Allowed 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 121.055 -0.258 . . . . 0.0 110.952 -179.696 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.41 ' H ' ' HB2' ' A' ' 111' ' ' LEU . 2.3 tp 67.25 131.09 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.738 0.304 . . . . 0.0 110.55 -179.815 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . 0.4 ' O ' ' CG ' ' A' ' 113' ' ' GLU . 8.3 pt-20 -65.29 122.32 16.85 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.582 179.922 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 10.1 ttm180 -174.85 45.11 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.35 -179.913 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -150.51 -55.94 0.16 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.623 -179.875 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 1.2 tt -66.93 -37.11 83.71 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.79 -179.857 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -63.71 -22.69 67.04 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.167 0.508 . . . . 0.0 110.283 -179.123 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . 0.417 ' O ' ' OG ' ' A' ' 121' ' ' SER . 46.9 mt -57.46 -35.81 70.63 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 108.195 -1.039 . . . . 0.0 108.195 178.32 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . 0.559 ' C ' ' H ' ' A' ' 121' ' ' SER . 36.2 mt -57.91 -48.92 78.45 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 114.935 -1.03 . . . . 0.0 108.24 179.075 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 18.6 t -59.14 -0.99 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.135 177.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' SER . . . . . 0.559 ' H ' ' C ' ' A' ' 119' ' ' LEU . 4.4 p -111.45 -41.66 4.06 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 108.555 -0.906 . . . . 0.0 108.555 177.237 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -128.75 84.55 2.24 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.106 -0.952 . . . . 0.0 109.664 179.77 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . 0.741 ' CG ' ' N ' ' A' ' 124' ' ' ASP . 0.0 OUTLIER -83.74 -159.01 0.34 Allowed 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 120.559 -0.456 . . . . 0.0 111.162 -178.834 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . 0.741 ' N ' ' CG ' ' A' ' 123' ' ' HIS . 0.6 OUTLIER 158.91 -32.15 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.787 -0.642 . . . . 0.0 109.53 179.961 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 125' ' ' ASP . . . . . 0.42 ' OD1' ' O ' ' A' ' 125' ' ' ASP . 0.7 OUTLIER . . . . . 0 C--O 1.219 -0.518 0 CA-C-O 118.028 -0.987 . . . . 0.0 110.417 179.771 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 501' ' ' C2E . . . . . 0.847 ' O21' " H4'" ' A' ' 501' ' ' C2E . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 502' ' ' C2E . . . . . 0.536 ' N21' ' ND1' ' A' ' 12' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.0 mpt? . . . . . 0 N--CA 1.491 1.583 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.506 ' HG ' ' H ' ' A' ' 4' ' ' GLN . 3.4 t -163.35 161.21 24.42 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.458 -179.914 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -99.66 21.04 12.94 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.16 -0.473 . . . . 0.0 109.89 178.475 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . 0.535 ' C ' ' H ' ' A' ' 6' ' ' ASP . 0.8 OUTLIER -114.41 -15.69 12.05 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 115.643 -0.708 . . . . 0.0 109.827 177.883 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 61.1 m170 -74.8 29.99 0.09 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.214 179.512 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . 0.591 ' O ' ' NH2' ' A' ' 8' ' ' ARG . 6.3 m-20 -50.25 160.26 0.39 Allowed 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 -179.932 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.446 ' OE1' ' OG ' ' A' ' 121' ' ' SER . 0.9 OUTLIER -97.27 133.39 41.95 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.177 0.513 . . . . 0.0 110.391 -179.744 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.65 HH21 ' C81' ' A' ' 502' ' ' C2E . 0.2 OUTLIER -125.14 -14.17 6.61 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.501 -0.772 . . . . 0.0 111.289 -179.1 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.615 ' CZ ' HH21 ' A' ' 13' ' ' ARG . 2.5 ptt180 -105.47 93.66 4.79 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.112 179.365 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.536 ' C ' ' O ' ' A' ' 9' ' ' ARG . 0.0 OUTLIER 15.07 -89.23 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 115.215 -0.902 . . . . 0.0 111.945 -179.88 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . 0.4 ' N ' ' O ' ' A' ' 9' ' ' ARG . 0.3 OUTLIER -124.52 171.37 10.05 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-O 120.978 0.418 . . . . 0.0 110.707 -179.557 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . 0.569 ' ND1' ' N21' ' A' ' 502' ' ' C2E . 9.0 m-70 -64.74 132.88 50.8 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.643 -179.946 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.615 HH21 ' CZ ' ' A' ' 9' ' ' ARG . 2.2 mtm180 -81.24 -177.68 6.58 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.396 -0.366 . . . . 0.0 110.527 -179.905 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 2.4 mp -91.56 104.49 15.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.043 -179.405 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -95.14 120.21 34.96 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.635 179.145 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 2.2 p90 -150.11 157.82 43.52 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 108.503 -0.925 . . . . 0.0 108.503 178.02 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -95.77 143.37 27.07 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 120.139 -0.624 . . . . 0.0 110.77 -179.372 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -176.48 175.23 1.79 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.665 179.091 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -96.33 134.03 39.96 Favored 'General case' 0 C--N 1.326 -0.45 0 C-N-CA 120.647 -0.421 . . . . 0.0 111.141 -179.598 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.495 ' O ' ' O ' ' A' ' 31' ' ' VAL . 11.0 p -133.52 152.39 51.9 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.019 178.588 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.423 ' CG ' HH21 ' A' ' 28' ' ' ARG . 6.1 mm-40 -131.31 136.74 48.38 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 179.814 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 1.1 mm -117.45 135.37 58.08 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.552 0 C-N-CA 120.197 -0.601 . . . . 0.0 110.338 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -130.56 122.78 28.16 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.78 -179.321 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.535 ' OE1' ' CZ ' ' A' ' 57' ' ' PHE . 24.2 tt0 -124.64 101.78 7.28 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 114.735 -1.12 . . . . 0.0 109.823 179.097 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 82.14 -124.53 6.52 Favored Glycine 0 CA--C 1.523 0.557 0 N-CA-C 110.055 -1.218 . . . . 0.0 110.055 -178.952 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -100.53 10.64 40.91 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.776 0.322 . . . . 0.0 110.197 179.555 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.498 ' HB3' ' CZ2' ' A' ' 29' ' ' TRP . 17.5 mtt180 -112.58 133.57 54.56 Favored 'General case' 0 C--N 1.332 -0.158 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 -178.502 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.423 HH21 ' CG ' ' A' ' 21' ' ' GLU . 49.2 ttt180 -128.47 152.88 47.73 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.388 179.212 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.518 ' NE1' ' O ' ' A' ' 48' ' ' ASP . 6.6 m-90 -151.02 156.9 42.08 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.709 -178.691 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.477 ' CD ' ' H ' ' A' ' 30' ' ' GLU . 2.3 mp0 -99.94 136.18 40.24 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 179.159 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.495 ' O ' ' O ' ' A' ' 20' ' ' SER . 30.7 m -145.36 156.65 13.35 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-O 121.049 0.452 . . . . 0.0 111.001 -179.451 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 10.7 tp -97.41 129.71 44.61 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 108.42 -0.956 . . . . 0.0 108.42 178.811 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -90.14 124.41 34.79 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.152 0.501 . . . . 0.0 110.111 -179.729 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 75.4 m-70 -91.02 -31.56 16.26 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.375 -0.829 . . . . 0.0 111.414 -178.87 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 1.9 p30 -170.8 161.87 7.4 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 119.577 -0.849 . . . . 0.0 111.125 177.387 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 5.4 p -146.78 169.11 5.16 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.168 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.307 -178.572 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' SER . . . . . 0.508 ' CB ' HN22 ' A' ' 501' ' ' C2E . 14.7 t -140.09 171.78 13.7 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 107.956 -1.127 . . . . 0.0 107.956 178.224 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 4.0 tp -68.18 0.79 3.35 Favored 'General case' 0 C--N 1.324 -0.514 0 C-N-CA 120.124 -0.63 . . . . 0.0 111.185 -179.091 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -160.78 35.21 0.15 Allowed 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.573 -0.451 . . . . 0.0 111.141 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . 0.567 ' HA3' ' N3 ' ' A' ' 501' ' ' C2E . . . -174.02 159.93 29.55 Favored Glycine 0 CA--C 1.524 0.656 0 N-CA-C 110.943 -0.863 . . . . 0.0 110.943 179.673 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -148.22 148.91 15.7 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.277 0 CA-C-O 121.46 0.648 . . . . 0.0 111.839 -178.664 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -121.57 134.84 55.02 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 114.839 -1.073 . . . . 0.0 108.612 178.662 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 33.3 m -139.63 175.05 7.79 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-O 121.234 0.54 . . . . 0.0 111.698 -179.444 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -99.47 143.7 16.66 Favored Glycine 0 N--CA 1.467 0.746 0 N-CA-C 108.774 -1.73 . . . . 0.0 108.774 177.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . 0.52 ' CD ' ' O ' ' A' ' 45' ' ' GLN . 0.0 OUTLIER -85.66 121.7 73.3 Favored Pre-proline 0 CA--C 1.534 0.332 0 CA-C-N 118.221 1.01 . . . . 0.0 111.659 -178.314 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 79.8 Cg_endo -86.6 161.74 9.38 Favored 'Trans proline' 0 C--N 1.303 -1.82 0 C-N-CA 121.766 1.644 . . . . 0.0 111.106 178.447 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.4 mm100 -65.72 -39.65 91.41 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 111.9 0.334 . . . . 0.0 111.9 -179.32 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . 0.528 ' O ' ' N ' ' A' ' 50' ' ' ASN . 79.2 m-20 -72.48 8.7 1.29 Allowed 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 111.912 0.338 . . . . 0.0 111.912 -178.873 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' TRP . . . . . 0.462 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 64.8 t-105 -59.84 66.72 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 112.324 0.49 . . . . 0.0 112.324 -179.344 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . 0.538 ' ND2' ' O ' ' A' ' 50' ' ' ASN . 1.8 t30 -93.07 78.71 4.59 Favored 'General case' 0 C--N 1.326 -0.43 0 C-N-CA 119.947 -0.701 . . . . 0.0 109.302 178.176 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -144.39 144.23 13.11 Favored Glycine 0 CA--C 1.525 0.682 0 N-CA-C 111.578 -0.609 . . . . 0.0 111.578 -179.199 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -78.62 121.99 84.31 Favored Pre-proline 0 CA--C 1.534 0.357 0 CA-C-N 115.795 -0.203 . . . . 0.0 110.811 -179.898 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -60.93 -22.93 75.97 Favored 'Trans proline' 0 N--CA 1.495 1.59 0 C-N-CA 122.443 2.096 . . . . 0.0 112.433 -179.576 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.564 ' C ' ' HE ' ' A' ' 55' ' ' ARG . 28.2 mt-30 -75.5 -23.73 56.78 Favored 'General case' 0 C--N 1.323 -0.544 0 C-N-CA 120.36 -0.536 . . . . 0.0 111.059 -179.634 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.564 ' HE ' ' C ' ' A' ' 54' ' ' GLN . 0.0 OUTLIER -94.11 151.45 39.64 Favored Pre-proline 0 C--N 1.33 -0.252 0 CA-C-O 120.851 0.358 . . . . 0.0 110.043 179.981 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . 0.438 ' O ' ' OE1' ' A' ' 24' ' ' GLN . 33.2 Cg_endo -64.03 160.92 35.5 Favored 'Trans proline' 0 N--CA 1.495 1.615 0 C-N-CA 123.068 2.512 . . . . 0.0 113.532 -178.833 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . 0.535 ' CZ ' ' OE1' ' A' ' 24' ' ' GLN . 58.7 m-85 -130.79 156.38 45.09 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 114.926 -1.034 . . . . 0.0 109.191 179.366 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -123.36 136.74 54.8 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 178.537 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -115.33 135.42 54.16 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.971 0.415 . . . . 0.0 111.915 -178.545 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 3.7 mmm180 -122.91 127.42 48.92 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 108.547 -0.908 . . . . 0.0 108.547 177.725 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 13.5 mt -108.35 151.24 26.26 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.908 0.385 . . . . 0.0 111.001 -178.895 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' TYR . . . . . 0.407 ' CD1' ' N ' ' A' ' 62' ' ' TYR . 12.7 m-85 -134.61 110.68 9.47 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.62 179.809 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.402 ' C ' ' CD2' ' A' ' 63' ' ' LEU . 1.4 tt -106.01 -81.91 0.54 Allowed 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.625 179.608 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -79.84 -177.88 50.96 Favored Glycine 0 CA--C 1.521 0.41 0 N-CA-C 109.343 -1.503 . . . . 0.0 109.343 178.678 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 5.5 mt -76.13 -33.42 59.43 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 119.806 -0.758 . . . . 0.0 110.478 -179.535 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -101.67 8.35 41.68 Favored 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 122.616 0.367 . . . . 0.0 110.849 179.886 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 12.1 t -103.95 94.1 2.99 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.195 0 CA-C-O 121.336 0.589 . . . . 0.0 111.877 -178.769 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 5.4 tp -113.65 117.33 31.26 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 108.088 -1.079 . . . . 0.0 108.088 178.156 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 3.9 mt -112.09 144.39 19.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-O 120.943 0.401 . . . . 0.0 111.174 -178.814 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.418 ' C ' ' HG2' ' A' ' 71' ' ' MET . 0.5 OUTLIER -128.2 130.1 47.49 Favored 'General case' 0 C--O 1.239 0.547 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.653 179.183 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' MET . . . . . 0.418 ' HG2' ' C ' ' A' ' 70' ' ' ARG . 0.0 OUTLIER -138.54 146.83 42.37 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.771 -0.649 . . . . 0.0 109.829 179.551 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . 0.454 ' OE2' ' O ' ' A' ' 57' ' ' PHE . 15.4 tp10 -99.59 132.83 44.67 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 107.551 -1.277 . . . . 0.0 107.551 178.663 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.425 ' O ' ' O ' ' A' ' 57' ' ' PHE . 2.0 pt -143.16 157.17 17.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 C-N-CA 119.182 -1.007 . . . . 0.0 113.102 -177.732 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 7.2 m -123.11 155.87 36.1 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-N 115.111 -0.95 . . . . 0.0 110.022 179.043 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.56 118.33 8.67 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.793 0.33 . . . . 0.0 110.698 -179.252 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -97.1 -43.32 7.45 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-O 121.136 0.493 . . . . 0.0 110.022 177.659 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' TRP . . . . . 0.543 ' NE1' ' HA3' ' A' ' 84' ' ' GLY . 67.5 p-90 -171.22 167.75 6.92 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.042 179.946 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -146.96 123.73 11.23 Favored 'General case' 0 N--CA 1.465 0.278 0 N-CA-C 109.878 -0.416 . . . . 0.0 109.878 178.575 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . 0.555 ' CZ ' HO2' ' A' ' 502' ' ' C2E . 10.9 ttp180 -152.48 134.23 14.69 Favored 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 113.163 0.801 . . . . 0.0 113.163 -179.98 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 56.97 47.18 18.12 Favored 'General case' 0 C--N 1.333 -0.15 0 N-CA-C 113.788 1.033 . . . . 0.0 113.788 176.487 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 82.39 -27.94 3.54 Favored Glycine 0 CA--C 1.523 0.58 0 C-N-CA 120.319 -0.943 . . . . 0.0 113.033 177.268 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 4.9 mt -89.39 154.0 20.4 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 117.381 0.59 . . . . 0.0 110.335 -179.004 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 70.1 mt -126.87 135.67 51.28 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.402 -178.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . 0.543 ' HA3' ' NE1' ' A' ' 77' ' ' TRP . . . -98.49 150.84 19.46 Favored Glycine 0 N--CA 1.45 -0.375 0 N-CA-C 109.546 -1.421 . . . . 0.0 109.546 178.64 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 45.8 m-85 -145.57 134.85 22.95 Favored 'General case' 0 C--N 1.318 -0.766 0 C-N-CA 120.863 -0.335 . . . . 0.0 110.458 -179.542 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.431 ' CD ' HE22 ' A' ' 88' ' ' GLN . 5.7 tt0 -103.97 125.73 50.57 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 179.646 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -70.38 125.44 26.8 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.979 0.419 . . . . 0.0 111.542 -178.744 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . 0.431 HE22 ' CD ' ' A' ' 86' ' ' GLU . 29.3 mm-40 -98.22 -31.94 11.82 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.302 179.468 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . 0.472 ' ND1' ' C ' ' A' ' 89' ' ' HIS . 0.0 OUTLIER -160.48 141.59 12.06 Favored 'General case' 0 C--O 1.222 -0.342 0 CA-C-N 116.043 -0.526 . . . . 0.0 109.842 179.617 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . 0.411 ' CD1' ' SD ' ' A' ' 71' ' ' MET . 7.1 tt -145.26 140.72 22.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-O 121.381 0.61 . . . . 0.0 110.235 -179.13 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . 0.545 ' OD1' ' N ' ' A' ' 92' ' ' LEU . 12.9 t0 -56.88 142.42 41.29 Favored 'General case' 0 N--CA 1.462 0.131 0 CA-C-N 115.148 -0.933 . . . . 0.0 112.003 -178.294 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.545 ' N ' ' OD1' ' A' ' 91' ' ' ASP . 6.5 tt -53.87 -41.84 67.96 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 114.82 -1.082 . . . . 0.0 110.233 -179.051 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . 0.43 ' N ' ' OD1' ' A' ' 91' ' ' ASP . 0.6 OUTLIER -67.52 -42.46 82.76 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.815 -0.439 . . . . 0.0 109.815 179.254 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 6.4 m -60.79 -37.8 83.17 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.176 179.615 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 61.4 mt -58.62 -38.32 70.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.243 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -70.97 -40.81 71.72 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.206 -0.597 . . . . 0.0 111.337 -179.131 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 68.7 m-70 -62.35 -37.24 84.89 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 119.503 -0.879 . . . . 0.0 109.316 179.945 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.43 -33.92 76.15 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 178.374 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 6.3 mtt-85 -60.46 -36.77 79.04 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 120.166 -0.613 . . . . 0.0 109.347 178.628 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . 0.455 ' CG ' HH11 ' A' ' 100' ' ' ARG . 0.1 OUTLIER -57.89 -46.18 85.3 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.511 179.108 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 7.1 mp -65.56 -35.4 80.73 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.39 -179.65 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 2.5 t -68.63 -47.7 75.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.496 -0.32 . . . . 0.0 110.437 179.64 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 93.4 mt-10 -65.72 -42.05 91.55 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.702 -179.552 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 48.1 mt -68.3 -41.33 81.1 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.949 -0.3 . . . . 0.0 111.639 -178.582 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -68.91 -40.56 79.04 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.445 -0.502 . . . . 0.0 110.709 -179.871 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 2.1 tp -56.23 -47.29 78.74 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.781 0.324 . . . . 0.0 110.348 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . 0.582 ' O ' ' N ' ' A' ' 109' ' ' GLU . . . 64.66 94.67 0.02 OUTLIER Glycine 0 CA--C 1.523 0.565 0 N-CA-C 110.508 -1.037 . . . . 0.0 110.508 -179.855 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -44.37 86.3 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.844 0.354 . . . . 0.0 110.824 -179.805 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . 0.582 ' N ' ' O ' ' A' ' 107' ' ' GLY . 61.3 mt-10 -99.88 -81.14 0.47 Allowed 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.346 179.965 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 25.0 tt0 -174.77 -67.06 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.489 -179.879 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 8.1 mp 43.11 49.01 5.48 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.796 179.917 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.405 ' O ' ' O ' ' A' ' 113' ' ' GLU . 0.2 OUTLIER -78.03 74.86 4.57 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.989 0.423 . . . . 0.0 110.145 179.885 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . 0.405 ' O ' ' O ' ' A' ' 112' ' ' LEU . 21.0 tt0 56.39 108.35 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.353 -179.781 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . 0.428 ' HG2' ' N ' ' A' ' 115' ' ' GLU . 5.6 ttm180 -109.37 -118.96 0.28 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.877 -179.713 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . 0.428 ' N ' ' HG2' ' A' ' 114' ' ' ARG . 6.0 tp10 -63.16 147.03 52.06 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.026 0.441 . . . . 0.0 110.845 -179.387 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 41.4 mt -67.12 -46.98 72.5 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.319 -179.95 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' ALA . . . . . 0.546 ' O ' ' N ' ' A' ' 121' ' ' SER . . . -59.76 -47.52 85.34 Favored 'General case' 0 C--N 1.332 -0.158 0 N-CA-C 112.849 0.685 . . . . 0.0 112.849 -178.169 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 25.4 mt -55.76 -48.8 74.65 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.267 -0.573 . . . . 0.0 111.362 -177.569 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 14.7 mt -73.56 -50.14 22.8 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 120.185 -0.606 . . . . 0.0 110.693 179.74 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 60.2 t -71.32 -20.29 21.19 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.306 0 N-CA-C 112.6 0.592 . . . . 0.0 112.6 -178.336 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' SER . . . . . 0.546 ' N ' ' O ' ' A' ' 117' ' ' ALA . 10.9 t -64.75 -41.33 95.99 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 119.403 -0.919 . . . . 0.0 110.179 -179.062 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -170.17 161.34 8.39 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.629 -0.428 . . . . 0.0 111.075 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . 0.407 ' CD2' ' C ' ' A' ' 123' ' ' HIS . 0.0 OUTLIER -160.18 158.25 29.77 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.004 -0.544 . . . . 0.0 109.778 179.058 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . 0.45 ' OD1' ' O ' ' A' ' 124' ' ' ASP . 15.0 t0 -160.85 69.38 0.36 Allowed 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 120.815 -0.354 . . . . 0.0 111.215 -178.899 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 . . . . . 0 C--O 1.22 -0.476 0 CA-C-O 117.963 -1.018 . . . . 0.0 110.526 -179.985 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 501' ' ' C2E . . . . . 0.898 ' O21' " H4'" ' A' ' 501' ' ' C2E . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 502' ' ' C2E . . . . . 0.65 ' C81' HH21 ' A' ' 8' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 11.1 mmt . . . . . 0 N--CA 1.491 1.578 0 N-CA-C 109.419 -0.586 . . . . 0.0 109.419 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 29.9 m -98.41 79.11 2.48 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.717 -179.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . 0.499 ' C ' ' H ' ' A' ' 5' ' ' HIS . 1.5 p30 -99.62 -30.37 12.16 Favored 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 178.337 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . 0.434 ' CD ' ' O ' ' A' ' 4' ' ' GLN . 0.3 OUTLIER -71.37 7.93 1.2 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.784 -0.644 . . . . 0.0 109.672 179.922 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . 0.499 ' H ' ' C ' ' A' ' 3' ' ' ASP . 24.8 m170 -100.95 28.37 5.32 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.679 -0.691 . . . . 0.0 109.918 179.462 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 50.5 m-20 -41.08 144.05 0.33 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.857 -179.298 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.457 ' OE1' ' N21' ' A' ' 502' ' ' C2E . 4.3 tt0 -80.74 134.14 35.78 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.69 179.938 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.787 ' H ' ' C61' ' A' ' 502' ' ' C2E . 0.0 OUTLIER -121.99 -13.82 8.14 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.451 179.824 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.714 ' O ' ' N ' ' A' ' 11' ' ' PHE . 1.7 mtt180 -96.05 69.54 2.79 Favored 'General case' 0 N--CA 1.469 0.487 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 179.47 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.501 ' C ' ' O ' ' A' ' 9' ' ' ARG . 0.0 OUTLIER 26.31 -79.65 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.836 -179.438 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . 0.714 ' N ' ' O ' ' A' ' 9' ' ' ARG . 0.3 OUTLIER -139.73 142.93 36.81 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 109.893 -0.41 . . . . 0.0 109.893 179.313 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . 0.427 ' C ' ' O ' ' A' ' 11' ' ' PHE . 64.2 m-70 -32.68 151.39 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.468 -179.354 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.448 ' NH1' ' N1 ' ' A' ' 501' ' ' C2E . 24.2 mtm180 -103.3 173.91 6.1 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.558 -179.732 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 40.5 mm -72.25 98.88 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.412 179.786 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -95.58 119.86 34.82 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.33 0.586 . . . . 0.0 111.663 -179.861 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -149.93 154.64 38.62 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.036 -0.983 . . . . 0.0 108.433 177.816 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -95.57 147.03 24.0 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 120.013 -0.675 . . . . 0.0 111.478 -178.328 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -179.11 176.8 0.85 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.698 -0.683 . . . . 0.0 109.846 179.375 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 22.2 t0 -96.11 134.26 39.39 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.95 -179.737 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.594 ' O ' ' O ' ' A' ' 31' ' ' VAL . 21.5 p -134.37 154.06 51.55 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.135 0.493 . . . . 0.0 110.263 179.002 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 18.7 mt-10 -135.29 143.16 46.08 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 109.041 -0.726 . . . . 0.0 109.041 179.487 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -122.35 136.3 59.64 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 C-N-CA 120.21 -0.596 . . . . 0.0 110.986 -179.023 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -123.89 123.32 40.17 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.927 -179.44 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.547 ' OE1' ' CZ ' ' A' ' 57' ' ' PHE . 20.6 tt0 -131.15 102.7 6.11 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.32 -0.855 . . . . 0.0 109.635 178.858 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 78.56 -128.38 8.64 Favored Glycine 0 CA--C 1.522 0.524 0 N-CA-C 109.77 -1.332 . . . . 0.0 109.77 -178.94 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -98.89 11.24 39.42 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.675 0.274 . . . . 0.0 110.456 179.612 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.551 ' HB3' ' CZ2' ' A' ' 29' ' ' TRP . 0.6 OUTLIER -111.78 132.5 54.62 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 121.007 0.432 . . . . 0.0 112.011 -179.056 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.415 ' HG2' ' N ' ' A' ' 29' ' ' TRP . 4.5 ttt85 -126.79 147.43 50.01 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.8 -0.637 . . . . 0.0 109.947 178.931 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.583 ' HE1' ' CG ' ' A' ' 48' ' ' ASP . 6.5 m-90 -145.85 155.44 42.9 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.497 -179.0 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.586 ' OE1' ' N ' ' A' ' 30' ' ' GLU . 0.0 OUTLIER -99.33 138.53 36.3 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 178.982 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.594 ' O ' ' O ' ' A' ' 20' ' ' SER . 17.7 m -149.12 157.82 6.67 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-O 121.226 0.536 . . . . 0.0 110.947 -179.335 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 8.2 tp -98.24 129.84 44.97 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 107.975 -1.12 . . . . 0.0 107.975 178.511 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.9 tt -92.17 126.46 37.26 Favored 'General case' 0 C--N 1.325 -0.489 0 C-N-CA 120.271 -0.572 . . . . 0.0 109.61 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 73.4 m-70 -90.46 -28.16 18.78 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.428 -0.805 . . . . 0.0 111.732 -178.299 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -172.44 161.46 5.11 Favored 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 119.635 -0.826 . . . . 0.0 111.205 177.578 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 4.8 p -144.92 168.99 8.57 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.165 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.949 -179.026 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 9.4 t -141.88 170.55 15.5 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 107.924 -1.139 . . . . 0.0 107.924 178.717 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.479 ' O ' ' CD2' ' A' ' 38' ' ' LEU . 4.0 tt -67.13 -1.08 3.85 Favored 'General case' 0 C--N 1.322 -0.611 0 C-N-CA 119.691 -0.804 . . . . 0.0 110.58 -179.243 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . 0.539 ' CE1' ' O ' ' A' ' 87' ' ' CYS . 26.1 t60 -159.86 35.4 0.18 Allowed 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 120.642 -0.423 . . . . 0.0 111.609 179.926 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . 0.449 ' HA3' ' N3 ' ' A' ' 501' ' ' C2E . . . -171.83 155.59 24.17 Favored Glycine 0 CA--C 1.528 0.862 0 N-CA-C 111.135 -0.786 . . . . 0.0 111.135 179.79 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.407 HG22 HD13 ' A' ' 41' ' ' ILE . 0.1 OUTLIER -147.33 149.09 15.89 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.454 0 CA-C-O 121.368 0.604 . . . . 0.0 111.774 -179.182 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -122.7 139.58 53.8 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 115.205 -0.907 . . . . 0.0 109.185 178.984 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.0 m -144.1 175.29 3.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 121.178 0.514 . . . . 0.0 111.709 -179.474 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -97.18 145.47 17.87 Favored Glycine 0 CA--C 1.531 1.073 0 N-CA-C 109.692 -1.363 . . . . 0.0 109.692 178.545 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . 0.541 ' NE2' ' O ' ' A' ' 46' ' ' PRO . 17.9 tm0? -87.65 114.3 58.32 Favored Pre-proline 0 N--CA 1.467 0.411 0 CA-C-N 117.954 0.877 . . . . 0.0 112.06 -178.467 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.541 ' O ' ' NE2' ' A' ' 45' ' ' GLN . 83.7 Cg_endo -84.24 161.5 13.26 Favored 'Trans proline' 0 C--N 1.308 -1.557 0 C-N-CA 121.569 1.513 . . . . 0.0 110.97 178.524 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -65.26 -40.17 93.62 Favored 'General case' 0 N--CA 1.465 0.317 0 N-CA-C 112.7 0.629 . . . . 0.0 112.7 -178.621 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . 0.583 ' CG ' ' HE1' ' A' ' 29' ' ' TRP . 38.5 t0 -73.95 8.84 1.79 Allowed 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 112.068 0.396 . . . . 0.0 112.068 -178.571 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' TRP . . . . . 0.475 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 65.2 t-105 -59.17 69.32 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 111.636 0.235 . . . . 0.0 111.636 -179.781 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . 0.547 ' N ' ' O ' ' A' ' 48' ' ' ASP . 0.5 OUTLIER -93.41 78.82 4.4 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 120.203 -0.599 . . . . 0.0 110.019 178.913 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -142.52 159.48 27.22 Favored Glycine 0 CA--C 1.526 0.731 0 N-CA-C 111.22 -0.752 . . . . 0.0 111.22 -179.765 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 45.3 t0 -95.26 109.05 42.85 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-N 115.759 -0.22 . . . . 0.0 111.022 -179.544 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 78.1 Cg_exo -47.27 -22.69 2.59 Favored 'Trans proline' 0 N--CA 1.493 1.485 0 C-N-CA 122.358 2.039 . . . . 0.0 112.077 179.532 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.51 -23.84 53.7 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.285 -179.386 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.487 ' O ' ' CE1' ' A' ' 57' ' ' PHE . 26.6 mtm180 -95.26 155.22 39.1 Favored Pre-proline 0 N--CA 1.463 0.207 0 C-N-CA 120.616 -0.434 . . . . 0.0 110.22 179.635 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . 0.409 ' O ' ' OE1' ' A' ' 24' ' ' GLN . 9.3 Cg_exo -66.92 160.73 45.63 Favored 'Trans proline' 0 N--CA 1.493 1.49 0 C-N-CA 122.685 2.256 . . . . 0.0 113.305 -178.864 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . 0.547 ' CZ ' ' OE1' ' A' ' 24' ' ' GLN . 49.3 m-85 -130.76 155.31 46.86 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 114.851 -1.068 . . . . 0.0 108.937 179.313 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -122.16 139.17 54.06 Favored 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 178.326 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -119.77 137.69 53.8 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 112.217 0.451 . . . . 0.0 112.217 -178.059 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 13.0 mtt180 -123.17 127.6 48.88 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 108.623 -0.88 . . . . 0.0 108.623 177.385 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 9.7 mt -109.39 150.98 27.25 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.942 0.401 . . . . 0.0 110.757 -178.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' TYR . . . . . 0.425 ' CD1' ' N ' ' A' ' 62' ' ' TYR . 20.1 m-85 -132.61 109.68 9.91 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.438 179.73 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 1.9 tt -104.55 -82.48 0.51 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.731 -0.668 . . . . 0.0 109.398 179.501 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . 0.409 ' H ' ' HB ' ' A' ' 67' ' ' VAL . . . -78.68 179.01 52.82 Favored Glycine 0 CA--C 1.522 0.497 0 N-CA-C 109.156 -1.578 . . . . 0.0 109.156 178.423 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.57 ' CD2' ' N ' ' A' ' 65' ' ' LEU . 3.1 mm? -74.22 -33.06 63.25 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 119.827 -0.749 . . . . 0.0 110.118 -179.498 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -101.96 9.32 40.61 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.95 179.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . 0.409 ' HB ' ' H ' ' A' ' 64' ' ' GLY . 8.9 t -106.08 95.91 4.18 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.242 0 CA-C-O 121.309 0.576 . . . . 0.0 111.807 -178.621 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 6.5 tp -113.1 117.46 32.03 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 108.169 -1.049 . . . . 0.0 108.169 178.176 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 3.5 mt -111.04 142.92 22.02 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-O 120.97 0.414 . . . . 0.0 110.836 -178.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 5.7 ttp180 -128.2 130.97 48.83 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.734 179.572 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -139.64 147.4 40.98 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.643 179.846 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -106.38 123.74 48.53 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 107.52 -1.289 . . . . 0.0 107.52 178.257 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.476 ' O ' ' O ' ' A' ' 57' ' ' PHE . 3.8 pt -134.47 162.35 39.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 N-CA-C 113.348 0.87 . . . . 0.0 113.348 -176.923 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 1.9 t -119.0 148.58 42.84 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 114.808 -1.087 . . . . 0.0 108.71 178.251 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.405 ' HA ' ' CD1' ' A' ' 85' ' ' PHE . 2.3 tt -66.46 126.74 29.79 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.569 0.7 . . . . 0.0 110.119 -179.127 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -98.2 -41.39 7.92 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 114.923 -1.035 . . . . 0.0 110.928 178.284 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' TRP . . . . . 0.577 ' CZ3' " H1'" ' A' ' 502' ' ' C2E . 69.2 p-90 -169.59 171.94 7.24 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.096 -179.409 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -149.19 123.13 9.37 Favored 'General case' 0 N--CA 1.465 0.301 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 177.725 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 20.4 ttt-85 -152.91 134.66 14.59 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 119.775 -0.77 . . . . 0.0 113.033 -179.882 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 56.54 46.84 19.78 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 113.372 0.878 . . . . 0.0 113.372 176.586 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 80.82 -25.22 3.53 Favored Glycine 0 CA--C 1.524 0.632 0 C-N-CA 120.485 -0.864 . . . . 0.0 113.082 177.479 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 7.6 mt -89.76 161.41 16.05 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 117.882 0.841 . . . . 0.0 110.825 -178.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 54.3 mt -136.37 136.24 39.48 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.278 -179.308 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . 0.534 ' HA3' ' NE1' ' A' ' 77' ' ' TRP . . . -109.61 156.2 15.72 Favored Glycine 0 N--CA 1.451 -0.316 0 N-CA-C 109.294 -1.522 . . . . 0.0 109.294 178.169 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . 0.405 ' CD1' ' HA ' ' A' ' 75' ' ' LEU . 81.4 m-85 -145.46 143.3 29.94 Favored 'General case' 0 C--N 1.318 -0.788 0 C-N-CA 120.829 -0.348 . . . . 0.0 110.214 -179.655 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.485 ' OE2' ' CD2' ' A' ' 39' ' ' HIS . 14.5 tm-20 -103.37 128.74 50.4 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 179.276 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . 0.539 ' O ' ' CE1' ' A' ' 39' ' ' HIS . 41.0 t -78.28 127.14 31.8 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 112.267 0.469 . . . . 0.0 112.267 -178.236 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -102.98 -27.99 12.28 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.462 179.367 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . 0.558 ' ND1' ' N ' ' A' ' 90' ' ' ILE . 0.0 OUTLIER -160.46 141.28 11.88 Favored 'General case' 0 C--O 1.227 -0.104 0 CA-C-O 121.019 0.438 . . . . 0.0 110.55 179.433 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . 0.558 ' N ' ' ND1' ' A' ' 89' ' ' HIS . 9.3 tt -145.74 141.16 21.99 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.966 -179.843 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 5.5 t0 -54.67 141.9 30.38 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 115.334 -0.848 . . . . 0.0 112.23 -178.248 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 57.3 tp -54.12 -41.97 68.93 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 114.929 -1.032 . . . . 0.0 109.979 -179.704 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -68.89 -41.53 78.15 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 109.558 -0.534 . . . . 0.0 109.558 179.228 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 13.4 m -61.39 -37.3 82.93 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.863 -0.608 . . . . 0.0 109.878 179.325 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 47.6 mt -58.62 -38.03 68.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 115.635 -0.712 . . . . 0.0 110.011 179.74 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -70.86 -37.79 73.11 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 120.266 -0.574 . . . . 0.0 110.686 -179.465 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' HIS . . . . . 0.438 ' O ' ' HB2' ' A' ' 100' ' ' ARG . 73.5 m-70 -66.47 -37.97 86.3 Favored 'General case' 0 C--N 1.326 -0.448 0 C-N-CA 119.657 -0.817 . . . . 0.0 109.235 179.491 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 1.9 mp -67.85 -34.09 76.02 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 177.906 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 15.3 mtp-105 -65.24 -37.1 86.21 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 178.489 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . 0.438 ' HB2' ' O ' ' A' ' 97' ' ' HIS . 2.8 mmt180 -57.59 -37.84 73.88 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.626 178.635 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.428 ' O ' ' OD1' ' A' ' 105' ' ' ASN . 15.6 mt -68.86 -37.4 79.07 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.38 -179.448 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . 0.419 ' O ' ' CB ' ' A' ' 106' ' ' LEU . 72.6 t -68.5 -47.35 77.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.095 -179.909 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -65.14 -44.44 88.63 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.484 -179.248 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.469 ' CD2' ' N ' ' A' ' 104' ' ' LEU . 1.3 mm? -70.93 -42.82 69.34 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.519 -0.309 . . . . 0.0 111.345 -179.282 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . 0.428 ' OD1' ' O ' ' A' ' 101' ' ' LEU . 1.5 m-20 -74.16 -34.68 63.91 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 120.741 -0.384 . . . . 0.0 110.827 -179.554 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.419 ' CB ' ' O ' ' A' ' 102' ' ' VAL . 6.5 tt -61.69 -23.45 66.11 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.323 179.781 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -52.7 -91.81 0.01 OUTLIER Glycine 0 CA--C 1.522 0.495 0 N-CA-C 110.667 -0.973 . . . . 0.0 110.667 -179.855 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 174.73 38.15 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.913 0.387 . . . . 0.0 110.699 179.851 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -67.21 -75.74 0.09 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.447 179.858 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . 0.484 ' CD ' ' N ' ' A' ' 111' ' ' LEU . 0.0 OUTLIER -51.78 -19.72 1.8 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.942 0.401 . . . . 0.0 110.076 179.779 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . 0.538 ' C ' ' H ' ' A' ' 113' ' ' GLU . 0.5 OUTLIER 68.58 -55.96 0.52 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.667 179.802 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER 72.86 -17.78 0.39 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.215 -179.992 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . 0.538 ' H ' ' C ' ' A' ' 111' ' ' LEU . 17.1 tt0 47.7 36.83 6.05 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.595 179.902 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . 0.436 ' HA ' HH11 ' A' ' 114' ' ' ARG . 3.7 tpt85 -174.81 155.62 2.13 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.44 179.949 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 16.9 tp10 -168.33 -51.55 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.384 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.407 ' O ' ' HB2' ' A' ' 119' ' ' LEU . 17.2 mt -67.38 -34.12 76.62 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.112 -179.856 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' ALA . . . . . 0.463 ' O ' ' CG2' ' A' ' 120' ' ' VAL . . . -67.58 -24.29 65.49 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 120.037 -0.665 . . . . 0.0 109.316 -179.608 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . 0.473 ' C ' ' H ' ' A' ' 120' ' ' VAL . 18.1 mt -63.59 -31.01 72.04 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 114.858 -1.065 . . . . 0.0 109.823 178.24 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . 0.407 ' HB2' ' O ' ' A' ' 116' ' ' LEU . 0.3 OUTLIER -55.28 -11.27 0.73 Allowed 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 -179.14 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . 0.473 ' H ' ' C ' ' A' ' 118' ' ' LEU . 55.6 t -64.74 -8.08 4.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.544 -0.753 . . . . 0.0 109.809 175.307 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 22.1 p -92.64 -22.54 19.4 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.063 -178.92 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -89.33 -102.51 0.09 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.937 0.398 . . . . 0.0 110.346 179.777 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . 0.422 ' ND1' ' C ' ' A' ' 123' ' ' HIS . 0.0 OUTLIER 179.89 150.17 0.36 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.391 179.75 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 6.4 p30 -139.94 35.17 1.95 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.782 0.325 . . . . 0.0 110.556 -179.823 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 25.2 m-20 . . . . . 0 C--O 1.22 -0.456 0 CA-C-O 118.074 -0.965 . . . . 0.0 110.448 -179.833 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 501' ' ' C2E . . . . . 0.575 ' N71' ' CG ' ' A' ' 9' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 502' ' ' C2E . . . . . 0.787 ' C61' ' H ' ' A' ' 8' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.536 ' O ' ' CB ' ' A' ' 2' ' ' SER . 3.3 mmt . . . . . 0 N--CA 1.491 1.596 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.536 ' CB ' ' O ' ' A' ' 1' ' ' MET . 0.9 OUTLIER 91.67 -6.37 0.23 Allowed 'General case' 0 N--CA 1.463 0.22 0 CA-C-O 120.929 0.395 . . . . 0.0 109.967 -179.277 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -99.8 36.62 1.77 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.863 -0.608 . . . . 0.0 109.73 178.054 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . 0.511 ' O ' ' NH1' ' A' ' 8' ' ' ARG . 2.4 mm100 -114.84 -21.76 9.98 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.493 178.005 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . 0.418 ' O ' ' C ' ' A' ' 6' ' ' ASP . 10.7 m170 -60.76 -4.45 0.97 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.924 0.393 . . . . 0.0 110.094 179.651 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . 0.471 ' H ' ' C ' ' A' ' 4' ' ' GLN . 3.0 m-20 -36.27 143.32 0.07 Allowed 'General case' 0 C--N 1.333 -0.118 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.833 179.673 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.423 ' CD ' ' O ' ' A' ' 121' ' ' SER . 9.4 tt0 -82.17 130.88 35.2 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.65 -179.877 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.716 ' H ' ' C61' ' A' ' 502' ' ' C2E . 0.0 OUTLIER -124.51 -8.65 7.44 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.662 -179.609 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.822 ' O ' ' N ' ' A' ' 11' ' ' PHE . 3.6 mtt180 -99.05 75.98 2.08 Favored 'General case' 0 N--CA 1.464 0.232 0 N-CA-C 109.91 -0.404 . . . . 0.0 109.91 179.963 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.54 ' C ' ' O ' ' A' ' 9' ' ' ARG . 0.0 OUTLIER 16.74 -68.91 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.63 0 O-C-N 123.858 0.724 . . . . 0.0 111.427 -179.441 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . 0.822 ' N ' ' O ' ' A' ' 9' ' ' ARG . 0.1 OUTLIER -135.48 141.44 45.34 Favored 'General case' 0 CA--C 1.53 0.207 0 N-CA-C 109.751 -0.463 . . . . 0.0 109.751 179.615 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 5.8 p80 -41.01 151.29 0.06 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.824 0.345 . . . . 0.0 111.03 -179.652 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.698 ' NH1' ' NH1' ' A' ' 9' ' ' ARG . 3.4 mtm-85 -97.19 -172.13 2.36 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.498 -179.82 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 42.2 mm -94.82 98.05 7.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.887 -179.684 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -93.75 120.39 33.96 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.315 0.579 . . . . 0.0 111.19 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 2.3 p90 -149.76 157.66 43.42 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.164 -0.926 . . . . 0.0 108.683 178.045 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -95.6 146.21 24.65 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 120.343 -0.543 . . . . 0.0 110.502 -179.472 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . 179.32 174.45 0.76 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.367 179.703 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -96.15 133.84 39.94 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.544 179.924 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.531 ' O ' ' O ' ' A' ' 31' ' ' VAL . 3.3 p -134.64 154.11 51.66 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.976 0.417 . . . . 0.0 110.18 179.076 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -132.93 143.67 49.63 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.172 -0.677 . . . . 0.0 109.172 179.427 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 53.3 mt -124.33 136.41 60.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 C-N-CA 120.176 -0.61 . . . . 0.0 111.184 -179.477 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -121.11 123.39 42.2 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.659 -179.34 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.567 HE22 ' N ' ' A' ' 52' ' ' ASP . 3.4 tt0 -130.78 101.9 5.86 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.135 -0.939 . . . . 0.0 109.551 179.361 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 78.37 -129.08 9.1 Favored Glycine 0 CA--C 1.523 0.553 0 N-CA-C 109.785 -1.326 . . . . 0.0 109.785 -178.668 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 19.2 pt-20 -98.81 11.49 38.56 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.903 0.382 . . . . 0.0 110.21 179.367 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.449 ' HB3' ' CZ2' ' A' ' 29' ' ' TRP . 1.1 mpt_? -112.42 133.79 54.31 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.074 -0.512 . . . . 0.0 112.01 -178.922 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 17.2 ttt180 -127.12 149.58 49.88 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.873 -0.603 . . . . 0.0 109.764 178.777 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.566 ' NE1' ' O ' ' A' ' 48' ' ' ASP . 6.1 m-90 -147.74 156.45 42.76 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.769 -178.927 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 78.1 mt-10 -99.3 131.3 45.42 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.693 -0.685 . . . . 0.0 109.212 178.81 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.531 ' O ' ' O ' ' A' ' 20' ' ' SER . 14.4 m -137.15 154.7 31.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-O 121.256 0.551 . . . . 0.0 111.214 -179.504 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 13.0 tp -95.23 126.57 40.64 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 108.531 -0.914 . . . . 0.0 108.531 178.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.452 ' HG ' ' N ' ' A' ' 34' ' ' HIS . 2.3 tt -83.02 150.75 26.15 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 179.631 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' HIS . . . . . 0.452 ' N ' ' HG ' ' A' ' 33' ' ' LEU . 64.7 m-70 -123.01 -28.33 4.08 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.155 179.604 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . 0.535 ' CG ' HH21 ' A' ' 13' ' ' ARG . 2.3 p30 -173.83 160.62 3.65 Favored 'General case' 0 C--N 1.327 -0.413 0 C-N-CA 119.802 -0.759 . . . . 0.0 111.109 176.953 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 6.5 p -145.24 169.08 7.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.146 -179.06 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' SER . . . . . 0.483 ' CB ' HN22 ' A' ' 501' ' ' C2E . 29.8 t -142.17 167.68 21.55 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 107.985 -1.117 . . . . 0.0 107.985 178.6 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 2.7 pp -62.99 -0.16 0.65 Allowed 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 119.758 -0.777 . . . . 0.0 110.963 -179.157 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . 0.449 ' H ' ' C ' ' A' ' 37' ' ' SER . 0.4 OUTLIER -165.61 43.04 0.07 Allowed 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 120.793 -0.363 . . . . 0.0 111.467 -179.91 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . 0.42 ' HA3' ' N3 ' ' A' ' 501' ' ' C2E . . . -178.85 154.95 15.09 Favored Glycine 0 CA--C 1.528 0.881 0 N-CA-C 110.816 -0.914 . . . . 0.0 110.816 179.812 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -148.21 148.77 15.84 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.238 0 CA-C-O 121.469 0.652 . . . . 0.0 111.873 -178.9 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.439 ' HG ' ' O6 ' ' A' ' 501' ' ' C2E . 0.9 OUTLIER -120.79 132.42 55.02 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 114.813 -1.085 . . . . 0.0 108.187 178.355 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 5.4 m -139.26 175.9 6.88 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-O 121.368 0.604 . . . . 0.0 111.821 -178.737 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -98.0 143.87 16.94 Favored Glycine 0 CA--C 1.529 0.968 0 N-CA-C 109.758 -1.337 . . . . 0.0 109.758 178.148 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . 0.483 ' O ' ' OE1' ' A' ' 45' ' ' GLN . 1.7 tm0? -85.78 117.73 69.26 Favored Pre-proline 0 N--CA 1.466 0.345 0 CA-C-N 117.625 0.713 . . . . 0.0 111.686 -178.78 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_endo -86.79 161.76 9.1 Favored 'Trans proline' 0 C--N 1.311 -1.446 0 C-N-CA 121.628 1.552 . . . . 0.0 111.037 178.687 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.53 ' CD ' ' H ' ' A' ' 47' ' ' GLN . 1.2 mp0 -65.49 -40.63 93.31 Favored 'General case' 0 N--CA 1.467 0.407 0 N-CA-C 112.604 0.594 . . . . 0.0 112.604 -178.877 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . 0.566 ' O ' ' NE1' ' A' ' 29' ' ' TRP . 1.2 m-20 -72.2 8.56 1.27 Allowed 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 111.866 0.321 . . . . 0.0 111.866 -178.371 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' TRP . . . . . 0.463 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 63.5 t-105 -60.13 68.9 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.55 -0.295 . . . . 0.0 111.717 -179.521 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . 0.534 ' C ' HD21 ' A' ' 50' ' ' ASN . 0.7 OUTLIER -93.35 78.76 4.44 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 120.074 -0.651 . . . . 0.0 109.806 178.737 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . 0.452 ' CA ' HE22 ' A' ' 24' ' ' GLN . . . -143.93 151.22 23.19 Favored Glycine 0 CA--C 1.525 0.707 0 N-CA-C 110.896 -0.882 . . . . 0.0 110.896 -179.729 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . 0.567 ' N ' HE22 ' A' ' 24' ' ' GLN . 11.0 t0 -88.17 114.18 58.29 Favored Pre-proline 0 CA--C 1.536 0.415 0 CA-C-O 120.339 0.114 . . . . 0.0 111.014 -179.677 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_exo -46.93 -22.42 2.0 Favored 'Trans proline' 0 N--CA 1.497 1.694 0 C-N-CA 122.735 2.29 . . . . 0.0 112.671 179.618 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -78.27 -24.12 46.94 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 120.571 -0.452 . . . . 0.0 111.894 -178.632 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.553 ' O ' ' CE1' ' A' ' 57' ' ' PHE . 12.7 mtp85 -93.9 152.59 40.69 Favored Pre-proline 0 C--N 1.33 -0.247 0 C-N-CA 120.598 -0.441 . . . . 0.0 110.177 179.839 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_endo -65.01 160.57 40.89 Favored 'Trans proline' 0 N--CA 1.495 1.565 0 C-N-CA 122.734 2.289 . . . . 0.0 112.93 -178.912 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . 0.553 ' CE1' ' O ' ' A' ' 55' ' ' ARG . 43.1 m-85 -130.41 156.43 44.76 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.094 -0.957 . . . . 0.0 109.17 179.469 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -123.1 136.8 54.95 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 178.357 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -116.66 136.08 53.26 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.097 0.475 . . . . 0.0 111.931 -178.152 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.457 ' HE ' HD13 ' A' ' 68' ' ' LEU . 16.1 mmm-85 -123.02 127.56 48.95 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 177.864 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 6.9 mt -105.99 151.06 25.1 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.063 0.458 . . . . 0.0 111.243 -178.43 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' TYR . . . . . 0.478 ' CD1' ' N ' ' A' ' 62' ' ' TYR . 13.6 m-85 -135.88 108.9 7.66 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.002 179.291 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -105.34 -81.3 0.54 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.681 -0.69 . . . . 0.0 109.589 179.911 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . 0.411 ' H ' ' HB ' ' A' ' 67' ' ' VAL . . . -78.82 -176.44 47.93 Favored Glycine 0 CA--C 1.521 0.428 0 N-CA-C 109.254 -1.538 . . . . 0.0 109.254 178.421 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.41 ' H ' HD23 ' A' ' 65' ' ' LEU . 0.3 OUTLIER -76.39 -33.34 58.88 Favored 'General case' 0 C--N 1.329 -0.326 0 C-N-CA 119.918 -0.713 . . . . 0.0 110.59 -179.62 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.41 ' OD1' ' O ' ' A' ' 66' ' ' ASP . 48.2 t0 -103.06 9.21 38.64 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 122.753 0.421 . . . . 0.0 111.075 -179.789 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . 0.411 ' HB ' ' H ' ' A' ' 64' ' ' GLY . 28.7 t -103.33 95.21 3.66 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.249 0 CA-C-O 121.288 0.566 . . . . 0.0 111.698 -178.652 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.457 HD13 ' HE ' ' A' ' 60' ' ' ARG . 1.3 tp -114.2 117.6 31.65 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 178.917 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . 0.453 HD13 HG21 ' A' ' 69' ' ' ILE . 18.7 mm -113.15 145.24 19.35 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.252 0 CA-C-O 121.012 0.434 . . . . 0.0 111.726 -178.422 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 3.2 ptm180 -128.51 133.42 48.44 Favored 'General case' 0 C--O 1.239 0.502 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.078 179.133 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -146.16 150.42 35.84 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.273 -0.876 . . . . 0.0 110.144 -179.765 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -103.81 128.2 51.25 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 107.851 -1.166 . . . . 0.0 107.851 178.335 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.51 HD13 ' CG ' ' A' ' 85' ' ' PHE . 14.5 pt -135.97 156.98 38.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 C-N-CA 119.995 -0.682 . . . . 0.0 112.757 -177.594 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 31.3 t -122.41 151.35 41.34 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 114.781 -1.1 . . . . 0.0 109.903 179.195 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.506 ' CD1' ' CZ ' ' A' ' 85' ' ' PHE . 7.1 tp -66.21 121.2 14.66 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.184 0.516 . . . . 0.0 110.365 -179.68 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -97.57 -42.57 7.62 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 115.454 -0.793 . . . . 0.0 110.522 178.175 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' TRP . . . . . 0.555 ' NE1' ' HA3' ' A' ' 84' ' ' GLY . 66.8 p-90 -168.52 167.37 11.69 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 115.419 -0.809 . . . . 0.0 110.084 -179.357 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -147.51 123.77 10.89 Favored 'General case' 0 N--CA 1.465 0.325 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 178.612 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 33.9 ttt85 -152.4 134.29 14.81 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 119.789 -0.764 . . . . 0.0 113.043 179.87 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 57.05 47.3 17.7 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 113.781 1.03 . . . . 0.0 113.781 176.839 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 82.78 -27.48 3.82 Favored Glycine 0 CA--C 1.522 0.495 0 C-N-CA 120.292 -0.956 . . . . 0.0 113.28 177.075 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 3.9 mt -89.67 158.85 17.4 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 117.744 0.772 . . . . 0.0 110.153 -179.096 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 63.4 mt -130.68 135.44 47.83 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.387 -179.119 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . 0.555 ' HA3' ' NE1' ' A' ' 77' ' ' TRP . . . -93.93 151.69 20.38 Favored Glycine 0 N--CA 1.448 -0.561 0 N-CA-C 109.477 -1.449 . . . . 0.0 109.477 178.434 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . 0.51 ' CG ' HD13 ' A' ' 73' ' ' ILE . 26.8 m-85 -145.81 131.3 18.73 Favored 'General case' 0 C--N 1.317 -0.823 0 C-N-CA 120.647 -0.421 . . . . 0.0 110.692 -179.234 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.527 ' OE1' ' NE2' ' A' ' 88' ' ' GLN . 4.0 tt0 -103.76 127.56 51.23 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 179.664 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 4.9 t -70.67 122.77 20.42 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.929 0.395 . . . . 0.0 111.907 -178.616 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . 0.527 ' NE2' ' OE1' ' A' ' 86' ' ' GLU . 32.0 mm-40 -94.74 -32.43 13.33 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.898 -0.592 . . . . 0.0 109.774 179.16 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . 0.498 ' ND1' ' N ' ' A' ' 90' ' ' ILE . 0.0 OUTLIER -163.38 143.72 8.93 Favored 'General case' 0 C--O 1.223 -0.316 0 CA-C-N 115.74 -0.664 . . . . 0.0 109.984 179.751 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . 0.498 ' N ' ' ND1' ' A' ' 89' ' ' HIS . 10.7 tt -144.89 141.06 23.32 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-O 121.379 0.609 . . . . 0.0 109.918 -179.83 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . 0.553 ' O ' ' OG ' ' A' ' 94' ' ' SER . 4.7 t0 -56.43 142.11 39.8 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-N 115.209 -0.905 . . . . 0.0 112.1 -177.903 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 3.7 tp -54.44 -41.56 69.55 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 114.885 -1.052 . . . . 0.0 109.895 -179.635 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -70.51 -37.71 74.2 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.208 179.45 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' SER . . . . . 0.553 ' OG ' ' O ' ' A' ' 91' ' ' ASP . 2.2 p -63.16 -35.18 79.44 Favored 'General case' 0 C--N 1.333 -0.149 0 N-CA-C 109.841 -0.429 . . . . 0.0 109.841 179.706 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 36.2 mt -62.08 -39.16 82.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.209 179.539 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -70.53 -42.73 70.83 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.386 -0.526 . . . . 0.0 111.785 -178.371 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' HIS . . . . . 0.483 ' O ' ' HB2' ' A' ' 100' ' ' ARG . 57.4 m-70 -62.7 -40.17 96.31 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 119.153 -1.019 . . . . 0.0 109.264 -179.778 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 3.4 tp -66.46 -33.61 76.09 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 177.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 11.3 mtt-85 -57.74 -35.76 71.15 Favored 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 119.871 -0.732 . . . . 0.0 109.439 178.385 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . 0.483 ' HB2' ' O ' ' A' ' 97' ' ' HIS . 11.2 mmt180 -58.39 -47.69 83.04 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 121.178 0.513 . . . . 0.0 110.596 178.973 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.437 HD21 ' H ' ' A' ' 101' ' ' LEU . 1.7 mm? -66.84 -34.35 77.62 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.381 -179.803 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 71.8 t -68.63 -47.06 78.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-O 120.929 0.395 . . . . 0.0 110.555 179.512 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.2 tm-20 -65.42 -42.63 92.29 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.386 -179.436 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 28.2 mt -65.04 -42.38 94.34 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 120.796 -0.362 . . . . 0.0 110.487 -179.714 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 49.8 m-80 -74.59 -50.79 16.57 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.21 179.399 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 52.0 tp -57.6 -18.69 21.27 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 179.398 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -91.67 140.82 15.37 Favored Glycine 0 CA--C 1.52 0.378 0 N-CA-C 110.711 -0.955 . . . . 0.0 110.711 179.875 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -93.33 150.07 20.75 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 120.92 -0.312 . . . . 0.0 110.458 -179.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . 0.412 ' HG2' ' H ' ' A' ' 110' ' ' GLU . 16.6 tt0 -89.79 -142.16 0.15 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.263 179.973 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . 0.412 ' H ' ' HG2' ' A' ' 109' ' ' GLU . 2.2 tm-20 -66.55 -34.59 78.25 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.354 179.79 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -48.23 136.0 12.65 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.382 179.942 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 3.7 mt -38.82 129.58 1.51 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.743 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 9.7 mt-10 -76.75 134.61 39.11 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.193 179.72 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . 0.62 ' C ' ' H ' ' A' ' 116' ' ' LEU . 2.8 ttm180 -146.11 -76.56 0.2 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.745 -179.958 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 62.6 tt0 63.48 -9.0 0.14 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.079 0.466 . . . . 0.0 110.397 -179.921 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.62 ' H ' ' C ' ' A' ' 114' ' ' ARG . 55.3 tp -67.6 -35.67 79.41 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.877 -0.601 . . . . 0.0 112.531 -179.096 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -62.77 -23.02 67.0 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.26 -0.576 . . . . 0.0 110.826 -177.854 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . 0.433 ' O ' ' CB ' ' A' ' 121' ' ' SER . 13.0 mt -58.54 -32.89 69.31 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.234 -0.894 . . . . 0.0 109.546 178.47 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . 0.41 ' C ' ' H ' ' A' ' 121' ' ' SER . 1.0 OUTLIER -56.92 -43.6 81.61 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 107.926 -1.139 . . . . 0.0 107.926 179.708 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 20.1 t -57.39 -9.71 0.87 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 178.199 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' SER . . . . . 0.433 ' CB ' ' O ' ' A' ' 118' ' ' LEU . 1.0 OUTLIER -87.49 22.05 2.32 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 178.052 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . 0.429 ' CB ' ' O ' ' A' ' 121' ' ' SER . . . 164.94 -162.65 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.236 -0.893 . . . . 0.0 109.908 -179.736 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . 0.644 ' CG ' ' N ' ' A' ' 124' ' ' ASP . 0.0 OUTLIER 76.95 -52.04 0.57 Allowed 'General case' 0 C--N 1.333 -0.114 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 -178.883 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . 0.644 ' N ' ' CG ' ' A' ' 123' ' ' HIS . 24.3 m-20 2.32 84.41 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 115.747 -0.66 . . . . 0.0 112.026 179.656 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 17.7 p-10 . . . . . 0 C--O 1.221 -0.447 0 CA-C-O 118.042 -0.98 . . . . 0.0 110.415 179.786 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 501' ' ' C2E . . . . . 0.562 ' N71' ' CG ' ' A' ' 9' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 502' ' ' C2E . . . . . 0.716 ' C61' ' H ' ' A' ' 8' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.557 ' O ' ' CB ' ' A' ' 2' ' ' SER . 5.6 mmt . . . . . 0 N--CA 1.491 1.595 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.557 ' CB ' ' O ' ' A' ' 1' ' ' MET . 6.6 p 92.2 34.0 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.395 -179.526 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 10.1 p30 -100.07 22.11 11.81 Favored 'General case' 0 C--N 1.332 -0.179 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 177.73 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . 0.509 ' C ' ' H ' ' A' ' 6' ' ' ASP . 0.0 OUTLIER -113.84 -21.6 10.58 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 115.531 -0.759 . . . . 0.0 109.9 178.395 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . 0.418 ' O ' ' C ' ' A' ' 6' ' ' ASP . 32.1 m170 -66.69 3.95 0.91 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.102 179.305 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . 0.509 ' H ' ' C ' ' A' ' 4' ' ' GLN . 42.5 m-20 -37.77 147.05 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.123 179.961 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -80.4 134.2 35.98 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.149 0.5 . . . . 0.0 110.998 -179.358 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.605 HH21 ' C21' ' A' ' 501' ' ' C2E . 0.0 OUTLIER -121.27 -13.73 8.44 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.732 -179.952 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.751 ' O ' ' N ' ' A' ' 11' ' ' PHE . 3.8 ptt85 -110.19 69.63 0.7 Allowed 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 121.104 0.478 . . . . 0.0 109.938 179.794 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.596 ' CG ' HH11 ' A' ' 10' ' ' ARG . 0.0 OUTLIER 37.78 -72.65 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.044 -0.98 . . . . 0.0 111.799 -179.865 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . 0.751 ' N ' ' O ' ' A' ' 9' ' ' ARG . 6.0 m-85 -148.23 170.31 18.15 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 120.824 0.345 . . . . 0.0 110.571 -179.613 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -61.81 141.58 57.84 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.298 179.795 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.633 ' HE ' ' H ' ' A' ' 13' ' ' ARG . 0.5 OUTLIER -88.4 -174.38 4.58 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.592 -179.69 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.563 ' CD1' ' N ' ' A' ' 14' ' ' ILE . 1.9 mp -81.12 97.6 3.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.276 179.778 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -93.0 120.57 33.43 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.297 0.57 . . . . 0.0 111.402 -179.524 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 2.0 p90 -149.68 157.06 42.88 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.135 -0.939 . . . . 0.0 108.565 178.134 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -95.55 147.22 23.8 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 120.341 -0.544 . . . . 0.0 110.62 -179.223 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . 178.94 176.2 0.57 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.241 179.795 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -96.43 134.51 39.51 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.933 -179.608 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.654 ' O ' ' O ' ' A' ' 31' ' ' VAL . 11.5 p -136.48 159.93 40.29 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.07 179.092 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.471 ' OE1' ' N ' ' A' ' 22' ' ' ILE . 0.3 OUTLIER -148.29 145.2 28.07 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 108.717 -0.845 . . . . 0.0 108.717 178.772 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . 0.471 ' N ' ' OE1' ' A' ' 21' ' ' GLU . 61.6 mt -119.58 136.73 55.77 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.323 0 CA-C-O 121.237 0.542 . . . . 0.0 112.056 -177.776 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.433 ' CD1' ' N ' ' A' ' 23' ' ' LEU . 0.0 OUTLIER -117.8 123.24 45.46 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.492 -0.776 . . . . 0.0 110.443 179.678 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.422 ' HG3' ' O ' ' A' ' 56' ' ' PRO . 38.1 tt0 -129.26 101.42 5.99 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.446 -0.797 . . . . 0.0 109.823 179.101 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 78.09 -126.78 7.84 Favored Glycine 0 CA--C 1.521 0.418 0 N-CA-C 109.877 -1.289 . . . . 0.0 109.877 -179.089 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.457 ' OE1' ' O ' ' A' ' 26' ' ' GLU . 0.0 OUTLIER -100.24 9.82 42.16 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.894 0.378 . . . . 0.0 110.084 179.53 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.463 ' HB3' ' CZ2' ' A' ' 29' ' ' TRP . 36.7 mtt85 -112.37 134.62 53.81 Favored 'General case' 0 CA--C 1.521 -0.15 0 CA-C-N 116.06 -0.518 . . . . 0.0 112.066 -178.806 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 60.1 ttt-85 -129.24 150.15 50.74 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.346 179.852 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.528 ' NE1' ' O ' ' A' ' 48' ' ' ASP . 6.5 m-90 -147.49 155.01 41.48 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.171 -179.169 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.551 ' CD ' ' H ' ' A' ' 30' ' ' GLU . 1.4 mp0 -101.23 140.32 35.69 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 179.517 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.654 ' O ' ' O ' ' A' ' 20' ' ' SER . 18.9 m -148.89 157.11 7.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-O 121.149 0.499 . . . . 0.0 111.121 -179.466 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.684 ' H ' ' CD2' ' A' ' 32' ' ' LEU . 1.2 pt? -95.71 129.82 42.81 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 108.456 -0.942 . . . . 0.0 108.456 178.294 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.4 tt -93.57 126.11 38.54 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.403 0.62 . . . . 0.0 110.239 -179.255 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 50.2 m-70 -90.65 -25.75 19.95 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.009 -0.996 . . . . 0.0 111.863 -178.375 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -175.2 161.78 2.89 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 119.721 -0.792 . . . . 0.0 111.341 177.78 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 4.3 p -143.42 168.37 12.47 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.157 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.871 -179.472 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' SER . . . . . 0.448 ' C ' ' H ' ' A' ' 39' ' ' HIS . 25.3 t -142.92 167.06 22.97 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 107.789 -1.189 . . . . 0.0 107.789 178.399 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.488 ' C ' ' CG ' ' A' ' 39' ' ' HIS . 1.0 OUTLIER -63.28 -1.32 1.04 Allowed 'General case' 0 C--N 1.322 -0.588 0 C-N-CA 119.602 -0.839 . . . . 0.0 110.31 -179.811 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . 0.488 ' CG ' ' C ' ' A' ' 38' ' ' LEU . 0.0 OUTLIER -163.3 46.31 0.13 Allowed 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 120.713 -0.395 . . . . 0.0 111.301 179.995 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 177.14 153.58 11.05 Favored Glycine 0 CA--C 1.528 0.86 0 N-CA-C 111.221 -0.752 . . . . 0.0 111.221 179.568 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -148.77 149.36 15.08 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.255 0 CA-C-O 121.33 0.586 . . . . 0.0 111.64 -179.198 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.419 HD21 ' N ' ' A' ' 43' ' ' VAL . 0.6 OUTLIER -121.18 136.47 54.97 Favored 'General case' 0 N--CA 1.464 0.27 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 178.685 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.419 ' N ' HD21 ' A' ' 42' ' ' LEU . 19.3 m -140.22 175.29 6.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 C-N-CA 120.226 -0.589 . . . . 0.0 111.887 -179.561 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -97.3 144.36 17.28 Favored Glycine 0 CA--C 1.527 0.829 0 N-CA-C 109.247 -1.541 . . . . 0.0 109.247 177.938 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 60.4 tt0 -86.82 114.66 59.23 Favored Pre-proline 0 N--CA 1.466 0.349 0 CA-C-N 117.938 0.869 . . . . 0.0 111.839 -178.504 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 93.8 Cg_endo -84.85 162.7 12.03 Favored 'Trans proline' 0 C--N 1.31 -1.488 0 C-N-CA 121.81 1.674 . . . . 0.0 111.774 178.938 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.684 ' NE2' ' H ' ' A' ' 48' ' ' ASP . 0.4 OUTLIER -65.54 -40.1 92.5 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 112.438 0.532 . . . . 0.0 112.438 -178.981 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . 0.684 ' H ' ' NE2' ' A' ' 47' ' ' GLN . 37.6 m-20 -74.21 8.79 1.93 Allowed 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 111.895 0.331 . . . . 0.0 111.895 -178.645 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' TRP . . . . . 0.48 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 62.3 t-105 -60.79 69.01 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 112.006 0.373 . . . . 0.0 112.006 -179.525 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . 0.557 HD21 ' C ' ' A' ' 50' ' ' ASN . 0.2 OUTLIER -92.96 80.07 4.61 Favored 'General case' 0 C--N 1.326 -0.43 0 C-N-CA 119.84 -0.744 . . . . 0.0 109.439 178.476 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -143.17 146.08 16.53 Favored Glycine 0 CA--C 1.524 0.596 0 N-CA-C 111.341 -0.703 . . . . 0.0 111.341 -179.301 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 53.9 t0 -84.42 113.95 51.92 Favored Pre-proline 0 CA--C 1.533 0.305 0 CA-C-N 115.96 -0.12 . . . . 0.0 110.705 179.817 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_exo -48.0 -22.33 3.41 Favored 'Trans proline' 0 N--CA 1.497 1.716 0 C-N-CA 122.517 2.144 . . . . 0.0 112.194 179.854 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 34.5 mm-40 -77.63 -24.11 49.6 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.132 -0.485 . . . . 0.0 112.044 -178.703 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.564 ' O ' ' CE1' ' A' ' 57' ' ' PHE . 39.1 mtp85 -95.15 151.64 38.91 Favored Pre-proline 0 N--CA 1.464 0.245 0 C-N-CA 120.573 -0.451 . . . . 0.0 110.436 -179.703 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . 0.422 ' O ' ' HG3' ' A' ' 24' ' ' GLN . 38.3 Cg_endo -65.59 161.09 40.09 Favored 'Trans proline' 0 N--CA 1.498 1.751 0 C-N-CA 123.156 2.571 . . . . 0.0 113.072 -178.855 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . 0.564 ' CE1' ' O ' ' A' ' 55' ' ' ARG . 42.7 m-85 -131.59 156.29 46.04 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.344 -0.843 . . . . 0.0 109.572 179.587 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 29.2 mt-10 -120.35 133.95 55.35 Favored 'General case' 0 N--CA 1.469 0.475 0 N-CA-C 108.913 -0.773 . . . . 0.0 108.913 178.043 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -114.36 136.28 53.16 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.149 0.5 . . . . 0.0 111.998 -178.332 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 12.1 mmt180 -123.12 127.86 49.29 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 108.352 -0.981 . . . . 0.0 108.352 177.644 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 10.7 mp -108.16 147.14 31.7 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 120.33 -0.548 . . . . 0.0 110.683 -179.316 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' TYR . . . . . 0.513 ' CD1' ' N ' ' A' ' 62' ' ' TYR . 4.2 m-85 -130.6 111.1 11.91 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.353 179.77 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 1.8 tt -106.57 -79.33 0.57 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.852 -0.613 . . . . 0.0 109.938 179.781 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -80.99 -177.33 51.58 Favored Glycine 0 CA--C 1.52 0.404 0 N-CA-C 109.372 -1.491 . . . . 0.0 109.372 178.643 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 12.1 mt -76.07 -32.62 59.35 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 119.725 -0.79 . . . . 0.0 110.452 -179.441 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -104.16 8.91 36.38 Favored 'General case' 0 C--N 1.332 -0.185 0 C-N-CA 122.656 0.382 . . . . 0.0 111.222 -179.825 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 37.6 t -104.8 96.29 4.48 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.294 0 CA-C-O 121.37 0.605 . . . . 0.0 111.654 -179.072 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 3.1 tp -116.06 117.52 30.33 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 107.95 -1.13 . . . . 0.0 107.95 178.659 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . 0.464 HG22 HD12 ' A' ' 69' ' ' ILE . 20.9 mm -111.8 146.3 16.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.639 -178.29 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.678 ' H ' ' HG ' ' A' ' 94' ' ' SER . 0.0 OUTLIER -128.36 130.49 47.82 Favored 'General case' 0 C--O 1.238 0.481 0 CA-C-O 121.25 0.548 . . . . 0.0 111.134 178.817 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' MET . . . . . 0.403 ' HG2' ' C ' ' A' ' 70' ' ' ARG . 1.2 mtm -140.66 148.2 40.46 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.494 -0.775 . . . . 0.0 110.002 179.629 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . 0.457 ' OE2' ' O ' ' A' ' 57' ' ' PHE . 10.6 tp10 -100.74 128.47 46.77 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 107.678 -1.23 . . . . 0.0 107.678 178.666 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.512 HD13 ' CG ' ' A' ' 85' ' ' PHE . 9.2 pt -138.83 157.23 29.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 C-N-CA 119.601 -0.84 . . . . 0.0 112.965 -177.644 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -121.82 150.99 41.11 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 114.787 -1.097 . . . . 0.0 109.613 178.765 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.435 ' CD1' ' CZ ' ' A' ' 85' ' ' PHE . 7.3 tp -66.48 123.46 20.08 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.425 0.631 . . . . 0.0 110.457 -179.666 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -98.18 -43.63 6.92 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 114.959 -1.019 . . . . 0.0 111.115 178.168 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' TRP . . . . . 0.568 ' CD1' ' C2 ' ' A' ' 502' ' ' C2E . 68.7 p-90 -167.56 171.21 10.52 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.436 -179.124 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -151.09 123.87 8.58 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 116.541 -0.3 . . . . 0.0 110.305 178.776 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 8.1 ttt85 -152.33 133.6 14.38 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 112.821 0.674 . . . . 0.0 112.821 179.494 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . 0.414 ' O ' ' OD1' ' A' ' 80' ' ' ASP . 8.3 t70 56.4 47.41 19.02 Favored 'General case' 0 N--CA 1.464 0.26 0 N-CA-C 113.528 0.936 . . . . 0.0 113.528 176.506 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 69.43 12.72 66.93 Favored Glycine 0 CA--C 1.523 0.558 0 C-N-CA 120.305 -0.95 . . . . 0.0 111.931 178.188 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 49.5 mt -117.65 139.67 50.7 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 108.739 -0.837 . . . . 0.0 108.739 178.665 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 44.9 mt -122.72 135.06 54.46 Favored 'General case' 0 CA--C 1.513 -0.455 0 C-N-CA 120.359 -0.536 . . . . 0.0 111.179 -179.311 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . 0.563 ' HA3' ' NE1' ' A' ' 77' ' ' TRP . . . -97.81 153.63 20.14 Favored Glycine 0 N--CA 1.448 -0.558 0 N-CA-C 109.474 -1.451 . . . . 0.0 109.474 178.868 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . 0.512 ' CG ' HD13 ' A' ' 73' ' ' ILE . 27.8 m-85 -145.44 132.16 19.99 Favored 'General case' 0 C--N 1.314 -0.966 0 C-N-CA 120.788 -0.365 . . . . 0.0 110.668 -179.183 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 55.9 tt0 -103.92 127.88 51.44 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 179.726 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -76.62 125.86 29.98 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.065 0.459 . . . . 0.0 111.626 -178.715 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -103.46 -29.26 11.29 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.236 179.701 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . 0.459 ' ND1' ' C ' ' A' ' 89' ' ' HIS . 0.0 OUTLIER -160.35 141.2 11.97 Favored 'General case' 0 C--O 1.223 -0.318 0 CA-C-O 120.947 0.403 . . . . 0.0 110.462 179.542 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . 0.451 ' N ' ' ND1' ' A' ' 89' ' ' HIS . 7.5 tt -146.01 141.06 21.6 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.131 -179.619 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -56.75 138.82 52.42 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 115.194 -0.912 . . . . 0.0 111.864 -178.321 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 1.8 tt -54.09 -41.46 68.28 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 115.078 -0.965 . . . . 0.0 110.304 -179.849 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -67.88 -36.1 79.67 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 179.321 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' SER . . . . . 0.678 ' HG ' ' H ' ' A' ' 70' ' ' ARG . 3.9 m -68.62 -37.39 79.72 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.869 179.355 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 54.7 mt -58.9 -38.75 75.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.721 -179.757 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -70.67 -41.21 72.38 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 120.332 -0.547 . . . . 0.0 111.502 -178.385 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' HIS . . . . . 0.414 ' O ' ' HB2' ' A' ' 100' ' ' ARG . 58.5 m-70 -62.02 -37.58 85.42 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 119.272 -0.971 . . . . 0.0 109.216 179.875 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 6.5 tt -67.66 -34.1 76.26 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 110.059 -0.348 . . . . 0.0 110.059 178.095 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 8.1 mtp85 -59.22 -38.01 78.92 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.255 -0.578 . . . . 0.0 109.467 178.646 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . 0.414 ' HB2' ' O ' ' A' ' 97' ' ' HIS . 3.5 mmt180 -58.06 -45.66 86.68 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.736 178.758 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.409 ' N ' HD23 ' A' ' 101' ' ' LEU . 3.2 mm? -65.31 -37.96 88.71 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.628 -179.415 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . 0.548 ' O ' ' ND2' ' A' ' 105' ' ' ASN . 55.1 t -65.73 -47.55 85.55 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-O 120.941 0.401 . . . . 0.0 110.28 179.838 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 14.8 tm-20 -66.08 -39.27 89.91 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.459 179.803 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 13.8 mt -73.26 -42.53 62.39 Favored 'General case' 0 CA--C 1.532 0.28 0 N-CA-C 112.143 0.423 . . . . 0.0 112.143 -178.327 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . 0.548 ' ND2' ' O ' ' A' ' 102' ' ' VAL . 0.1 OUTLIER -70.61 -37.53 73.87 Favored 'General case' 0 N--CA 1.464 0.274 0 C-N-CA 120.589 -0.444 . . . . 0.0 111.131 -179.137 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 2.2 mt -56.07 -28.47 57.72 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.555 -179.696 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . 0.426 ' O ' ' C ' ' A' ' 108' ' ' ASP . . . 52.15 54.37 26.6 Favored Glycine 0 CA--C 1.523 0.567 0 N-CA-C 110.257 -1.137 . . . . 0.0 110.257 -179.498 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . 0.426 ' C ' ' O ' ' A' ' 107' ' ' GLY . 8.0 t0 -35.69 -69.19 0.11 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.779 0.323 . . . . 0.0 111.018 -179.612 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . 0.443 ' O ' ' OE1' ' A' ' 109' ' ' GLU . 0.0 OUTLIER -71.98 102.18 2.88 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.762 -179.649 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 58.43 -130.64 1.29 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.921 179.646 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . 0.479 ' O ' ' C ' ' A' ' 112' ' ' LEU . 4.0 mm? 59.04 94.8 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.384 -179.78 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.54 ' CG ' ' H ' ' A' ' 113' ' ' GLU . 0.4 OUTLIER 24.54 -113.69 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.837 179.826 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . 0.54 ' H ' ' CG ' ' A' ' 112' ' ' LEU . 0.7 OUTLIER 70.43 -73.74 0.09 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.226 -179.663 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . 0.511 ' O ' ' O ' ' A' ' 113' ' ' GLU . 1.6 ptt180 36.6 99.64 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.987 179.781 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 8.9 mt-10 -50.09 -15.4 0.21 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.965 -0.562 . . . . 0.0 111.064 -179.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 10.8 mp -54.14 -45.46 71.97 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.01 0.433 . . . . 0.0 110.36 -179.645 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -58.09 -52.29 66.16 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.969 179.791 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 11.7 mt -60.3 -48.42 81.83 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.958 -0.564 . . . . 0.0 112.291 -178.357 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . 0.412 ' C ' ' H ' ' A' ' 121' ' ' SER . 4.0 mm? -72.72 -50.51 24.23 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 119.886 -0.725 . . . . 0.0 111.002 -179.107 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 91.5 t -56.71 -8.64 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 C-N-CA 120.341 -0.544 . . . . 0.0 111.577 -175.602 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' SER . . . . . 0.412 ' H ' ' C ' ' A' ' 119' ' ' LEU . 11.1 t -83.25 -40.14 19.98 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 178.413 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . 0.571 ' O ' ' HB3' ' A' ' 123' ' ' HIS . . . -131.24 -144.66 0.26 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.347 -0.842 . . . . 0.0 109.848 179.431 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . 0.571 ' HB3' ' O ' ' A' ' 122' ' ' ALA . 0.0 OUTLIER 162.92 -154.22 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.288 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 179.496 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . 0.401 ' OD1' ' N ' ' A' ' 124' ' ' ASP . 1.0 OUTLIER -116.34 31.21 6.87 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-O 120.628 0.251 . . . . 0.0 110.821 179.958 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 125' ' ' ASP . . . . . 0.482 ' C ' ' CE1' ' A' ' 123' ' ' HIS . 50.0 m-20 . . . . . 0 C--O 1.22 -0.458 0 CA-C-O 118.025 -0.988 . . . . 0.0 110.625 -179.854 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 501' ' ' C2E . . . . . 0.969 ' O21' " H4'" ' A' ' 501' ' ' C2E . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 502' ' ' C2E . . . . . 0.568 ' C2 ' ' CD1' ' A' ' 77' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.438 ' C ' ' H ' ' A' ' 3' ' ' ASP . 45.9 mtt . . . . . 0 N--CA 1.491 1.589 0 N-CA-C 109.395 -0.595 . . . . 0.0 109.395 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 38.2 m -75.45 40.79 0.18 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.699 -179.784 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . 0.438 ' H ' ' C ' ' A' ' 1' ' ' MET . 79.6 m-20 -85.21 21.37 1.71 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.044 179.595 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . 0.74 ' NE2' ' H ' ' A' ' 6' ' ' ASP . 0.0 OUTLIER -112.16 -24.51 9.82 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.232 179.993 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . 0.579 ' C ' ' O ' ' A' ' 4' ' ' GLN . 0.0 OUTLIER 3.19 64.51 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 115.59 -0.732 . . . . 0.0 111.781 179.487 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . 0.74 ' H ' ' NE2' ' A' ' 4' ' ' GLN . 8.1 m-20 25.89 92.58 0.01 OUTLIER 'General case' 0 N--CA 1.461 0.121 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.889 179.74 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -98.26 127.61 44.28 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 120.695 -0.402 . . . . 0.0 110.358 -179.574 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.744 ' NH2' ' N11' ' A' ' 501' ' ' C2E . 0.0 OUTLIER -125.0 -3.83 7.57 Favored 'General case' 0 N--CA 1.462 0.135 0 CA-C-N 115.972 -0.558 . . . . 0.0 112.113 -178.977 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.584 ' NH1' ' CZ ' ' A' ' 13' ' ' ARG . 1.7 ptt180 -109.28 84.46 1.93 Allowed 'General case' 0 N--CA 1.467 0.402 0 CA-C-O 121.11 0.481 . . . . 0.0 110.241 179.799 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.529 ' C ' ' O ' ' A' ' 9' ' ' ARG . 0.0 OUTLIER 18.23 -87.92 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 114.979 -1.01 . . . . 0.0 111.689 -179.846 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . 0.45 ' N ' ' O ' ' A' ' 9' ' ' ARG . 0.5 OUTLIER -119.64 154.59 33.78 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.873 0.368 . . . . 0.0 110.174 -179.943 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . 0.466 ' ND1' ' N ' ' A' ' 12' ' ' HIS . 2.0 m-70 -46.64 172.37 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.067 -179.577 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.584 ' CZ ' ' NH1' ' A' ' 9' ' ' ARG . 2.3 mtm180 -118.24 -179.5 3.79 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.404 -179.875 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.587 ' CD1' ' N ' ' A' ' 14' ' ' ILE . 1.8 mp -91.46 94.16 4.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.944 179.727 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -93.35 120.4 33.6 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.358 0.599 . . . . 0.0 111.435 -179.493 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -149.7 156.19 41.46 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.029 -0.987 . . . . 0.0 108.509 178.01 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -95.38 148.04 22.87 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 120.271 -0.571 . . . . 0.0 110.646 -178.888 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . 178.73 178.69 0.42 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.695 -0.684 . . . . 0.0 109.852 179.565 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 63.1 t0 -96.63 133.78 40.7 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.76 179.946 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.573 ' O ' ' O ' ' A' ' 31' ' ' VAL . 13.0 p -134.11 154.03 51.45 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.013 0.435 . . . . 0.0 110.164 178.818 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -135.36 145.99 47.93 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 179.519 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 1.1 mm -124.83 136.28 61.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-O 121.278 0.561 . . . . 0.0 110.865 -179.092 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.401 ' CD1' ' NE ' ' A' ' 60' ' ' ARG . 0.3 OUTLIER -123.0 124.1 42.38 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.85 -179.615 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.523 ' O ' ' OE1' ' A' ' 24' ' ' GLN . 1.7 tm0? -130.92 102.2 5.95 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.418 -0.81 . . . . 0.0 109.459 178.774 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 79.04 -128.03 8.34 Favored Glycine 0 CA--C 1.525 0.659 0 N-CA-C 110.016 -1.234 . . . . 0.0 110.016 -178.705 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -99.75 12.07 37.6 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.732 0.301 . . . . 0.0 110.373 179.567 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.471 ' HB3' ' CZ2' ' A' ' 29' ' ' TRP . 0.0 OUTLIER -112.68 133.56 54.64 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.25 -0.432 . . . . 0.0 112.04 -178.815 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.436 ' HG2' ' N ' ' A' ' 29' ' ' TRP . 2.5 ttt85 -126.98 147.45 50.12 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.967 -0.56 . . . . 0.0 109.896 179.146 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.55 ' NE1' ' O ' ' A' ' 48' ' ' ASP . 6.6 m-90 -146.13 155.64 42.88 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.538 -0.755 . . . . 0.0 110.541 -179.214 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -100.19 137.49 38.55 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 179.144 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.573 ' O ' ' O ' ' A' ' 20' ' ' SER . 16.7 m -146.14 156.65 12.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-O 121.2 0.524 . . . . 0.0 111.077 -179.429 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 10.2 tp -95.67 129.95 42.71 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 108.042 -1.096 . . . . 0.0 108.042 178.421 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.3 tt -92.35 124.89 36.74 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.334 0.587 . . . . 0.0 109.99 -179.89 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 72.6 m-70 -90.29 -27.86 19.16 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.287 -0.87 . . . . 0.0 111.864 -178.429 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . 0.5 ' OD2' ' NH2' ' A' ' 13' ' ' ARG . 2.8 p30 -172.91 161.91 4.62 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 119.531 -0.867 . . . . 0.0 111.331 177.732 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 4.6 p -144.95 168.76 8.8 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.161 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.121 -179.186 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' SER . . . . . 0.477 ' HG ' ' N ' ' A' ' 38' ' ' LEU . 26.4 t -141.97 168.32 20.02 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 107.919 -1.141 . . . . 0.0 107.919 178.73 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.477 ' N ' ' HG ' ' A' ' 37' ' ' SER . 22.4 tp -64.92 -1.61 2.12 Favored 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 119.64 -0.824 . . . . 0.0 110.281 -179.495 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . 0.411 ' H ' ' C ' ' A' ' 37' ' ' SER . 3.2 p-80 -161.1 41.24 0.15 Allowed 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 120.569 -0.452 . . . . 0.0 111.857 179.655 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . 0.445 ' HA3' ' N3 ' ' A' ' 501' ' ' C2E . . . -178.76 155.96 17.65 Favored Glycine 0 CA--C 1.528 0.863 0 N-CA-C 111.255 -0.738 . . . . 0.0 111.255 179.635 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -147.29 148.72 16.26 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.321 0 CA-C-O 121.332 0.587 . . . . 0.0 111.991 -178.995 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -121.76 133.53 54.92 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 114.941 -1.027 . . . . 0.0 108.498 178.735 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 32.2 m -138.76 175.19 8.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-O 121.278 0.561 . . . . 0.0 111.891 -179.036 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -97.58 144.18 17.15 Favored Glycine 0 CA--C 1.527 0.842 0 N-CA-C 109.161 -1.575 . . . . 0.0 109.161 177.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . 0.495 ' CD ' ' O ' ' A' ' 45' ' ' GLN . 0.0 OUTLIER -87.34 118.63 70.17 Favored Pre-proline 0 CA--C 1.534 0.342 0 CA-C-N 118.159 0.98 . . . . 0.0 111.941 -178.339 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 95.6 Cg_endo -86.45 162.19 9.61 Favored 'Trans proline' 0 C--N 1.307 -1.608 0 C-N-CA 121.586 1.524 . . . . 0.0 111.196 178.649 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 4.0 mm100 -65.45 -40.23 92.98 Favored 'General case' 0 CA--C 1.533 0.322 0 N-CA-C 112.347 0.499 . . . . 0.0 112.347 -178.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . 0.55 ' O ' ' NE1' ' A' ' 29' ' ' TRP . 7.7 m-20 -71.78 8.83 1.04 Allowed 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.059 0.392 . . . . 0.0 112.059 -178.677 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' TRP . . . . . 0.471 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 64.0 t-105 -60.28 67.77 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 112.054 0.39 . . . . 0.0 112.054 -179.425 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . 0.549 ' ND2' ' C ' ' A' ' 50' ' ' ASN . 0.6 OUTLIER -93.29 78.56 4.48 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 120.195 -0.602 . . . . 0.0 109.394 178.395 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -144.6 145.41 14.84 Favored Glycine 0 CA--C 1.527 0.822 0 C-N-CA 121.165 -0.541 . . . . 0.0 111.807 -179.326 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 45.7 t0 -78.02 122.41 85.39 Favored Pre-proline 0 CA--C 1.536 0.419 0 CA-C-N 115.505 -0.348 . . . . 0.0 110.824 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 20.6 Cg_endo -60.96 -22.3 74.05 Favored 'Trans proline' 0 N--CA 1.498 1.769 0 C-N-CA 122.805 2.336 . . . . 0.0 112.079 -179.576 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 32.1 mt-30 -78.72 -23.53 45.45 Favored 'General case' 0 C--N 1.324 -0.54 0 C-N-CA 120.633 -0.427 . . . . 0.0 111.374 -179.264 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.567 ' O ' ' CE1' ' A' ' 57' ' ' PHE . 34.3 mtp85 -93.85 147.31 33.3 Favored Pre-proline 0 C--N 1.332 -0.186 0 C-N-CA 120.876 -0.33 . . . . 0.0 110.492 -179.741 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -60.71 160.96 22.8 Favored 'Trans proline' 0 N--CA 1.496 1.67 0 C-N-CA 123.041 2.494 . . . . 0.0 113.399 -178.817 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . 0.567 ' CE1' ' O ' ' A' ' 55' ' ' ARG . 39.1 m-85 -130.44 157.14 43.44 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 115.162 -0.927 . . . . 0.0 109.117 179.414 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -124.02 137.62 54.57 Favored 'General case' 0 N--CA 1.469 0.523 0 N-CA-C 109.486 -0.561 . . . . 0.0 109.486 178.683 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -118.55 136.7 53.7 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 112.41 0.522 . . . . 0.0 112.41 -178.093 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.435 HH11 ' HD2' ' A' ' 60' ' ' ARG . 0.6 OUTLIER -121.55 127.43 50.95 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 108.075 -1.083 . . . . 0.0 108.075 176.631 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 12.6 mt -110.11 151.18 27.55 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.93 0.395 . . . . 0.0 110.977 -178.63 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 55.6 m-85 -132.31 108.58 9.3 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.528 179.938 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 3.9 tt -104.17 -82.83 0.5 Allowed 'General case' 0 C--N 1.333 -0.121 0 CA-C-N 115.65 -0.705 . . . . 0.0 109.359 179.238 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . 0.403 ' H ' ' HB ' ' A' ' 67' ' ' VAL . . . -77.59 176.11 53.85 Favored Glycine 0 CA--C 1.521 0.418 0 N-CA-C 109.094 -1.602 . . . . 0.0 109.094 178.279 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.443 ' CD1' ' C ' ' A' ' 65' ' ' LEU . 3.1 tm? -72.2 -35.91 69.06 Favored 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 119.852 -0.739 . . . . 0.0 109.768 -179.693 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.478 ' OD1' ' O ' ' A' ' 66' ' ' ASP . 15.2 t0 -98.55 9.51 43.05 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.15 179.608 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . 0.403 ' HB ' ' H ' ' A' ' 64' ' ' GLY . 15.0 t -107.1 96.47 4.66 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.296 0 CA-C-O 121.453 0.644 . . . . 0.0 112.069 -178.719 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.411 HD22 HH11 ' A' ' 70' ' ' ARG . 0.0 OUTLIER -112.53 118.19 34.44 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 108.173 -1.047 . . . . 0.0 108.173 178.208 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . 0.427 HG23 ' OG ' ' A' ' 94' ' ' SER . 3.3 mt -113.37 144.21 21.48 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.233 0 CA-C-O 121.065 0.46 . . . . 0.0 111.373 -178.694 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.436 ' HD3' ' N ' ' A' ' 70' ' ' ARG . 0.0 OUTLIER -128.14 131.53 48.96 Favored 'General case' 0 C--O 1.239 0.508 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.868 179.407 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -143.26 149.74 38.31 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.11 -179.628 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -104.88 127.24 52.63 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 107.945 -1.131 . . . . 0.0 107.945 178.307 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.459 HD13 ' CG ' ' A' ' 85' ' ' PHE . 14.0 pt -134.9 157.91 41.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 N-CA-C 112.888 0.699 . . . . 0.0 112.888 -177.507 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 9.2 p -122.69 156.06 35.14 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.045 -0.98 . . . . 0.0 109.911 179.032 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 7.2 tp -65.42 119.05 10.3 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.885 0.374 . . . . 0.0 111.054 -179.447 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -97.63 -41.98 7.87 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.554 177.614 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' TRP . . . . . 0.567 ' NE1' ' HA3' ' A' ' 84' ' ' GLY . 67.7 p-90 -171.01 170.02 6.39 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 115.828 -0.624 . . . . 0.0 109.894 -179.741 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -151.32 124.02 8.52 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 110.017 -0.364 . . . . 0.0 110.017 178.84 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . 0.577 ' HE ' HO2' ' A' ' 502' ' ' C2E . 1.0 OUTLIER -152.15 133.64 14.58 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 119.833 -0.747 . . . . 0.0 112.91 179.67 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . 0.448 ' OD2' ' NH1' ' A' ' 79' ' ' ARG . 61.5 m-20 56.75 47.43 18.16 Favored 'General case' 0 N--CA 1.462 0.168 0 N-CA-C 114.131 1.16 . . . . 0.0 114.131 176.357 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 84.97 -28.35 4.59 Favored Glycine 0 CA--C 1.524 0.649 0 C-N-CA 120.425 -0.893 . . . . 0.0 113.311 177.043 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 4.5 mt -89.84 158.03 17.65 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 117.705 0.752 . . . . 0.0 110.567 -178.915 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 58.4 mt -129.95 135.59 48.49 Favored 'General case' 0 CA--C 1.517 -0.301 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.443 -179.13 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . 0.567 ' HA3' ' NE1' ' A' ' 77' ' ' TRP . . . -96.86 151.77 19.93 Favored Glycine 0 N--CA 1.451 -0.323 0 N-CA-C 109.517 -1.433 . . . . 0.0 109.517 178.522 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . 0.459 ' CG ' HD13 ' A' ' 73' ' ' ILE . 25.2 m-85 -145.56 132.32 20.03 Favored 'General case' 0 C--N 1.318 -0.804 0 C-N-CA 120.711 -0.396 . . . . 0.0 110.884 -179.205 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.464 ' O ' ' NE2' ' A' ' 88' ' ' GLN . 34.3 tt0 -104.04 126.58 51.27 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 179.614 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 39.1 t -69.23 122.2 18.37 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.005 0.431 . . . . 0.0 112.083 -178.486 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . 0.464 ' NE2' ' O ' ' A' ' 86' ' ' GLU . 51.6 mm-40 -95.28 -33.31 12.61 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.14 179.113 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -162.11 141.92 9.88 Favored 'General case' 0 C--O 1.223 -0.313 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.067 179.974 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . 0.66 ' CG1' ' HG ' ' A' ' 94' ' ' SER . 10.5 tt -145.05 141.17 23.01 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-O 121.237 0.541 . . . . 0.0 110.049 -179.467 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -59.44 141.52 54.48 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 115.319 -0.855 . . . . 0.0 112.382 -177.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 14.6 tp -54.21 -41.71 68.94 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 114.963 -1.017 . . . . 0.0 110.669 -179.549 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -65.49 -40.13 92.74 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 179.339 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' SER . . . . . 0.66 ' HG ' ' CG1' ' A' ' 90' ' ' ILE . 2.3 t -69.54 -35.01 75.06 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.149 179.392 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 36.1 mt -58.37 -38.35 68.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.802 -0.636 . . . . 0.0 109.821 -179.906 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -70.75 -37.98 73.46 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 120.383 -0.527 . . . . 0.0 111.051 -179.202 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 61.9 m-70 -63.75 -35.85 81.94 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 119.381 -0.927 . . . . 0.0 109.112 179.772 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 6.4 mp -67.33 -33.82 76.05 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 177.872 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 3.8 mtt-85 -61.6 -39.02 89.73 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 178.732 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 38.2 mtp180 -57.92 -45.73 86.08 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.549 179.0 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.41 ' O ' ' ND2' ' A' ' 105' ' ' ASN . 7.3 mp -63.84 -34.75 78.64 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.692 -0.685 . . . . 0.0 109.697 179.97 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 85.1 t -68.74 -40.51 81.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 116.037 -0.528 . . . . 0.0 110.151 178.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -65.5 -48.6 72.01 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.828 -0.623 . . . . 0.0 111.552 -179.35 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 6.5 mp -67.81 -43.01 80.64 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 120.702 -0.399 . . . . 0.0 111.211 -179.037 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . 0.41 ' ND2' ' O ' ' A' ' 101' ' ' LEU . 6.7 m-80 -64.41 -34.34 77.95 Favored 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 120.685 -0.406 . . . . 0.0 110.905 -179.704 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 8.1 mt -56.26 -18.82 11.64 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.778 -0.453 . . . . 0.0 109.778 179.686 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -104.26 -14.2 24.81 Favored Glycine 0 CA--C 1.524 0.6 0 N-CA-C 110.661 -0.976 . . . . 0.0 110.661 179.766 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 72.3 m-20 54.97 -169.3 0.07 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.803 0.335 . . . . 0.0 110.549 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . 0.557 ' CD ' ' H ' ' A' ' 109' ' ' GLU . 5.6 mp0 -67.84 -123.47 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.131 179.717 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . 0.415 ' O ' ' O ' ' A' ' 109' ' ' GLU . 45.3 mt-10 -47.99 -96.36 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.217 179.699 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . 0.447 ' O ' ' O ' ' A' ' 112' ' ' LEU . 44.3 tp -173.22 -90.62 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.225 -0.443 . . . . 0.0 109.984 179.664 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.447 ' O ' ' O ' ' A' ' 111' ' ' LEU . 0.7 OUTLIER 58.78 137.36 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.808 179.544 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 -47.08 102.16 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.519 179.916 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . 0.462 ' O ' ' CB ' ' A' ' 115' ' ' GLU . 18.1 ttm180 -161.37 118.32 2.24 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.667 179.946 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . 0.462 ' CB ' ' O ' ' A' ' 114' ' ' ARG . 7.5 tt0 162.15 -48.22 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.81 -0.632 . . . . 0.0 109.517 -179.854 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 6.3 tt -67.33 -35.11 78.73 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.472 -0.786 . . . . 0.0 111.025 179.678 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -65.59 -23.16 66.77 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-O 121.173 0.511 . . . . 0.0 110.727 -178.687 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . 0.417 ' O ' ' CB ' ' A' ' 121' ' ' SER . 34.2 mt -57.21 -40.38 77.37 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 178.695 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . 0.599 ' C ' ' H ' ' A' ' 121' ' ' SER . 3.9 mm? -57.22 -47.37 81.5 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 107.634 -1.247 . . . . 0.0 107.634 179.118 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 24.1 t -58.72 1.0 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.847 177.344 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' SER . . . . . 0.599 ' H ' ' C ' ' A' ' 119' ' ' LEU . 1.5 t -98.98 -41.85 7.39 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 108.429 -0.952 . . . . 0.0 108.429 177.155 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . 0.434 ' O ' ' O ' ' A' ' 123' ' ' HIS . . . -131.12 63.72 1.59 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.171 -0.922 . . . . 0.0 110.484 -179.941 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . 0.754 ' CG ' ' N ' ' A' ' 124' ' ' ASP . 0.0 OUTLIER -56.37 -158.3 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 120.714 -0.394 . . . . 0.0 111.181 -178.687 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . 0.754 ' N ' ' CG ' ' A' ' 123' ' ' HIS . 9.0 t70 157.44 -24.41 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.865 179.639 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 . . . . . 0 C--O 1.221 -0.427 0 CA-C-O 117.938 -1.029 . . . . 0.0 110.587 179.985 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 501' ' ' C2E . . . . . 0.873 ' O21' " H4'" ' A' ' 501' ' ' C2E . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 502' ' ' C2E . . . . . 0.582 ' N71' ' NH2' ' A' ' 8' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.5 mtt . . . . . 0 N--CA 1.491 1.578 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 59.5 p -105.48 86.18 2.37 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.651 -179.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . 0.48 ' N ' ' OD1' ' A' ' 3' ' ' ASP . 0.4 OUTLIER -99.81 103.84 15.49 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 109.157 -0.683 . . . . 0.0 109.157 177.942 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . 0.898 HE21 ' H ' ' A' ' 5' ' ' HIS . 0.0 OUTLIER -108.13 -34.12 6.96 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.725 -0.67 . . . . 0.0 111.09 -179.149 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . 0.898 ' H ' HE21 ' A' ' 4' ' ' GLN . 40.1 m170 -111.48 -106.35 0.37 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.44 -0.346 . . . . 0.0 111.012 -179.242 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . 0.477 ' O ' ' N71' ' A' ' 502' ' ' C2E . 24.7 m-20 54.57 163.77 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.998 -0.371 . . . . 0.0 109.998 -179.499 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -104.32 127.75 52.03 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 120.888 0.375 . . . . 0.0 111.43 -179.418 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.654 ' NH2' ' C21' ' A' ' 501' ' ' C2E . 0.0 OUTLIER -123.9 -12.57 7.52 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.476 -179.794 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.618 ' HG2' ' O61' ' A' ' 502' ' ' C2E . 8.0 ptt85 -116.14 83.72 1.99 Allowed 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 120.831 0.348 . . . . 0.0 110.251 179.654 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.549 ' C ' ' O ' ' A' ' 9' ' ' ARG . 0.0 OUTLIER 18.86 -83.03 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.381 -0.827 . . . . 0.0 111.39 -179.938 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . 0.588 ' N ' ' O ' ' A' ' 9' ' ' ARG . 0.1 OUTLIER -117.68 171.16 8.21 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-O 120.947 0.403 . . . . 0.0 110.609 179.969 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . 0.49 ' C ' ' HE ' ' A' ' 13' ' ' ARG . 0.0 OUTLIER -73.45 -0.39 14.77 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.471 -179.409 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.495 ' CZ ' ' NH1' ' A' ' 9' ' ' ARG . 9.8 mtm180 67.85 178.28 0.24 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.835 0.35 . . . . 0.0 110.277 -179.656 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.569 ' CD1' ' N ' ' A' ' 14' ' ' ILE . 1.4 mp -84.6 105.64 13.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.455 -179.901 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -95.46 119.72 34.46 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.459 0.647 . . . . 0.0 111.55 -179.883 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -150.02 155.12 39.35 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 114.904 -1.044 . . . . 0.0 108.293 177.891 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . 0.53 ' N ' ' OD1' ' A' ' 17' ' ' ASP . 17.9 p-10 -95.6 146.22 24.64 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 120.09 -0.644 . . . . 0.0 111.005 -178.626 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -178.65 174.9 1.14 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.244 179.588 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 3.5 t0 -96.07 133.91 39.75 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.854 -179.669 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.539 ' O ' ' O ' ' A' ' 31' ' ' VAL . 27.7 p -133.71 152.51 51.9 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.253 0.549 . . . . 0.0 110.358 178.729 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.482 ' OE1' ' NH2' ' A' ' 28' ' ' ARG . 6.7 mm-40 -131.34 151.96 51.04 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 108.976 -0.75 . . . . 0.0 108.976 179.533 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . 0.416 ' HA ' ' O ' ' A' ' 58' ' ' GLU . 22.6 mt -134.44 136.25 53.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 C-N-CA 120.053 -0.659 . . . . 0.0 111.304 -179.376 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -124.16 123.27 39.93 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.473 -0.785 . . . . 0.0 111.402 -179.142 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.536 ' OE1' ' CZ ' ' A' ' 57' ' ' PHE . 24.1 tt0 -128.12 102.07 6.56 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.538 -0.755 . . . . 0.0 109.811 178.61 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 80.97 -125.8 7.06 Favored Glycine 0 CA--C 1.522 0.528 0 N-CA-C 109.974 -1.25 . . . . 0.0 109.974 -178.894 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -100.55 12.19 37.86 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.954 0.407 . . . . 0.0 110.014 179.489 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.572 ' HB3' ' CZ2' ' A' ' 29' ' ' TRP . 24.1 mtt85 -114.27 135.84 53.62 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 112.968 0.729 . . . . 0.0 112.968 -178.062 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.482 ' NH2' ' OE1' ' A' ' 21' ' ' GLU . 72.0 ttt-85 -128.69 151.38 49.59 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.017 178.77 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.572 ' CZ2' ' HB3' ' A' ' 27' ' ' ARG . 6.5 m-90 -149.25 156.56 42.31 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.59 -179.249 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -100.83 140.07 35.64 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.09 -0.504 . . . . 0.0 109.676 179.321 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.539 ' O ' ' O ' ' A' ' 20' ' ' SER . 12.5 m -149.92 158.45 5.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-O 121.324 0.583 . . . . 0.0 111.19 -179.267 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.69 ' H ' ' CD2' ' A' ' 32' ' ' LEU . 1.0 OUTLIER -99.02 129.95 45.33 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 108.577 -0.897 . . . . 0.0 108.577 178.556 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.2 tt -95.18 125.51 39.87 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 120.306 -0.558 . . . . 0.0 109.787 -179.62 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' HIS . . . . . 0.484 ' HE2' ' CD1' ' A' ' 32' ' ' LEU . 20.3 m-70 -90.62 -26.17 19.77 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.402 -0.817 . . . . 0.0 111.714 -178.455 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -172.16 161.31 5.42 Favored 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 119.544 -0.862 . . . . 0.0 111.271 177.403 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 8.4 p -145.17 168.59 8.59 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.823 -178.792 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 6.4 t -141.77 169.66 17.17 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 108.045 -1.094 . . . . 0.0 108.045 178.801 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 5.7 tt -67.69 -1.97 6.13 Favored 'General case' 0 C--N 1.323 -0.556 0 C-N-CA 119.872 -0.731 . . . . 0.0 110.69 -179.325 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . 0.569 ' CE1' ' O ' ' A' ' 87' ' ' CYS . 58.1 t60 -156.98 35.42 0.29 Allowed 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 120.777 -0.369 . . . . 0.0 111.501 -179.756 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . 0.437 ' HA3' ' N3 ' ' A' ' 501' ' ' C2E . . . -175.96 158.98 26.17 Favored Glycine 0 CA--C 1.527 0.787 0 N-CA-C 111.241 -0.744 . . . . 0.0 111.241 179.811 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -149.36 149.58 14.65 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.388 0 CA-C-O 121.104 0.478 . . . . 0.0 111.532 -178.963 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.7 tt -122.09 141.86 50.96 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 115.527 -0.761 . . . . 0.0 109.105 178.519 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 20.0 m -145.26 174.98 2.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-O 121.263 0.554 . . . . 0.0 111.684 -179.562 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -98.72 145.63 17.8 Favored Glycine 0 CA--C 1.528 0.846 0 N-CA-C 109.808 -1.317 . . . . 0.0 109.808 178.811 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 47.5 tt0 -87.22 113.27 53.0 Favored Pre-proline 0 N--CA 1.463 0.22 0 CA-C-N 117.611 0.706 . . . . 0.0 111.699 -178.654 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 96.9 Cg_endo -83.96 161.35 13.82 Favored 'Trans proline' 0 C--N 1.306 -1.682 0 C-N-CA 121.56 1.507 . . . . 0.0 111.372 179.031 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.535 ' CD ' ' H ' ' A' ' 47' ' ' GLN . 0.0 OUTLIER -65.12 -26.24 68.11 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 112.388 0.514 . . . . 0.0 112.388 -178.797 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . 0.534 ' O ' ' N ' ' A' ' 50' ' ' ASN . 1.3 p30 -86.65 8.42 22.45 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 112.085 0.402 . . . . 0.0 112.085 -178.619 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' TRP . . . . . 0.435 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 58.9 t-105 -60.52 68.56 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 111.786 0.291 . . . . 0.0 111.786 -179.69 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . 0.534 ' N ' ' O ' ' A' ' 48' ' ' ASP . 0.3 OUTLIER -93.15 78.77 4.54 Favored 'General case' 0 C--N 1.324 -0.509 0 C-N-CA 120.129 -0.628 . . . . 0.0 109.763 178.607 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -145.02 160.17 27.99 Favored Glycine 0 CA--C 1.525 0.708 0 N-CA-C 111.047 -0.821 . . . . 0.0 111.047 -179.611 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 30.1 t0 -95.31 110.89 52.98 Favored Pre-proline 0 CA--C 1.533 0.296 0 C-N-CA 121.267 -0.173 . . . . 0.0 110.924 -179.646 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_exo -47.79 -22.35 3.13 Favored 'Trans proline' 0 N--CA 1.493 1.485 0 C-N-CA 122.362 2.041 . . . . 0.0 112.357 179.614 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 83.7 mt-30 -76.77 -23.85 52.93 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.382 -179.411 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.521 ' O ' ' CE1' ' A' ' 57' ' ' PHE . 15.9 mtp180 -95.46 151.88 38.89 Favored Pre-proline 0 CA--C 1.531 0.227 0 N-CA-C 110.08 -0.341 . . . . 0.0 110.08 179.987 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . 0.454 ' O ' ' OE1' ' A' ' 24' ' ' GLN . 35.4 Cg_endo -64.85 160.87 38.8 Favored 'Trans proline' 0 N--CA 1.495 1.579 0 C-N-CA 122.852 2.368 . . . . 0.0 113.331 -178.497 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . 0.536 ' CZ ' ' OE1' ' A' ' 24' ' ' GLN . 57.8 m-85 -130.71 154.66 47.72 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 114.997 -1.001 . . . . 0.0 109.192 179.486 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.416 ' O ' ' HA ' ' A' ' 22' ' ' ILE . 16.5 mt-10 -119.31 136.01 54.44 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 108.863 -0.792 . . . . 0.0 108.863 178.667 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . 0.496 ' C ' ' HE ' ' A' ' 60' ' ' ARG . . . -120.47 139.43 52.88 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.281 0.563 . . . . 0.0 112.507 -177.871 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.496 ' HE ' ' C ' ' A' ' 59' ' ' ALA . 2.4 mmp_? -123.96 127.67 48.29 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 108.418 -0.956 . . . . 0.0 108.418 177.304 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 9.6 mp -105.78 150.36 25.61 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 120.701 -0.4 . . . . 0.0 110.386 -179.234 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' TYR . . . . . 0.446 ' CD1' ' N ' ' A' ' 62' ' ' TYR . 18.3 m-85 -133.9 108.99 8.75 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.46 179.643 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.427 ' C ' ' CD2' ' A' ' 63' ' ' LEU . 2.4 tt -104.97 -84.7 0.49 Allowed 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.582 -0.736 . . . . 0.0 109.207 179.382 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . 0.416 ' H ' ' HB3' ' A' ' 63' ' ' LEU . . . -75.72 178.11 48.69 Favored Glycine 0 CA--C 1.52 0.384 0 N-CA-C 109.23 -1.548 . . . . 0.0 109.23 178.508 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 11.6 mt -73.34 -33.8 65.31 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 119.949 -0.7 . . . . 0.0 110.31 -179.588 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -100.87 9.31 42.48 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.822 179.913 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 8.7 t -104.94 94.97 3.43 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-O 121.334 0.588 . . . . 0.0 111.901 -178.824 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 6.1 tp -112.37 117.46 32.51 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 177.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . 0.404 HG22 ' OG ' ' A' ' 94' ' ' SER . 3.4 mt -112.63 144.78 19.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 120.946 0.403 . . . . 0.0 111.148 -178.942 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.401 ' N ' HG22 ' A' ' 69' ' ' ILE . 5.9 mtt85 -127.98 131.6 49.24 Favored 'General case' 0 C--O 1.239 0.506 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.75 179.344 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -142.95 149.03 37.85 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.211 -179.822 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 17.6 tp10 -100.44 134.2 43.74 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 107.635 -1.246 . . . . 0.0 107.635 178.123 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.407 HD11 ' CG ' ' A' ' 85' ' ' PHE . 4.5 pt -144.1 157.34 15.63 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.157 0 C-N-CA 119.084 -1.046 . . . . 0.0 113.138 -177.707 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 29.7 m -122.06 152.86 39.36 Favored 'General case' 0 N--CA 1.463 0.225 0 CA-C-N 115.012 -0.995 . . . . 0.0 109.965 178.877 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -65.31 120.31 12.55 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-O 120.964 0.411 . . . . 0.0 110.398 -179.197 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -97.31 -37.63 9.97 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.166 177.53 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' TRP . . . . . 0.707 ' NE1' ' HA3' ' A' ' 84' ' ' GLY . 69.6 p-90 -171.12 169.91 6.33 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.745 179.725 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -151.45 123.9 8.37 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.178 178.459 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 21.6 ttm-85 -152.36 131.44 12.66 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 120.308 -0.557 . . . . 0.0 112.35 179.441 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 19.5 t70 55.95 47.28 20.31 Favored 'General case' 0 N--CA 1.466 0.325 0 N-CA-C 113.634 0.976 . . . . 0.0 113.634 176.257 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 68.74 12.28 64.2 Favored Glycine 0 CA--C 1.523 0.549 0 C-N-CA 120.325 -0.941 . . . . 0.0 111.594 178.603 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 32.4 mt -114.36 139.93 49.07 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 178.156 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 27.6 mt -128.45 135.28 49.26 Favored 'General case' 0 CA--C 1.512 -0.515 0 C-N-CA 120.298 -0.561 . . . . 0.0 111.51 -178.805 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . 0.707 ' HA3' ' NE1' ' A' ' 77' ' ' TRP . . . -103.49 155.39 17.92 Favored Glycine 0 N--CA 1.446 -0.667 0 N-CA-C 109.179 -1.568 . . . . 0.0 109.179 178.436 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . 0.407 ' CG ' HD11 ' A' ' 73' ' ' ILE . 49.6 m-85 -145.75 136.79 24.66 Favored 'General case' 0 C--N 1.311 -1.093 0 C-N-CA 120.792 -0.363 . . . . 0.0 110.417 -179.535 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.444 ' O ' ' NE2' ' A' ' 88' ' ' GLN . 4.6 pt-20 -103.89 127.76 51.4 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 179.232 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . 0.569 ' O ' ' CE1' ' A' ' 39' ' ' HIS . 4.8 t -75.73 126.08 30.3 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.889 0.376 . . . . 0.0 111.985 -178.305 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . 0.444 ' NE2' ' O ' ' A' ' 86' ' ' GLU . 0.0 OUTLIER -102.1 -28.5 12.3 Favored 'General case' 0 N--CA 1.462 0.143 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.49 179.318 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . 0.554 ' ND1' ' N ' ' A' ' 90' ' ' ILE . 0.1 OUTLIER -161.0 141.26 11.1 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.958 0.409 . . . . 0.0 110.377 179.712 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . 0.56 ' CD1' ' OG ' ' A' ' 94' ' ' SER . 7.9 tt -146.01 141.34 21.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.186 -179.422 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . 0.526 ' N ' ' OD1' ' A' ' 91' ' ' ASP . 0.3 OUTLIER -55.24 143.15 28.88 Favored 'General case' 0 N--CA 1.462 0.139 0 CA-C-N 115.381 -0.827 . . . . 0.0 111.98 -178.293 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 59.2 tp -54.08 -41.66 68.46 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.066 -0.97 . . . . 0.0 109.705 -179.579 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -67.88 -38.33 82.91 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.001 -0.545 . . . . 0.0 109.554 179.081 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' SER . . . . . 0.56 ' OG ' ' CD1' ' A' ' 90' ' ' ILE . 5.6 t -68.25 -35.14 77.45 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.946 179.368 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 44.2 mt -58.74 -38.26 70.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.786 -0.643 . . . . 0.0 109.702 179.507 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -71.42 -42.11 68.7 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.947 -179.728 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' HIS . . . . . 0.408 ' O ' ' HB2' ' A' ' 100' ' ' ARG . 61.3 m-70 -61.79 -37.52 84.68 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 119.745 -0.782 . . . . 0.0 109.718 -179.996 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 2.6 mp -67.54 -34.05 76.31 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 177.711 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 8.8 mtt85 -66.31 -37.11 84.63 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 177.551 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . 0.408 ' HB2' ' O ' ' A' ' 97' ' ' HIS . 56.1 mtp180 -61.67 -44.2 97.41 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.105 -0.952 . . . . 0.0 110.969 178.916 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 5.0 mt -62.16 -39.61 93.24 Favored 'General case' 0 C--N 1.332 -0.174 0 C-N-CA 120.608 -0.437 . . . . 0.0 109.824 -179.318 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . 0.478 ' O ' ' N ' ' A' ' 106' ' ' LEU . 72.6 t -68.5 -43.2 83.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.57 179.72 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -59.06 -48.74 80.51 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.017 -179.609 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 8.7 mt -67.44 -42.21 83.51 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.741 -0.383 . . . . 0.0 110.421 -179.629 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -72.38 -29.01 63.37 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.435 179.88 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.478 ' N ' ' O ' ' A' ' 102' ' ' VAL . 41.7 tp -63.84 -21.77 66.6 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.756 -0.461 . . . . 0.0 109.756 179.614 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -172.91 138.6 4.77 Favored Glycine 0 CA--C 1.525 0.714 0 N-CA-C 110.949 -0.86 . . . . 0.0 110.949 179.767 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 29.4 m-20 -126.14 -62.35 1.17 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.778 0.323 . . . . 0.0 110.505 -179.89 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . 0.53 ' O ' ' N ' ' A' ' 111' ' ' LEU . 1.4 pm0 -146.04 127.32 14.84 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.254 179.559 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -38.67 90.73 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.907 -179.844 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . 0.53 ' N ' ' O ' ' A' ' 109' ' ' GLU . 0.6 OUTLIER -92.46 -163.16 1.01 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.247 179.678 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 33.2 tp -88.67 -78.54 0.34 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.261 179.901 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 30.1 mt-10 -57.19 -171.34 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.451 179.794 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . 0.439 ' CZ ' ' O ' ' A' ' 114' ' ' ARG . 19.7 ttp85 -159.68 46.09 0.26 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.655 179.592 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 5.3 mp0 56.81 20.8 5.45 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.675 179.695 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 23.9 mt -67.74 -39.95 84.2 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.631 -179.68 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -58.24 -22.58 52.81 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-O 121.54 0.686 . . . . 0.0 110.236 -178.852 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . 0.423 ' HA ' ' HG ' ' A' ' 121' ' ' SER . 11.3 mt -58.37 -31.38 67.57 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 114.742 -1.117 . . . . 0.0 108.892 177.668 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . 0.413 ' C ' ' H ' ' A' ' 121' ' ' SER . 11.9 mt -55.97 -45.93 78.77 Favored 'General case' 0 C--N 1.332 -0.167 0 N-CA-C 108.428 -0.953 . . . . 0.0 108.428 -179.899 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 61.9 t -57.47 -8.75 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.055 178.603 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' SER . . . . . 0.676 ' O ' ' O ' ' A' ' 122' ' ' ALA . 0.0 OUTLIER -109.4 -38.82 5.38 Favored 'General case' 0 C--N 1.332 -0.164 0 N-CA-C 108.45 -0.945 . . . . 0.0 108.45 177.799 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . 0.676 ' O ' ' O ' ' A' ' 121' ' ' SER . . . -46.1 -143.75 0.0 OUTLIER 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 114.974 -1.012 . . . . 0.0 111.657 179.832 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . 0.678 ' CD2' ' N ' ' A' ' 124' ' ' ASP . 0.4 OUTLIER -25.25 -42.19 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.551 -179.594 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . 0.678 ' N ' ' CD2' ' A' ' 123' ' ' HIS . 11.5 t0 61.72 -68.18 0.06 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.17 -179.484 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 125' ' ' ASP . . . . . 0.553 ' N ' ' O ' ' A' ' 123' ' ' HIS . 21.6 t0 . . . . . 0 C--O 1.22 -0.455 0 CA-C-O 117.985 -1.007 . . . . 0.0 111.438 -179.528 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 501' ' ' C2E . . . . . 0.654 ' C21' ' NH2' ' A' ' 8' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 502' ' ' C2E . . . . . 0.618 ' O61' ' HG2' ' A' ' 9' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.1 mtp . . . . . 0 N--CA 1.49 1.555 0 N-CA-C 109.4 -0.592 . . . . 0.0 109.4 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.682 ' O ' ' N ' ' A' ' 4' ' ' GLN . 3.3 p 176.32 52.61 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.446 179.964 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -58.58 62.47 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.182 0.515 . . . . 0.0 110.449 -179.622 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . 0.682 ' N ' ' O ' ' A' ' 2' ' ' SER . 23.4 mm-40 -71.1 -3.14 18.31 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.474 -0.784 . . . . 0.0 110.576 -179.178 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . 0.444 ' O ' ' C ' ' A' ' 6' ' ' ASP . 25.2 m170 -80.74 -16.83 52.85 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 178.352 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . 0.444 ' C ' ' O ' ' A' ' 5' ' ' HIS . 99.3 m-20 -31.38 147.84 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 115.166 -0.925 . . . . 0.0 110.963 178.94 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -81.36 133.35 35.41 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.149 0.499 . . . . 0.0 110.099 179.888 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.648 ' H ' ' C61' ' A' ' 502' ' ' C2E . 0.0 OUTLIER -123.44 -10.14 7.97 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.332 -179.679 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.737 ' O ' ' N ' ' A' ' 11' ' ' PHE . 3.4 mtt180 -97.79 74.99 2.38 Favored 'General case' 0 CA--C 1.516 -0.33 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 -179.903 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.523 ' C ' ' O ' ' A' ' 9' ' ' ARG . 0.0 OUTLIER 22.71 -78.12 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.662 -179.5 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . 0.737 ' N ' ' O ' ' A' ' 9' ' ' ARG . 9.9 m-85 -129.27 152.42 48.86 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.622 -0.51 . . . . 0.0 109.622 178.945 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . 0.598 ' H ' ' CD2' ' A' ' 12' ' ' HIS . 2.0 p80 -47.17 157.24 0.19 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.812 0.339 . . . . 0.0 110.75 -179.505 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.618 ' NH1' ' N1 ' ' A' ' 501' ' ' C2E . 0.1 OUTLIER -103.61 -165.37 1.15 Allowed 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.499 -179.821 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.434 ' CG2' ' OD1' ' A' ' 105' ' ' ASN . 41.8 mm -102.77 96.25 4.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.491 179.982 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -93.83 119.96 33.46 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.274 0.559 . . . . 0.0 110.95 179.834 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 5.0 p90 -149.99 158.08 43.8 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 108.522 -0.918 . . . . 0.0 108.522 178.07 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 17.8 p-10 -95.6 145.92 24.87 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 120.185 -0.606 . . . . 0.0 110.746 -179.126 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -178.94 177.08 0.86 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.99 -0.55 . . . . 0.0 109.81 179.52 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 37.3 t0 -96.39 133.27 41.01 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 120.763 -0.375 . . . . 0.0 110.783 -179.679 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.56 ' O ' ' O ' ' A' ' 31' ' ' VAL . 2.9 p -132.97 150.61 52.15 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.371 0.605 . . . . 0.0 110.106 178.734 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 28.9 mm-40 -129.44 135.74 49.05 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.453 -0.794 . . . . 0.0 108.962 179.82 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -117.59 136.13 55.76 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.438 0 C-N-CA 120.227 -0.589 . . . . 0.0 110.376 -179.66 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.434 ' CD2' HH12 ' A' ' 60' ' ' ARG . 0.1 OUTLIER -125.38 123.2 38.81 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.518 -0.764 . . . . 0.0 111.08 -179.167 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.527 ' OE1' ' CZ ' ' A' ' 57' ' ' PHE . 20.1 tt0 -130.05 102.71 6.38 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.382 -0.826 . . . . 0.0 109.493 178.419 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 78.31 -127.93 8.44 Favored Glycine 0 CA--C 1.522 0.476 0 N-CA-C 109.672 -1.371 . . . . 0.0 109.672 -178.69 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.47 ' OE1' ' O ' ' A' ' 26' ' ' GLU . 2.5 pp20? -99.77 11.25 39.72 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.627 0.251 . . . . 0.0 110.387 179.468 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.525 ' HB3' ' CZ2' ' A' ' 29' ' ' TRP . 2.5 mpt_? -110.89 132.08 54.51 Favored 'General case' 0 CA--C 1.522 -0.134 0 CA-C-O 121.032 0.444 . . . . 0.0 111.872 -179.536 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.597 ' NH2' ' NH2' ' A' ' 60' ' ' ARG . 5.9 ttt180 -126.88 146.49 50.27 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.767 -0.651 . . . . 0.0 109.776 179.227 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.553 ' NE1' ' O ' ' A' ' 48' ' ' ASP . 6.5 m-90 -144.63 155.1 43.45 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.464 -179.097 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -100.24 128.62 46.27 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.785 -0.643 . . . . 0.0 109.934 179.734 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.56 ' O ' ' O ' ' A' ' 20' ' ' SER . 35.3 m -140.83 155.83 22.36 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-O 121.109 0.481 . . . . 0.0 111.202 -179.703 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.41 HD12 ' HE2' ' A' ' 34' ' ' HIS . 0.3 OUTLIER -94.03 131.34 39.62 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 108.553 -0.906 . . . . 0.0 108.553 178.375 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.5 tt -89.91 127.22 35.97 Favored 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 120.298 -0.561 . . . . 0.0 109.852 -179.735 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' HIS . . . . . 0.41 ' HE2' HD12 ' A' ' 32' ' ' LEU . 74.0 m-70 -92.45 -27.32 17.54 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.501 -0.772 . . . . 0.0 111.581 -178.634 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 -175.16 162.32 2.99 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 119.693 -0.803 . . . . 0.0 111.536 177.599 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 4.5 p -145.29 168.55 8.4 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.179 0 CA-C-N 115.503 -0.771 . . . . 0.0 111.094 -179.182 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' SER . . . . . 0.474 ' CB ' HN22 ' A' ' 501' ' ' C2E . 20.1 t -142.08 169.71 17.07 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 107.738 -1.208 . . . . 0.0 107.738 178.474 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.417 ' H ' HD22 ' A' ' 38' ' ' LEU . 0.3 OUTLIER -66.31 -0.72 2.78 Favored 'General case' 0 C--N 1.322 -0.598 0 C-N-CA 119.552 -0.859 . . . . 0.0 110.874 -179.256 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . 0.5 ' CE1' ' O ' ' A' ' 87' ' ' CYS . 47.6 t60 -158.9 38.16 0.22 Allowed 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 120.639 -0.424 . . . . 0.0 111.566 -179.828 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . 0.523 ' HA3' ' N3 ' ' A' ' 501' ' ' C2E . . . -177.46 158.16 23.33 Favored Glycine 0 CA--C 1.528 0.906 0 C-N-CA 120.606 -0.807 . . . . 0.0 111.422 179.871 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -148.49 148.95 15.56 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.374 0 CA-C-O 121.421 0.629 . . . . 0.0 111.768 -178.736 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.443 HD21 ' N ' ' A' ' 43' ' ' VAL . 0.6 OUTLIER -122.39 138.5 54.51 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 115.01 -0.996 . . . . 0.0 108.947 178.96 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.443 ' N ' HD21 ' A' ' 42' ' ' LEU . 23.6 m -142.83 174.58 5.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-O 121.16 0.505 . . . . 0.0 111.491 -179.695 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -95.13 144.9 17.47 Favored Glycine 0 CA--C 1.529 0.923 0 N-CA-C 109.528 -1.429 . . . . 0.0 109.528 178.285 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . 0.557 ' NE2' ' O ' ' A' ' 46' ' ' PRO . 18.0 tm0? -87.58 115.5 63.07 Favored Pre-proline 0 N--CA 1.464 0.264 0 CA-C-N 118.121 0.96 . . . . 0.0 112.099 -178.523 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.557 ' O ' ' NE2' ' A' ' 45' ' ' GLN . 96.1 Cg_endo -85.97 161.96 10.31 Favored 'Trans proline' 0 C--N 1.308 -1.588 0 C-N-CA 121.562 1.508 . . . . 0.0 111.213 178.587 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.2 mt-30 -65.14 -40.36 94.29 Favored 'General case' 0 N--CA 1.466 0.37 0 N-CA-C 112.585 0.587 . . . . 0.0 112.585 -178.709 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . 0.572 ' O ' ' N ' ' A' ' 50' ' ' ASN . 6.4 m-20 -72.89 8.88 1.33 Allowed 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 112.035 0.383 . . . . 0.0 112.035 -178.479 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' TRP . . . . . 0.46 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 64.5 t-105 -58.97 69.06 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.729 -0.214 . . . . 0.0 111.531 -179.878 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . 0.572 ' N ' ' O ' ' A' ' 48' ' ' ASP . 0.1 OUTLIER -93.25 78.55 4.5 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 120.201 -0.6 . . . . 0.0 109.531 178.812 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . 0.412 ' CA ' HE21 ' A' ' 24' ' ' GLN . . . -142.54 160.16 27.3 Favored Glycine 0 CA--C 1.52 0.401 0 N-CA-C 111.295 -0.722 . . . . 0.0 111.295 -179.557 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -95.02 121.97 61.21 Favored Pre-proline 0 C--N 1.325 -0.465 0 CA-C-N 115.367 -0.416 . . . . 0.0 110.662 -179.637 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 17.4 Cg_endo -60.15 -22.48 70.17 Favored 'Trans proline' 0 N--CA 1.494 1.519 0 C-N-CA 122.259 1.973 . . . . 0.0 111.564 -179.742 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 6.4 mm-40 -77.73 -21.68 51.52 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.472 179.927 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.511 ' O ' ' CE1' ' A' ' 57' ' ' PHE . 72.2 mtt-85 -97.65 149.86 36.17 Favored Pre-proline 0 CA--C 1.53 0.208 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.108 179.74 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . 0.411 ' O ' ' OE1' ' A' ' 24' ' ' GLN . 37.5 Cg_endo -65.56 160.93 40.74 Favored 'Trans proline' 0 N--CA 1.497 1.683 0 C-N-CA 123.116 2.544 . . . . 0.0 113.476 -179.093 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . 0.527 ' CZ ' ' OE1' ' A' ' 24' ' ' GLN . 26.9 m-85 -129.58 156.61 43.91 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 114.905 -1.043 . . . . 0.0 108.599 179.076 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 58.6 mt-10 -122.54 139.67 53.63 Favored 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 109.238 -0.652 . . . . 0.0 109.238 178.604 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -121.06 137.4 54.67 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.117 0.484 . . . . 0.0 111.74 -178.223 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.597 ' NH2' ' NH2' ' A' ' 28' ' ' ARG . 51.9 mtm-85 -123.19 127.84 49.2 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 177.524 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -107.9 151.1 26.23 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 120.493 -0.483 . . . . 0.0 111.066 -178.614 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 28.9 m-85 -134.0 109.67 9.15 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.17 179.527 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.443 ' HB3' ' H ' ' A' ' 64' ' ' GLY . 1.6 tt -104.63 -82.7 0.51 Allowed 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 115.838 -0.619 . . . . 0.0 109.398 179.529 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . 0.443 ' H ' ' HB3' ' A' ' 63' ' ' LEU . . . -77.76 179.27 51.3 Favored Glycine 0 CA--C 1.523 0.533 0 N-CA-C 109.416 -1.474 . . . . 0.0 109.416 178.568 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.561 ' CD2' ' N ' ' A' ' 65' ' ' LEU . 1.9 mm? -73.78 -31.89 63.52 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 119.925 -0.71 . . . . 0.0 110.129 -179.752 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.9 p30 -103.44 9.22 37.83 Favored 'General case' 0 C--N 1.332 -0.17 0 C-N-CA 122.775 0.43 . . . . 0.0 111.198 -179.927 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 8.7 t -105.07 96.37 4.54 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.37 0 CA-C-O 121.2 0.524 . . . . 0.0 111.807 -178.78 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 1.8 tp -114.37 118.48 33.98 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 178.678 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 2.9 mt -113.9 145.0 20.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.339 -0.392 . . . . 0.0 111.353 -178.791 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 8.4 ptm180 -128.41 131.06 48.48 Favored 'General case' 0 C--O 1.24 0.562 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.078 179.033 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -139.59 147.98 41.88 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.607 -0.724 . . . . 0.0 109.953 179.451 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -112.57 118.46 35.16 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 107.661 -1.237 . . . . 0.0 107.661 178.077 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.449 ' O ' ' O ' ' A' ' 57' ' ' PHE . 3.3 pt -129.32 168.02 23.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 N-CA-C 113.466 0.913 . . . . 0.0 113.466 -176.146 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 58.7 m -121.94 150.74 41.58 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 114.961 -1.018 . . . . 0.0 109.807 178.837 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.426 ' CD1' ' CE1' ' A' ' 85' ' ' PHE . 14.3 tp -66.6 123.58 20.47 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 121.268 0.556 . . . . 0.0 110.175 -179.837 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -98.15 -45.1 6.34 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 115.448 -0.796 . . . . 0.0 111.306 178.533 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' TRP . . . . . 0.491 ' CE2' ' HA3' ' A' ' 84' ' ' GLY . 66.5 p-90 -167.82 167.41 13.05 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.224 -178.965 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -146.4 123.85 11.7 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 109.824 -0.435 . . . . 0.0 109.824 178.622 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 41.4 ttt180 -152.11 133.54 14.54 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 119.917 -0.713 . . . . 0.0 112.804 179.843 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 56.77 46.91 19.1 Favored 'General case' 0 N--CA 1.464 0.233 0 N-CA-C 114.034 1.124 . . . . 0.0 114.034 176.763 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 83.16 -26.82 4.21 Favored Glycine 0 CA--C 1.523 0.569 0 C-N-CA 120.417 -0.897 . . . . 0.0 113.01 177.166 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 4.7 mt -89.56 153.34 20.85 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 117.528 0.664 . . . . 0.0 110.514 -179.06 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 79.4 mt -126.88 135.62 51.21 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.995 -179.256 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . 0.491 ' HA3' ' CE2' ' A' ' 77' ' ' TRP . . . -106.07 149.14 16.61 Favored Glycine 0 N--CA 1.454 -0.123 0 N-CA-C 109.75 -1.34 . . . . 0.0 109.75 178.906 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . 0.426 ' CE1' ' CD1' ' A' ' 75' ' ' LEU . 78.7 m-85 -142.05 142.93 32.89 Favored 'General case' 0 C--N 1.32 -0.697 0 C-N-CA 120.824 -0.35 . . . . 0.0 110.626 -179.748 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 23.9 tt0 -103.73 128.59 51.08 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 179.246 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . 0.5 ' O ' ' CE1' ' A' ' 39' ' ' HIS . 14.7 t -68.43 120.85 15.17 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.087 0.47 . . . . 0.0 111.84 -178.463 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -95.52 -36.98 11.08 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.366 179.561 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . 0.569 ' ND1' ' N ' ' A' ' 90' ' ' ILE . 0.0 OUTLIER -161.74 141.92 10.43 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.185 179.981 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . 0.569 ' N ' ' ND1' ' A' ' 89' ' ' HIS . 6.3 tt -145.22 140.87 22.74 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-O 121.239 0.543 . . . . 0.0 110.058 -179.251 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -55.44 143.62 28.41 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-N 115.244 -0.889 . . . . 0.0 112.109 -178.325 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 3.8 tt -54.49 -42.07 70.31 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.166 -0.925 . . . . 0.0 109.956 -179.686 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -68.89 -38.7 79.8 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.604 -0.517 . . . . 0.0 109.604 179.206 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 7.4 m -64.75 -36.2 83.52 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.779 -0.646 . . . . 0.0 109.59 179.14 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 24.1 mt -59.0 -38.36 73.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.648 -0.705 . . . . 0.0 109.998 179.677 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -71.25 -42.29 69.0 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 120.312 -0.555 . . . . 0.0 111.283 -179.189 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' HIS . . . . . 0.444 ' O ' ' HB2' ' A' ' 100' ' ' ARG . 62.0 m-70 -61.94 -38.41 88.35 Favored 'General case' 0 C--N 1.325 -0.486 0 C-N-CA 119.638 -0.825 . . . . 0.0 109.49 -179.757 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.42 -34.18 76.71 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 178.139 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 48.1 mtt-85 -65.36 -38.06 88.93 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 108.362 -0.977 . . . . 0.0 108.362 177.719 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . 0.444 ' HB2' ' O ' ' A' ' 97' ' ' HIS . 1.6 mtp180 -61.44 -45.96 92.08 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 115.102 -0.954 . . . . 0.0 110.659 178.06 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -59.08 -37.9 78.19 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 -179.503 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 70.0 t -68.6 -47.79 75.13 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 115.648 -0.706 . . . . 0.0 111.278 -179.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -65.67 -42.12 91.7 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.757 -179.079 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.455 ' CD2' ' N ' ' A' ' 104' ' ' LEU . 2.4 mm? -73.37 -40.31 64.46 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.611 -0.268 . . . . 0.0 111.179 -179.534 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . 0.434 ' OD1' ' CG2' ' A' ' 14' ' ' ILE . 2.2 m120 -69.02 -47.72 64.75 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 120.844 -0.342 . . . . 0.0 110.599 -179.866 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 8.5 tp -55.96 -30.64 62.03 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.491 -179.895 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 125.89 134.33 4.07 Favored Glycine 0 CA--C 1.524 0.627 0 N-CA-C 110.786 -0.926 . . . . 0.0 110.786 179.903 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -71.82 -13.07 61.58 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.871 0.367 . . . . 0.0 110.274 179.812 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . 0.512 ' N ' ' OE1' ' A' ' 109' ' ' GLU . 30.6 mp0 -93.95 10.31 33.94 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.699 -179.849 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 80.7 mm-40 -140.6 67.75 1.36 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.624 179.915 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . 0.606 ' H ' ' CD2' ' A' ' 111' ' ' LEU . 0.4 OUTLIER -84.5 -12.97 53.24 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.268 179.753 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 1.5 mt -52.67 98.16 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.579 -179.852 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . 0.532 ' CD ' ' N ' ' A' ' 113' ' ' GLU . 0.1 OUTLIER -68.74 171.54 7.65 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.384 179.706 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . 0.502 ' C ' ' H ' ' A' ' 116' ' ' LEU . 0.1 OUTLIER 83.58 -174.56 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.456 179.957 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . 0.487 ' H ' ' HG3' ' A' ' 114' ' ' ARG . 7.7 pt-20 -54.38 -7.44 0.15 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.852 -179.834 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.502 ' H ' ' C ' ' A' ' 114' ' ' ARG . 8.0 mp -65.14 -49.43 69.95 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.119 0.485 . . . . 0.0 110.464 -179.886 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -62.0 -50.43 72.09 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.456 -0.793 . . . . 0.0 112.897 -178.9 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . 0.481 ' O ' ' OG ' ' A' ' 121' ' ' SER . 2.4 mt -57.0 -48.62 78.03 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.033 -0.531 . . . . 0.0 112.149 -177.464 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 17.6 mt -73.6 -50.47 20.99 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 119.716 -0.794 . . . . 0.0 110.401 179.615 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 55.0 t -66.57 -13.91 16.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 N-CA-C 112.644 0.609 . . . . 0.0 112.644 -178.325 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 121' ' ' SER . . . . . 0.481 ' OG ' ' O ' ' A' ' 118' ' ' LEU . 7.3 p -64.81 -39.81 94.2 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 120.167 -0.613 . . . . 0.0 111.276 -178.389 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -165.71 159.82 16.68 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.388 -0.525 . . . . 0.0 111.257 179.729 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . 0.879 ' CG ' ' H ' ' A' ' 124' ' ' ASP . 12.2 p80 -171.2 -72.15 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.392 -179.726 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . 0.879 ' H ' ' CG ' ' A' ' 123' ' ' HIS . 31.4 t0 -116.38 45.99 1.68 Allowed 'General case' 0 C--N 1.334 -0.099 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.668 -179.61 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 125' ' ' ASP . . . . . 0.466 ' CB ' ' O ' ' A' ' 124' ' ' ASP . 0.5 OUTLIER . . . . . 0 C--O 1.22 -0.453 0 CA-C-O 117.945 -1.026 . . . . 0.0 110.071 -179.879 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 501' ' ' C2E . . . . . 0.909 ' O21' " H4'" ' A' ' 501' ' ' C2E . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 502' ' ' C2E . . . . . 0.661 ' C61' ' HE ' ' A' ' 9' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.678 ' N ' ' NE2' ' A' ' 5' ' ' HIS . 4.4 ptt? . . . . . 0 N--CA 1.491 1.578 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.637 ' CB ' ' O ' ' A' ' 1' ' ' MET . 16.5 m 112.28 -166.73 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.665 0 O-C-N 123.806 0.691 . . . . 0.0 110.683 179.922 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 11.1 p-10 -99.54 42.09 1.12 Allowed 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.125 178.811 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 7.4 tp60 -115.25 14.36 16.87 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.241 177.841 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . 0.678 ' NE2' ' N ' ' A' ' 1' ' ' MET . 2.7 m170 -92.19 -4.3 54.37 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.801 179.946 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -47.88 152.45 0.76 Allowed 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 179.864 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -91.27 132.44 36.13 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 120.173 -0.611 . . . . 0.0 111.384 -179.277 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.69 HH21 ' C21' ' A' ' 501' ' ' C2E . 0.0 OUTLIER -121.52 -5.89 9.25 Favored 'General case' 0 CA--C 1.529 0.137 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.968 -179.573 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.554 ' O ' ' C ' ' A' ' 10' ' ' ARG . 1.6 ptt85 -105.56 133.94 49.48 Favored 'General case' 0 N--CA 1.465 0.289 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 179.136 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.554 ' C ' ' O ' ' A' ' 9' ' ' ARG . 0.4 OUTLIER -22.67 -67.66 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.607 -179.516 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . 0.41 ' O ' ' O ' ' A' ' 12' ' ' HIS . 7.2 p90 -151.03 158.83 44.61 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.823 0.344 . . . . 0.0 110.698 179.076 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . 0.413 ' HE2' ' CD ' ' A' ' 115' ' ' GLU . 0.0 OUTLIER -43.35 167.59 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.294 179.635 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.414 ' HG2' ' HG ' ' A' ' 37' ' ' SER . 0.2 OUTLIER -117.93 166.34 12.62 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 120.9 0.381 . . . . 0.0 110.799 -179.99 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 39.5 mm -71.09 97.51 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.02 179.424 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -95.07 120.04 34.6 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.513 0.673 . . . . 0.0 111.649 -179.351 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 2.2 p90 -149.99 158.05 43.77 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 108.146 -1.057 . . . . 0.0 108.146 177.659 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . 0.482 ' OD1' ' N ' ' A' ' 18' ' ' ALA . 23.7 t0 -95.62 146.18 24.68 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 120.049 -0.661 . . . . 0.0 111.085 -178.822 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.482 ' N ' ' OD1' ' A' ' 17' ' ' ASP . . . -179.16 175.79 0.93 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.06 179.392 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -96.17 134.11 39.65 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.688 -179.676 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.639 ' O ' ' O ' ' A' ' 31' ' ' VAL . 5.8 p -135.47 157.21 47.46 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.142 179.044 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.485 ' HB3' ' NH1' ' A' ' 28' ' ' ARG . 50.2 mt-10 -142.04 145.56 34.52 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 179.168 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 28.1 mt -123.01 136.39 59.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-O 121.168 0.508 . . . . 0.0 111.787 -178.235 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -119.58 123.38 43.79 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.562 -0.744 . . . . 0.0 110.603 179.919 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.425 ' O ' ' OE1' ' A' ' 24' ' ' GLN . 1.5 tm0? -130.51 101.91 5.92 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.404 -0.817 . . . . 0.0 109.671 178.929 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 80.33 -126.79 7.59 Favored Glycine 0 CA--C 1.524 0.624 0 N-CA-C 109.949 -1.26 . . . . 0.0 109.949 -178.715 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.3 pt-20 -100.66 11.96 38.42 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.872 0.367 . . . . 0.0 110.047 179.57 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.492 ' HB3' ' CZ2' ' A' ' 29' ' ' TRP . 38.4 mtt-85 -114.58 136.0 53.52 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 112.771 0.656 . . . . 0.0 112.771 -178.036 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.76 ' CG ' HH11 ' A' ' 28' ' ' ARG . 0.0 OUTLIER -128.11 149.64 50.32 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.261 179.1 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.539 ' NE1' ' O ' ' A' ' 48' ' ' ASP . 6.7 m-90 -146.74 155.03 42.08 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.454 -0.794 . . . . 0.0 110.297 -179.477 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 11.9 mt-10 -100.33 136.61 39.95 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.042 -0.526 . . . . 0.0 109.912 179.502 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.639 ' O ' ' O ' ' A' ' 20' ' ' SER . 17.1 m -147.38 156.93 9.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-O 121.25 0.547 . . . . 0.0 111.167 -179.552 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.678 ' H ' ' CD2' ' A' ' 32' ' ' LEU . 1.4 pt? -95.88 130.29 42.88 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 108.817 -0.808 . . . . 0.0 108.817 178.498 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.6 tt -91.7 126.0 36.63 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.267 0.556 . . . . 0.0 110.092 -179.527 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 74.5 m-70 -91.95 -27.45 17.87 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.276 -0.875 . . . . 0.0 111.803 -178.531 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -173.7 161.14 3.85 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 119.574 -0.85 . . . . 0.0 111.317 177.576 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 5.6 p -144.57 168.84 9.51 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.118 0 CA-C-N 115.584 -0.735 . . . . 0.0 111.067 -179.09 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' SER . . . . . 0.444 ' OG ' ' N2 ' ' A' ' 501' ' ' C2E . 10.8 m -142.28 169.65 17.19 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 107.982 -1.118 . . . . 0.0 107.982 178.518 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.426 HD13 ' H ' ' A' ' 38' ' ' LEU . 2.0 mp -65.57 -1.21 2.45 Favored 'General case' 0 C--N 1.324 -0.517 0 C-N-CA 119.583 -0.847 . . . . 0.0 110.305 -179.803 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . 0.532 ' NE2' ' NH1' ' A' ' 10' ' ' ARG . 47.7 p-80 -163.11 41.25 0.1 Allowed 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 120.748 -0.381 . . . . 0.0 111.469 179.813 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -176.07 152.24 12.66 Favored Glycine 0 CA--C 1.525 0.661 0 N-CA-C 110.997 -0.841 . . . . 0.0 110.997 179.835 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -147.31 148.67 16.31 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.208 0 CA-C-O 121.495 0.664 . . . . 0.0 111.647 -179.135 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -121.76 140.33 52.47 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 114.836 -1.075 . . . . 0.0 108.719 178.977 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.2 m -144.11 175.13 3.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-O 121.328 0.585 . . . . 0.0 111.752 -179.441 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -97.15 144.57 17.41 Favored Glycine 0 CA--C 1.529 0.938 0 N-CA-C 109.247 -1.541 . . . . 0.0 109.247 178.01 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . 0.523 HE21 ' C ' ' A' ' 45' ' ' GLN . 0.0 OUTLIER -87.42 115.6 63.33 Favored Pre-proline 0 N--CA 1.464 0.274 0 CA-C-N 118.127 0.963 . . . . 0.0 111.75 -178.431 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 79.4 Cg_endo -86.07 162.22 10.16 Favored 'Trans proline' 0 C--N 1.307 -1.65 0 C-N-CA 121.765 1.643 . . . . 0.0 111.462 178.931 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.498 ' OE1' ' N ' ' A' ' 47' ' ' GLN . 25.9 mp0 -65.28 -40.24 93.64 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 112.153 0.427 . . . . 0.0 112.153 -179.0 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . 0.539 ' O ' ' NE1' ' A' ' 29' ' ' TRP . 16.4 m-20 -72.56 8.41 1.44 Allowed 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.05 0.389 . . . . 0.0 112.05 -178.538 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' TRP . . . . . 0.448 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 60.7 t-105 -61.45 68.43 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 111.696 0.258 . . . . 0.0 111.696 -179.657 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . 0.52 ' N ' ' O ' ' A' ' 48' ' ' ASP . 0.5 OUTLIER -93.28 78.98 4.47 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 120.023 -0.671 . . . . 0.0 109.682 178.688 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -141.77 158.22 26.57 Favored Glycine 0 CA--C 1.525 0.696 0 N-CA-C 111.369 -0.692 . . . . 0.0 111.369 -179.501 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 33.7 t0 -93.99 111.49 53.26 Favored Pre-proline 0 CA--C 1.533 0.311 0 CA-C-N 115.744 -0.228 . . . . 0.0 110.774 -179.89 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 76.7 Cg_exo -47.24 -22.28 2.31 Favored 'Trans proline' 0 N--CA 1.496 1.63 0 C-N-CA 122.597 2.198 . . . . 0.0 112.413 179.858 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 37.3 mt-30 -79.13 -24.01 43.64 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.82 -178.581 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.55 ' O ' ' CE1' ' A' ' 57' ' ' PHE . 3.0 mpt_? -94.82 151.4 38.99 Favored Pre-proline 0 C--N 1.33 -0.257 0 C-N-CA 120.581 -0.448 . . . . 0.0 109.962 179.69 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 35.3 Cg_endo -64.3 160.86 36.83 Favored 'Trans proline' 0 N--CA 1.495 1.6 0 C-N-CA 122.816 2.344 . . . . 0.0 113.285 -178.77 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . 0.55 ' CE1' ' O ' ' A' ' 55' ' ' ARG . 44.5 m-85 -130.5 155.68 46.06 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 114.991 -1.004 . . . . 0.0 109.005 179.419 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -121.61 134.46 55.0 Favored 'General case' 0 C--O 1.22 -0.452 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 178.728 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -115.86 135.66 53.79 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.113 0.483 . . . . 0.0 112.108 -178.454 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.426 ' N ' ' HD3' ' A' ' 60' ' ' ARG . 2.4 mpt_? -121.35 127.72 51.54 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 177.361 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 10.6 mt -108.93 137.15 47.3 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.914 0.387 . . . . 0.0 110.636 -179.061 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' TYR . . . . . 0.613 ' CD1' ' N ' ' A' ' 62' ' ' TYR . 1.0 OUTLIER -120.34 110.21 16.28 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.348 179.785 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.417 ' C ' ' CD2' ' A' ' 63' ' ' LEU . 2.2 tt -104.54 -84.55 0.48 Allowed 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.413 179.401 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -76.52 -176.89 43.17 Favored Glycine 0 CA--C 1.521 0.455 0 N-CA-C 109.503 -1.439 . . . . 0.0 109.503 178.62 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 3.2 mt -76.11 -32.22 59.07 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.015 -0.674 . . . . 0.0 110.319 -179.703 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.446 ' N ' ' OD1' ' A' ' 66' ' ' ASP . 1.3 m-20 -104.06 8.8 36.58 Favored 'General case' 0 C--N 1.332 -0.191 0 C-N-CA 122.759 0.424 . . . . 0.0 111.105 -179.913 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 9.3 t -103.34 95.05 3.54 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.296 0 CA-C-O 121.529 0.681 . . . . 0.0 111.8 -178.759 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -112.15 117.74 33.43 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 114.753 -1.112 . . . . 0.0 108.259 178.208 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 6.0 mt -113.9 143.62 23.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.887 0.375 . . . . 0.0 110.562 -179.043 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 11.6 mtm180 -128.26 131.26 48.76 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.914 179.191 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 2.2 mtp -140.39 148.88 41.92 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.917 -0.583 . . . . 0.0 109.945 179.651 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 12.0 tm-20 -102.39 134.71 45.26 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 107.48 -1.304 . . . . 0.0 107.48 178.247 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.413 HD12 ' CG ' ' A' ' 85' ' ' PHE . 5.3 pt -143.97 157.46 15.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 N-CA-C 113.472 0.916 . . . . 0.0 113.472 -177.352 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -121.18 150.17 41.71 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 114.759 -1.109 . . . . 0.0 109.444 178.604 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.48 ' CD1' ' CZ ' ' A' ' 85' ' ' PHE . 8.7 tp -66.71 123.76 21.01 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.265 0.555 . . . . 0.0 110.242 -179.638 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -98.0 -43.99 6.84 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 115.05 -0.977 . . . . 0.0 111.011 178.138 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' TRP . . . . . 0.563 ' NE1' ' HA3' ' A' ' 84' ' ' GLY . 68.0 p-90 -168.63 168.06 11.06 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.047 -179.13 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -146.45 123.72 11.57 Favored 'General case' 0 N--CA 1.464 0.257 0 N-CA-C 109.804 -0.443 . . . . 0.0 109.804 178.291 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . 0.408 ' NH1' " O2'" ' A' ' 502' ' ' C2E . 6.7 ttt-85 -152.26 133.93 14.69 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 119.922 -0.711 . . . . 0.0 112.906 179.979 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 56.64 47.16 18.95 Favored 'General case' 0 N--CA 1.465 0.285 0 N-CA-C 113.649 0.981 . . . . 0.0 113.649 176.752 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 81.78 -26.49 3.66 Favored Glycine 0 CA--C 1.522 0.529 0 C-N-CA 120.506 -0.854 . . . . 0.0 113.104 177.386 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 4.7 mt -89.6 153.79 20.48 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 117.685 0.742 . . . . 0.0 110.447 -179.289 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 43.5 mt -126.27 135.5 51.62 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.981 -179.395 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . 0.563 ' HA3' ' NE1' ' A' ' 77' ' ' TRP . . . -98.83 152.61 19.72 Favored Glycine 0 N--CA 1.451 -0.31 0 N-CA-C 109.949 -1.26 . . . . 0.0 109.949 178.963 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . 0.48 ' CZ ' ' CD1' ' A' ' 75' ' ' LEU . 40.7 m-85 -145.51 136.69 24.85 Favored 'General case' 0 C--N 1.319 -0.753 0 C-N-CA 120.673 -0.411 . . . . 0.0 111.017 -179.227 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.458 ' O ' ' NE2' ' A' ' 88' ' ' GLN . 31.5 tt0 -103.66 127.61 51.08 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 179.231 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 3.7 t -73.76 124.81 26.76 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.062 0.458 . . . . 0.0 112.042 -178.445 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . 0.458 ' NE2' ' O ' ' A' ' 86' ' ' GLU . 39.1 mm-40 -99.41 -32.12 11.31 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.692 -0.685 . . . . 0.0 110.228 179.277 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . 0.57 ' ND1' ' C ' ' A' ' 89' ' ' HIS . 0.0 OUTLIER -161.75 141.8 10.35 Favored 'General case' 0 C--O 1.225 -0.222 0 CA-C-O 121.033 0.444 . . . . 0.0 110.151 179.433 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 5.7 tt -145.66 141.29 22.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-O 121.436 0.636 . . . . 0.0 110.151 -179.577 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . 0.509 ' N ' ' OD1' ' A' ' 91' ' ' ASP . 0.0 OUTLIER -54.07 140.28 32.27 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 114.873 -1.058 . . . . 0.0 112.125 -178.39 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 16.6 tp -54.18 -41.87 69.04 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.043 -0.98 . . . . 0.0 110.01 -179.78 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -69.67 -40.2 76.55 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 179.252 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' SER . . . . . 0.455 ' OG ' ' OD2' ' A' ' 91' ' ' ASP . 4.0 m -64.48 -35.87 82.35 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.956 179.459 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 30.4 mt -58.51 -37.41 64.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 115.888 -0.597 . . . . 0.0 109.786 179.487 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -70.74 -41.86 71.27 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.148 -179.121 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 64.3 m-70 -61.75 -36.3 80.61 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 119.41 -0.916 . . . . 0.0 109.365 179.941 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 5.4 mp -67.57 -33.72 75.59 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 177.763 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 2.4 mtp180 -64.29 -36.76 85.16 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 178.324 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 20.7 mtt-85 -60.36 -45.85 92.02 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.962 179.043 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.465 ' O ' ' ND2' ' A' ' 105' ' ' ASN . 2.8 mt -63.04 -34.94 78.66 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 -179.822 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 79.1 t -68.4 -42.38 84.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.604 179.658 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 73.9 mt-10 -65.17 -44.92 86.96 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.771 -179.227 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 30.2 mt -70.43 -43.13 70.57 Favored 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 120.546 -0.462 . . . . 0.0 111.522 -178.718 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . 0.465 ' ND2' ' O ' ' A' ' 101' ' ' LEU . 1.9 m-80 -68.28 -25.84 65.36 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 120.705 -0.398 . . . . 0.0 110.895 -179.438 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 13.1 tp -55.9 -29.42 60.01 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.927 0.394 . . . . 0.0 110.201 179.802 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 104.33 149.68 20.09 Favored Glycine 0 CA--C 1.524 0.602 0 N-CA-C 110.913 -0.875 . . . . 0.0 110.913 179.979 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 88.5 m-20 -77.38 -42.4 36.56 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.814 0.34 . . . . 0.0 110.552 -179.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -48.68 130.0 17.07 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.398 -179.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 69.4 mm-40 -88.68 80.62 7.22 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.71 179.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 8.0 mt -58.95 134.43 56.94 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.547 179.987 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -55.92 -23.12 29.71 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.358 179.827 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -135.02 174.17 10.91 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.229 -179.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . 0.456 ' C ' ' H ' ' A' ' 116' ' ' LEU . 10.0 ptm180 -177.75 172.85 1.67 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.721 -179.902 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . 0.413 ' CD ' ' HE2' ' A' ' 12' ' ' HIS . 56.9 mt-10 -73.89 41.04 0.12 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.956 -179.656 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.456 ' H ' ' C ' ' A' ' 114' ' ' ARG . 1.4 mt -67.68 -40.49 84.42 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 112.483 0.549 . . . . 0.0 112.483 -179.015 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 117' ' ' ALA . . . . . 0.45 ' O ' ' CG2' ' A' ' 120' ' ' VAL . . . -70.78 -26.51 63.37 Favored 'General case' 0 N--CA 1.463 0.217 0 N-CA-C 112.218 0.451 . . . . 0.0 112.218 179.803 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . 0.408 ' C ' ' N ' ' A' ' 120' ' ' VAL . 6.8 mt -56.36 -36.58 68.96 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 120.607 -0.437 . . . . 0.0 111.651 -177.59 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . 0.428 ' O ' ' O ' ' A' ' 122' ' ' ALA . 12.7 mt -55.52 -10.84 0.72 Allowed 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 119.965 -0.694 . . . . 0.0 110.153 -178.147 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . 0.45 ' CG2' ' O ' ' A' ' 117' ' ' ALA . 21.0 t -56.52 -14.27 1.85 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.422 179.977 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 4.9 p -78.52 -32.25 47.93 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.516 179.961 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . 0.428 ' O ' ' O ' ' A' ' 119' ' ' LEU . . . -163.94 158.34 19.62 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.368 -179.9 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . 0.741 ' CG ' ' H ' ' A' ' 124' ' ' ASP . 19.5 p80 -116.78 -61.93 1.65 Allowed 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.729 179.967 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . 0.741 ' H ' ' CG ' ' A' ' 123' ' ' HIS . 3.8 m-20 61.17 18.02 8.69 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.919 0.39 . . . . 0.0 110.281 -179.741 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 125' ' ' ASP . . . . . 0.416 ' OD1' ' O ' ' A' ' 125' ' ' ASP . 49.9 t0 . . . . . 0 C--O 1.22 -0.49 0 CA-C-O 118.036 -0.983 . . . . 0.0 110.557 179.962 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 501' ' ' C2E . . . . . 0.69 ' C21' HH21 ' A' ' 8' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 502' ' ' C2E . . . . . 0.505 ' C4 ' ' CE2' ' A' ' 77' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.472 ' O ' ' OG ' ' A' ' 2' ' ' SER . 15.2 ttt . . . . . 0 N--CA 1.49 1.534 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.472 ' OG ' ' O ' ' A' ' 1' ' ' MET . 3.6 m -169.85 19.21 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.716 179.806 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 95.1 m-20 -98.22 109.52 22.26 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 179.26 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . 0.67 ' H ' ' NE2' ' A' ' 4' ' ' GLN . 0.0 OUTLIER -109.53 14.59 23.44 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.476 -0.784 . . . . 0.0 109.855 179.613 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . 0.65 ' CD2' ' O ' ' A' ' 4' ' ' GLN . 1.5 p-80 41.95 17.3 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.414 -179.215 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . 0.595 ' O ' ' CZ ' ' A' ' 8' ' ' ARG . 0.5 OUTLIER 39.82 83.43 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.467 179.745 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.496 ' CD ' ' O ' ' A' ' 7' ' ' GLU . 0.3 OUTLIER -88.65 128.64 35.6 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 120.306 -0.558 . . . . 0.0 110.5 -179.69 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.652 ' NH2' ' C21' ' A' ' 501' ' ' C2E . 0.0 OUTLIER -125.65 -8.26 6.8 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.235 -179.19 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.733 ' O ' ' N ' ' A' ' 11' ' ' PHE . 2.1 ptt85 -110.87 96.91 6.45 Favored 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 120.919 -0.312 . . . . 0.0 110.174 179.977 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.686 ' NH1' ' H ' ' A' ' 124' ' ' ASP . 0.0 OUTLIER 16.71 -74.01 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 115.171 -0.922 . . . . 0.0 111.19 -179.658 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . 0.733 ' N ' ' O ' ' A' ' 9' ' ' ARG . 0.1 OUTLIER -150.36 170.47 18.96 Favored 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 179.338 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . 0.441 ' CD2' ' N ' ' A' ' 12' ' ' HIS . 0.2 OUTLIER -43.23 161.19 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.867 0.365 . . . . 0.0 110.702 -179.826 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.433 ' O ' ' N ' ' A' ' 15' ' ' ALA . 21.2 mtm180 -111.57 147.82 34.6 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.185 -179.906 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.586 ' CD1' ' N ' ' A' ' 14' ' ' ILE . 1.3 mp -53.8 92.39 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 179.705 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.433 ' N ' ' O ' ' A' ' 13' ' ' ARG . . . -95.65 120.06 35.23 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.486 0.66 . . . . 0.0 112.134 -179.039 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 6.4 p90 -149.85 158.6 44.32 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 107.968 -1.123 . . . . 0.0 107.968 177.183 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -95.33 146.32 24.46 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 120.138 -0.625 . . . . 0.0 110.943 -178.809 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -178.92 176.37 0.92 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.863 179.427 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -96.62 133.82 40.63 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.831 -179.829 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.572 ' O ' ' O ' ' A' ' 31' ' ' VAL . 13.0 t -133.74 152.92 52.01 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 121.103 0.478 . . . . 0.0 110.255 178.617 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.446 ' OE1' ' OH ' ' A' ' 62' ' ' TYR . 91.0 mt-10 -132.32 151.8 51.68 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 179.497 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . 0.407 HG21 HD13 ' A' ' 22' ' ' ILE . 79.5 mt -132.71 136.38 55.92 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.468 0 C-N-CA 120.066 -0.654 . . . . 0.0 111.427 -179.568 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.444 ' CD1' ' NE ' ' A' ' 60' ' ' ARG . 0.2 OUTLIER -123.45 123.35 40.46 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.33 -0.85 . . . . 0.0 111.054 -179.398 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.548 ' OE1' ' CE2' ' A' ' 57' ' ' PHE . 18.8 tt0 -129.58 102.05 6.2 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.428 -0.805 . . . . 0.0 109.614 178.472 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 80.3 -127.22 7.82 Favored Glycine 0 CA--C 1.523 0.561 0 N-CA-C 109.847 -1.301 . . . . 0.0 109.847 -178.781 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.434 ' OE1' ' O ' ' A' ' 26' ' ' GLU . 2.9 pp20? -100.04 12.2 37.48 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.969 0.414 . . . . 0.0 110.095 179.434 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.491 ' HB3' ' CZ2' ' A' ' 29' ' ' TRP . 27.5 mtt-85 -113.77 135.25 54.16 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.883 -0.599 . . . . 0.0 112.605 -178.401 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.415 ' HG3' ' N ' ' A' ' 29' ' ' TRP . 11.1 ttt-85 -129.01 150.48 50.4 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.169 179.132 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.521 ' NE1' ' O ' ' A' ' 48' ' ' ASP . 6.7 m-90 -147.94 156.18 42.39 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.518 -179.365 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 12.4 mt-10 -99.9 138.09 37.45 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 178.978 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.572 ' O ' ' O ' ' A' ' 20' ' ' SER . 11.0 m -147.77 157.37 9.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-O 121.255 0.55 . . . . 0.0 111.214 -179.255 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.628 ' H ' ' CD2' ' A' ' 32' ' ' LEU . 0.6 OUTLIER -98.01 130.61 44.83 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 108.428 -0.953 . . . . 0.0 108.428 178.499 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.6 tt -94.35 125.05 38.75 Favored 'General case' 0 C--N 1.324 -0.524 0 C-N-CA 120.385 -0.526 . . . . 0.0 109.786 -179.679 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' HIS . . . . . 0.598 ' HE2' ' CD1' ' A' ' 32' ' ' LEU . 16.1 m-70 -90.7 -27.16 19.17 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.469 -0.787 . . . . 0.0 111.764 -178.341 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 -172.62 160.81 4.75 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 119.566 -0.854 . . . . 0.0 111.084 177.498 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 4.8 p -145.33 169.34 7.45 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.004 -178.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' SER . . . . . 0.522 ' CB ' HN22 ' A' ' 501' ' ' C2E . 24.9 t -141.64 167.84 21.19 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 107.883 -1.154 . . . . 0.0 107.883 178.262 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.543 ' H ' ' CD2' ' A' ' 38' ' ' LEU . 0.1 OUTLIER -64.77 -1.57 2.01 Favored 'General case' 0 C--N 1.321 -0.669 0 C-N-CA 119.95 -0.7 . . . . 0.0 110.562 -179.259 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . 0.553 ' NE2' ' O ' ' A' ' 87' ' ' CYS . 19.9 t60 -159.14 41.68 0.23 Allowed 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 120.786 -0.366 . . . . 0.0 111.397 -179.523 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . 0.411 ' HA3' ' N3 ' ' A' ' 501' ' ' C2E . . . 177.77 158.69 21.26 Favored Glycine 0 CA--C 1.527 0.798 0 N-CA-C 111.165 -0.774 . . . . 0.0 111.165 179.697 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -148.56 148.95 15.53 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.321 0 CA-C-O 121.342 0.591 . . . . 0.0 111.584 -178.856 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.6 tt -121.59 136.19 54.96 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 115.177 -0.92 . . . . 0.0 108.706 178.729 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 24.0 m -141.33 174.84 6.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-O 121.294 0.568 . . . . 0.0 111.964 -179.295 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -98.19 144.81 17.47 Favored Glycine 0 CA--C 1.529 0.912 0 N-CA-C 109.215 -1.554 . . . . 0.0 109.215 178.049 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . 0.578 ' CD ' ' O ' ' A' ' 45' ' ' GLN . 3.8 pp0? -88.03 116.72 67.05 Favored Pre-proline 0 CA--C 1.535 0.37 0 CA-C-N 118.078 0.939 . . . . 0.0 111.723 -178.349 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -84.82 162.57 12.09 Favored 'Trans proline' 0 C--N 1.305 -1.73 0 C-N-CA 121.384 1.389 . . . . 0.0 110.91 178.595 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 7.5 mp0 -64.52 -40.18 95.16 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.698 0.285 . . . . 0.0 111.539 -178.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . 0.521 ' O ' ' NE1' ' A' ' 29' ' ' TRP . 1.0 OUTLIER -70.45 8.64 0.77 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.821 -179.058 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' TRP . . . . . 0.461 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 60.7 t-105 -63.3 67.72 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 120.742 -0.383 . . . . 0.0 111.725 -179.39 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . 0.554 ' C ' HD21 ' A' ' 50' ' ' ASN . 0.5 OUTLIER -93.08 78.84 4.58 Favored 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 120.332 -0.547 . . . . 0.0 109.932 178.857 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -141.21 160.16 26.76 Favored Glycine 0 CA--C 1.525 0.696 0 N-CA-C 111.462 -0.655 . . . . 0.0 111.462 -179.528 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . 0.436 ' OD1' ' OE1' ' A' ' 54' ' ' GLN . 25.7 t0 -95.46 110.73 52.39 Favored Pre-proline 0 CA--C 1.533 0.326 0 CA-C-N 115.79 -0.205 . . . . 0.0 110.739 -179.873 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 71.4 Cg_exo -46.66 -22.66 1.92 Allowed 'Trans proline' 0 N--CA 1.496 1.671 0 C-N-CA 122.626 2.217 . . . . 0.0 112.751 -179.811 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.436 ' OE1' ' OD1' ' A' ' 52' ' ' ASP . 11.0 mp0 -80.29 -23.91 40.39 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 120.541 -0.464 . . . . 0.0 111.818 -178.968 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.539 ' O ' ' CE1' ' A' ' 57' ' ' PHE . 18.2 mtt-85 -92.72 151.03 40.63 Favored Pre-proline 0 C--N 1.331 -0.224 0 C-N-CA 120.354 -0.538 . . . . 0.0 109.736 179.563 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . 0.431 ' O ' ' OE1' ' A' ' 24' ' ' GLN . 35.7 Cg_endo -64.76 160.88 38.45 Favored 'Trans proline' 0 C--N 1.308 -1.594 0 C-N-CA 122.723 2.282 . . . . 0.0 113.187 -178.735 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . 0.548 ' CE2' ' OE1' ' A' ' 24' ' ' GLN . 42.9 m-85 -130.34 154.4 47.7 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 114.889 -1.051 . . . . 0.0 108.897 179.178 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.4 ' O ' ' HA ' ' A' ' 22' ' ' ILE . 83.4 mt-10 -120.6 134.96 55.23 Favored 'General case' 0 N--CA 1.467 0.392 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 178.469 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -117.0 137.28 52.33 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.212 0.529 . . . . 0.0 112.296 -178.187 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.444 ' NE ' ' CD1' ' A' ' 23' ' ' LEU . 0.9 OUTLIER -122.72 127.66 49.52 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.214 -0.903 . . . . 0.0 108.681 177.254 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 7.8 mt -110.66 139.01 46.32 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 120.73 -0.388 . . . . 0.0 110.419 -179.348 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' TYR . . . . . 0.5 ' CD1' ' N ' ' A' ' 62' ' ' TYR . 6.7 m-85 -120.27 111.24 17.54 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.935 -179.871 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 5.8 tt -105.09 -83.51 0.51 Allowed 'General case' 0 N--CA 1.462 0.15 0 CA-C-N 115.849 -0.614 . . . . 0.0 109.492 179.14 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -77.81 178.85 51.81 Favored Glycine 0 CA--C 1.523 0.542 0 N-CA-C 109.523 -1.431 . . . . 0.0 109.523 178.786 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -73.81 -33.23 64.09 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 119.898 -0.721 . . . . 0.0 110.119 -179.627 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 39.3 t0 -102.88 8.65 39.15 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.097 179.881 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 7.7 t -104.75 96.27 4.46 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.284 0 CA-C-O 121.308 0.575 . . . . 0.0 111.927 -178.812 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 6.0 tp -113.01 117.17 31.28 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 108.172 -1.048 . . . . 0.0 108.172 178.1 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 3.3 mt -111.91 143.69 21.2 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-O 120.818 0.342 . . . . 0.0 110.498 -179.061 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 24.7 mtm-85 -128.35 130.46 47.79 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.878 179.257 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' MET . . . . . 0.425 ' SD ' ' CD1' ' A' ' 90' ' ' ILE . 0.9 OUTLIER -139.48 148.78 43.16 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.858 -0.61 . . . . 0.0 109.741 179.575 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 72.1 tt0 -102.28 129.48 48.71 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 107.798 -1.186 . . . . 0.0 107.798 178.448 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.477 HD11 ' CG ' ' A' ' 85' ' ' PHE . 13.8 pt -138.16 157.54 31.79 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 C-N-CA 119.637 -0.825 . . . . 0.0 113.138 -177.491 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' SER . . . . . 0.587 ' N ' ' OE1' ' A' ' 88' ' ' GLN . 95.6 p -121.44 151.23 40.45 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 114.74 -1.118 . . . . 0.0 109.61 178.521 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.48 ' CD1' ' CZ ' ' A' ' 85' ' ' PHE . 8.0 tp -66.53 123.05 18.98 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.105 0.479 . . . . 0.0 110.431 -179.449 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -98.1 -44.38 6.64 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.964 178.042 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' TRP . . . . . 0.678 ' NE1' ' HA3' ' A' ' 84' ' ' GLY . 69.3 p-90 -164.95 170.55 15.11 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.185 -179.454 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -151.34 124.43 8.72 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 121.155 -0.218 . . . . 0.0 110.732 179.117 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . 0.552 ' NE ' " O2'" ' A' ' 502' ' ' C2E . 0.0 OUTLIER -151.95 131.68 13.19 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 112.933 0.716 . . . . 0.0 112.933 179.245 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 54.26 47.06 23.91 Favored 'General case' 0 N--CA 1.468 0.425 0 N-CA-C 113.791 1.034 . . . . 0.0 113.791 176.069 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 72.15 13.06 76.36 Favored Glycine 0 CA--C 1.522 0.503 0 C-N-CA 120.18 -1.01 . . . . 0.0 111.739 178.338 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 48.8 mt -116.91 138.06 51.79 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 178.818 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 29.7 mt -125.78 135.02 51.55 Favored 'General case' 0 CA--C 1.513 -0.456 0 C-N-CA 120.382 -0.527 . . . . 0.0 111.491 -178.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . 0.678 ' HA3' ' NE1' ' A' ' 77' ' ' TRP . . . -98.4 153.95 20.02 Favored Glycine 0 N--CA 1.447 -0.629 0 N-CA-C 109.334 -1.506 . . . . 0.0 109.334 178.381 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . 0.48 ' CZ ' ' CD1' ' A' ' 75' ' ' LEU . 28.8 m-85 -145.39 131.94 19.82 Favored 'General case' 0 C--N 1.312 -1.045 0 C-N-CA 120.794 -0.362 . . . . 0.0 110.568 -179.274 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.501 ' O ' ' NE2' ' A' ' 88' ' ' GLN . 20.3 pt-20 -103.6 128.77 50.82 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 179.692 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . 0.553 ' O ' ' NE2' ' A' ' 39' ' ' HIS . 5.2 t -75.71 124.52 27.4 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 112.234 0.457 . . . . 0.0 112.234 -178.028 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . 0.667 ' CA ' HE21 ' A' ' 88' ' ' GLN . 0.0 OUTLIER -102.12 -30.42 11.16 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.088 179.124 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . 0.609 ' ND1' ' N ' ' A' ' 90' ' ' ILE . 0.0 OUTLIER -158.77 140.47 13.53 Favored 'General case' 0 C--O 1.225 -0.198 0 CA-C-O 120.989 0.424 . . . . 0.0 110.202 179.298 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . 0.609 ' N ' ' ND1' ' A' ' 89' ' ' HIS . 6.2 tt -146.18 140.73 21.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.043 -179.384 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . 0.53 ' O ' ' OG ' ' A' ' 94' ' ' SER . 0.1 OUTLIER -53.94 142.27 25.14 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 115.308 -0.86 . . . . 0.0 111.993 -178.534 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 8.0 tp -54.37 -42.3 70.17 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.238 -0.892 . . . . 0.0 110.168 -179.831 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 3.6 p30 -69.03 -42.08 76.83 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.02 179.499 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' SER . . . . . 0.53 ' OG ' ' O ' ' A' ' 91' ' ' ASP . 2.0 p -60.26 -37.74 81.37 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.975 179.606 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 63.5 mt -58.77 -38.12 70.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.128 179.53 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -70.42 -40.44 73.84 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 120.292 -0.563 . . . . 0.0 110.988 -178.87 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 68.1 m-70 -64.29 -44.23 92.31 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 119.978 -0.689 . . . . 0.0 109.847 179.923 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -68.13 -35.49 78.19 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.35 179.299 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 13.0 mtp-105 -66.22 -41.94 89.4 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 120.94 -0.304 . . . . 0.0 111.466 -179.688 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 3.6 ptm85 -68.95 -36.1 77.53 Favored 'General case' 0 C--N 1.331 -0.201 0 C-N-CA 120.162 -0.615 . . . . 0.0 109.587 177.606 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 2.2 mp -57.83 -34.91 70.19 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 177.443 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 95.3 t -68.75 -45.44 81.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.195 179.232 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 -63.93 -35.59 81.17 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.644 179.898 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 9.1 mt -73.07 -42.55 62.93 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.576 -179.54 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -58.28 -50.5 73.38 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.444 179.892 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 9.3 mp -62.39 -25.23 67.82 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.272 179.939 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 110.93 -155.64 15.99 Favored Glycine 0 CA--C 1.522 0.501 0 N-CA-C 110.587 -1.005 . . . . 0.0 110.587 -179.877 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . 0.468 ' O ' ' N ' ' A' ' 110' ' ' GLU . 22.8 t70 -96.86 170.44 9.17 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.796 0.332 . . . . 0.0 110.351 179.877 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . 0.453 ' N ' ' CG ' ' A' ' 108' ' ' ASP . 0.0 OUTLIER -67.28 55.98 0.05 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.582 -179.957 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . 0.468 ' N ' ' O ' ' A' ' 108' ' ' ASP . 3.4 tt0 -46.46 174.7 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.445 179.932 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 1.4 mp -61.24 -33.13 73.01 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.743 -179.924 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -156.25 167.38 30.6 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.6 179.763 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . 0.42 ' O ' ' O ' ' A' ' 114' ' ' ARG . 19.3 tp10 -176.34 104.44 0.07 Allowed 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.602 179.96 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . 0.477 ' C ' ' H ' ' A' ' 116' ' ' LEU . 0.0 OUTLIER -53.09 -172.2 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.164 179.8 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . 0.41 ' OE1' ' CE1' ' A' ' 12' ' ' HIS . 5.2 mt-10 65.43 -0.55 1.15 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.975 0.416 . . . . 0.0 110.507 179.873 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.477 ' H ' ' C ' ' A' ' 114' ' ' ARG . 2.4 pp -67.27 -41.21 85.88 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.948 -179.689 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 117' ' ' ALA . . . . . 0.477 ' O ' ' CG2' ' A' ' 120' ' ' VAL . . . -69.13 -24.29 64.08 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 111.921 0.341 . . . . 0.0 111.921 -179.836 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 96.4 mt -55.13 -32.51 62.12 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 111.847 0.314 . . . . 0.0 111.847 -177.872 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . 0.574 ' C ' ' H ' ' A' ' 121' ' ' SER . 4.0 mm? -55.71 -16.95 4.88 Favored 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 119.961 -0.696 . . . . 0.0 109.465 -178.938 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . 0.482 ' O ' ' CG1' ' A' ' 120' ' ' VAL . 54.1 t -57.92 0.17 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.661 179.069 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 121' ' ' SER . . . . . 0.574 ' H ' ' C ' ' A' ' 119' ' ' LEU . 8.2 t -69.85 -18.64 63.44 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.998 -0.547 . . . . 0.0 111.275 -179.604 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . 0.653 ' O ' ' O ' ' A' ' 123' ' ' HIS . . . 76.58 21.85 1.26 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.971 0.415 . . . . 0.0 110.083 -179.61 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . 0.653 ' O ' ' O ' ' A' ' 122' ' ' ALA . 0.1 OUTLIER 47.52 133.58 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 115.403 -0.817 . . . . 0.0 111.474 179.503 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . 0.686 ' H ' ' NH1' ' A' ' 10' ' ' ARG . 0.5 OUTLIER 32.45 26.82 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 115.653 -0.703 . . . . 0.0 111.848 179.286 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 125' ' ' ASP . . . . . 0.619 ' N ' ' O ' ' A' ' 123' ' ' HIS . 0.0 OUTLIER . . . . . 0 C--O 1.221 -0.434 0 CA-C-O 117.986 -1.007 . . . . 0.0 111.18 179.895 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 501' ' ' C2E . . . . . 0.888 ' O21' " H4'" ' A' ' 501' ' ' C2E . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 502' ' ' C2E . . . . . 0.576 ' C2 ' ' CD1' ' A' ' 77' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 6.6 mmt . . . . . 0 N--CA 1.489 1.522 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 7.9 t -119.14 116.77 27.03 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.412 -179.906 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -102.25 91.82 4.46 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 175.888 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . 0.578 ' O ' ' NE2' ' A' ' 4' ' ' GLN . 0.0 OUTLIER -99.94 -34.4 10.13 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 120.832 -0.347 . . . . 0.0 111.718 -178.843 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 6.2 m80 -95.42 41.17 1.1 Allowed 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.507 -0.477 . . . . 0.0 111.022 -179.458 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . 0.558 ' O ' ' NE ' ' A' ' 8' ' ' ARG . 15.7 m-20 -57.45 120.13 7.71 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.059 -0.519 . . . . 0.0 109.782 179.218 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 18.0 tt0 -86.49 116.69 24.79 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.886 0.374 . . . . 0.0 110.593 -179.444 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.71 ' NH2' ' N11' ' A' ' 501' ' ' C2E . 0.0 OUTLIER -124.33 -2.48 8.04 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.26 -179.36 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.657 ' NH1' ' NH1' ' A' ' 13' ' ' ARG . 12.2 mtt180 -92.79 107.09 18.95 Favored 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 120.931 -0.308 . . . . 0.0 111.178 -178.967 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.572 ' C ' ' O ' ' A' ' 9' ' ' ARG . 0.0 OUTLIER -14.74 -57.81 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.016 179.943 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . 0.521 ' N ' ' O ' ' A' ' 9' ' ' ARG . 1.2 t80 -139.18 143.03 37.93 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.192 179.963 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . 0.6 ' H ' ' CD2' ' A' ' 12' ' ' HIS . 1.3 m-70 -53.54 119.45 4.88 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.761 -179.771 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.657 ' NH1' ' NH1' ' A' ' 9' ' ' ARG . 0.0 OUTLIER -68.12 178.38 1.89 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.906 0.384 . . . . 0.0 110.173 179.706 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.412 ' CD1' ' N ' ' A' ' 14' ' ' ILE . 1.7 mp -98.54 113.49 33.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.093 179.776 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -95.14 119.76 34.2 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.307 0.575 . . . . 0.0 111.039 -179.755 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.41 ' CZ ' HD23 ' A' ' 101' ' ' LEU . 0.4 OUTLIER -149.66 149.26 30.36 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.109 -0.95 . . . . 0.0 108.442 178.631 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -95.54 149.28 21.6 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 120.116 -0.634 . . . . 0.0 111.335 -178.19 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . 179.06 177.96 0.49 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.466 -0.788 . . . . 0.0 109.891 179.802 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -96.22 133.94 39.93 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.622 179.95 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.58 ' O ' ' O ' ' A' ' 31' ' ' VAL . 20.5 p -134.03 154.34 51.21 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.992 0.425 . . . . 0.0 110.209 178.688 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 16.3 mt-10 -136.24 146.6 46.92 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 108.798 -0.816 . . . . 0.0 108.798 179.409 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . 0.424 ' HA ' ' O ' ' A' ' 58' ' ' GLU . 39.8 mt -125.75 136.24 61.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 C-N-CA 120.037 -0.665 . . . . 0.0 111.329 -178.982 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.435 HD13 ' H ' ' A' ' 23' ' ' LEU . 0.1 OUTLIER -120.67 123.75 43.52 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.329 -0.85 . . . . 0.0 110.846 -179.497 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.491 ' O ' ' OE1' ' A' ' 24' ' ' GLN . 1.6 tm0? -131.49 102.2 5.84 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.513 -0.767 . . . . 0.0 109.606 178.811 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 78.97 -128.15 8.42 Favored Glycine 0 CA--C 1.525 0.664 0 N-CA-C 109.912 -1.275 . . . . 0.0 109.912 -178.711 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -99.14 12.32 36.47 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.865 0.364 . . . . 0.0 110.144 179.417 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.531 ' HB3' ' CZ2' ' A' ' 29' ' ' TRP . 18.6 mtt180 -113.41 135.43 53.87 Favored 'General case' 0 C--N 1.332 -0.177 0 N-CA-C 112.439 0.533 . . . . 0.0 112.439 -178.514 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.428 ' HG2' ' N ' ' A' ' 29' ' ' TRP . 7.0 ttt85 -128.86 148.25 50.88 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.184 179.282 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.531 ' CZ2' ' HB3' ' A' ' 27' ' ' ARG . 6.9 m-90 -146.65 155.82 42.73 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.628 -179.087 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 21.5 mt-10 -100.06 137.28 38.72 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 179.124 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.58 ' O ' ' O ' ' A' ' 20' ' ' SER . 17.3 m -146.88 157.69 10.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 121.31 0.576 . . . . 0.0 111.437 -179.361 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 10.7 tp -96.55 128.88 43.89 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 178.576 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.0 tt -93.37 124.99 37.74 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.232 0.539 . . . . 0.0 109.758 179.789 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 66.3 m-70 -91.24 -24.67 19.81 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.535 -0.757 . . . . 0.0 111.776 -178.434 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . 0.572 ' OD2' ' NH2' ' A' ' 13' ' ' ARG . 2.8 p30 -174.59 163.61 3.58 Favored 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 119.579 -0.849 . . . . 0.0 111.635 177.516 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 5.0 p -147.17 168.8 4.78 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.123 0 CA-C-N 115.434 -0.803 . . . . 0.0 111.275 -178.903 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 5.8 t -142.34 170.45 15.68 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 107.867 -1.16 . . . . 0.0 107.867 178.473 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.501 ' H ' ' CD2' ' A' ' 38' ' ' LEU . 0.1 OUTLIER -67.44 -2.58 6.56 Favored 'General case' 0 C--N 1.323 -0.566 0 C-N-CA 119.617 -0.833 . . . . 0.0 110.333 -179.687 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . 0.55 ' CD2' ' O ' ' A' ' 87' ' ' CYS . 1.6 t60 -156.67 37.97 0.32 Allowed 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 120.634 -0.426 . . . . 0.0 111.578 -179.627 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . 0.502 ' HA3' ' N3 ' ' A' ' 501' ' ' C2E . . . -178.73 158.4 22.74 Favored Glycine 0 CA--C 1.529 0.941 0 C-N-CA 120.505 -0.855 . . . . 0.0 111.526 179.795 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -149.82 150.17 13.97 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.362 0 CA-C-O 121.353 0.597 . . . . 0.0 111.565 -179.006 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.5 tt -122.24 141.28 51.65 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 115.06 -0.973 . . . . 0.0 108.783 178.815 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 15.9 m -145.34 175.03 2.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-O 121.202 0.525 . . . . 0.0 111.88 -179.242 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -99.56 144.85 17.25 Favored Glycine 0 CA--C 1.53 1.004 0 N-CA-C 109.68 -1.368 . . . . 0.0 109.68 178.423 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . 0.555 ' O ' ' NE2' ' A' ' 45' ' ' GLN . 0.0 OUTLIER -86.77 116.79 67.26 Favored Pre-proline 0 N--CA 1.465 0.307 0 CA-C-N 117.85 0.825 . . . . 0.0 111.939 -178.505 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 76.3 Cg_endo -87.1 151.65 8.22 Favored 'Trans proline' 0 C--N 1.309 -1.526 0 C-N-CA 121.567 1.511 . . . . 0.0 111.32 178.527 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -56.44 -13.74 2.5 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 112.658 0.614 . . . . 0.0 112.658 -178.76 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . 0.53 ' O ' ' N ' ' A' ' 50' ' ' ASN . 81.9 m-20 -97.52 8.81 43.94 Favored 'General case' 0 N--CA 1.467 0.398 0 N-CA-C 112.324 0.49 . . . . 0.0 112.324 -178.432 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' TRP . . . . . 0.444 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 58.4 t-105 -60.55 67.67 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 112.119 0.415 . . . . 0.0 112.119 -179.358 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . 0.53 ' N ' ' O ' ' A' ' 48' ' ' ASP . 0.3 OUTLIER -93.53 78.64 4.35 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 178.042 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -142.81 162.99 27.38 Favored Glycine 0 CA--C 1.524 0.609 0 N-CA-C 111.538 -0.625 . . . . 0.0 111.538 -179.146 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . 0.516 ' OD2' ' NH1' ' A' ' 55' ' ' ARG . 15.8 t0 -95.95 122.05 59.38 Favored Pre-proline 0 CA--C 1.534 0.328 0 CA-C-N 115.608 -0.296 . . . . 0.0 110.423 180.0 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -60.82 -21.71 71.28 Favored 'Trans proline' 0 N--CA 1.495 1.611 0 C-N-CA 122.472 2.115 . . . . 0.0 112.183 -179.315 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 22.9 mt-30 -78.67 -24.06 45.34 Favored 'General case' 0 C--N 1.326 -0.448 0 C-N-CA 120.435 -0.506 . . . . 0.0 111.619 -179.19 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.542 ' O ' ' CE1' ' A' ' 57' ' ' PHE . 1.2 mpp_? -93.35 153.18 41.51 Favored Pre-proline 0 N--CA 1.464 0.239 0 C-N-CA 120.595 -0.442 . . . . 0.0 110.004 179.698 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_endo -65.4 160.73 41.21 Favored 'Trans proline' 0 C--N 1.308 -1.585 0 C-N-CA 122.737 2.291 . . . . 0.0 113.273 -178.899 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . 0.542 ' CE1' ' O ' ' A' ' 55' ' ' ARG . 48.3 m-85 -130.87 155.24 47.07 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 114.891 -1.05 . . . . 0.0 109.117 179.633 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.424 ' O ' ' HA ' ' A' ' 22' ' ' ILE . 13.2 mm-40 -123.04 138.36 54.7 Favored 'General case' 0 N--CA 1.469 0.521 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 178.753 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -119.63 137.4 53.9 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.231 0.539 . . . . 0.0 112.133 -178.296 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.829 ' HE ' ' HE ' ' A' ' 70' ' ' ARG . 40.0 mtt85 -124.17 128.2 48.88 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.27 -0.877 . . . . 0.0 108.788 177.729 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -113.33 146.46 39.4 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.021 0.439 . . . . 0.0 110.634 -179.25 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' TYR . . . . . 0.449 ' CD1' ' N ' ' A' ' 62' ' ' TYR . 24.0 m-85 -124.03 108.85 12.82 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.173 179.56 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.412 ' HB3' ' H ' ' A' ' 64' ' ' GLY . 1.8 tt -103.13 -86.5 0.44 Allowed 'General case' 0 C--N 1.333 -0.138 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 179.551 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . 0.412 ' H ' ' HB3' ' A' ' 63' ' ' LEU . . . -74.3 174.06 50.36 Favored Glycine 0 CA--C 1.522 0.524 0 N-CA-C 109.147 -1.581 . . . . 0.0 109.147 178.367 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.495 ' CD1' ' N ' ' A' ' 65' ' ' LEU . 7.9 mp -71.31 -33.16 69.42 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 119.94 -0.704 . . . . 0.0 110.018 -179.788 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -102.52 9.55 39.44 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.902 179.912 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . 0.402 ' HB ' ' H ' ' A' ' 64' ' ' GLY . 24.2 t -107.59 98.81 7.45 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.324 0 CA-C-O 121.204 0.526 . . . . 0.0 112.02 -178.742 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 4.4 tp -113.86 117.77 32.35 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.268 -0.878 . . . . 0.0 108.709 178.55 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 3.1 mt -112.15 144.28 20.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.935 0.398 . . . . 0.0 111.208 -179.04 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.829 ' HE ' ' HE ' ' A' ' 60' ' ' ARG . 1.0 OUTLIER -128.34 131.3 48.6 Favored 'General case' 0 C--O 1.237 0.421 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.677 179.277 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 2.7 mtp -140.07 149.24 42.88 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.055 179.633 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . 0.413 ' OE1' ' OE2' ' A' ' 58' ' ' GLU . 23.9 tt0 -105.01 132.4 51.29 Favored 'General case' 0 CA--C 1.516 -0.33 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 177.995 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 1.5 pt -141.88 158.48 20.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 C-N-CA 119.521 -0.872 . . . . 0.0 113.266 -177.465 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' SER . . . . . 0.5 ' OG ' ' NE2' ' A' ' 88' ' ' GLN . 0.3 OUTLIER -118.91 149.16 42.05 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 114.966 -1.015 . . . . 0.0 109.205 178.35 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.411 ' CD1' ' CE1' ' A' ' 85' ' ' PHE . 16.2 tp -65.76 123.11 18.89 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.236 0.541 . . . . 0.0 110.199 -179.022 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -98.26 -44.62 6.5 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 115.261 -0.882 . . . . 0.0 111.257 178.423 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' TRP . . . . . 0.594 ' NE1' ' HA3' ' A' ' 84' ' ' GLY . 68.8 p-90 -166.05 169.58 14.43 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.412 -179.152 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -148.68 123.66 10.03 Favored 'General case' 0 N--CA 1.465 0.28 0 N-CA-C 109.446 -0.575 . . . . 0.0 109.446 178.222 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 37.6 ttt180 -152.37 133.54 14.3 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 119.762 -0.775 . . . . 0.0 112.809 -179.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 36.2 t0 57.24 47.15 17.47 Favored 'General case' 0 N--CA 1.465 0.276 0 N-CA-C 114.055 1.132 . . . . 0.0 114.055 176.845 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 82.9 -26.71 4.13 Favored Glycine 0 CA--C 1.521 0.452 0 C-N-CA 120.388 -0.911 . . . . 0.0 113.048 177.271 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 5.2 mt -89.66 161.6 16.03 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 117.689 0.744 . . . . 0.0 110.842 -179.057 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 40.5 mt -134.78 135.98 42.23 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.198 -179.25 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . 0.594 ' HA3' ' NE1' ' A' ' 77' ' ' TRP . . . -102.33 153.91 18.51 Favored Glycine 0 N--CA 1.453 -0.203 0 N-CA-C 109.741 -1.343 . . . . 0.0 109.741 178.529 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . 0.411 ' CE1' ' CD1' ' A' ' 75' ' ' LEU . 54.6 m-85 -145.64 139.63 26.75 Favored 'General case' 0 C--N 1.318 -0.777 0 C-N-CA 120.828 -0.349 . . . . 0.0 110.71 -179.725 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 20.4 pt-20 -103.86 130.08 51.4 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.084 -0.71 . . . . 0.0 109.084 179.764 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . 0.55 ' O ' ' CD2' ' A' ' 39' ' ' HIS . 5.2 t -77.33 124.36 27.75 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.006 0.431 . . . . 0.0 111.581 -178.556 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . 0.5 ' NE2' ' OG ' ' A' ' 74' ' ' SER . 0.0 OUTLIER -101.2 -29.67 11.97 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.206 179.685 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . 0.532 ' ND1' ' C ' ' A' ' 89' ' ' HIS . 0.0 OUTLIER -161.71 141.72 10.36 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.063 0.459 . . . . 0.0 110.273 179.471 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 6.6 tt -145.57 141.1 22.25 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-N 115.755 -0.657 . . . . 0.0 109.971 -179.547 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . 0.48 ' CG ' ' H ' ' A' ' 94' ' ' SER . 0.1 OUTLIER -53.69 141.05 27.5 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 115.164 -0.925 . . . . 0.0 111.747 -178.444 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.445 ' N ' ' OD1' ' A' ' 91' ' ' ASP . 3.1 tp -54.27 -42.53 70.1 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.122 -0.945 . . . . 0.0 110.593 -179.558 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 11.5 t0 -70.15 -36.83 75.01 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 179.476 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' SER . . . . . 0.48 ' H ' ' CG ' ' A' ' 91' ' ' ASP . 3.6 m -64.53 -37.85 88.98 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.661 -0.699 . . . . 0.0 109.784 179.162 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 50.1 mt -58.74 -37.82 68.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.056 179.529 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -70.56 -41.06 72.93 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.717 -179.167 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' HIS . . . . . 0.423 ' O ' ' HG2' ' A' ' 100' ' ' ARG . 64.1 m-70 -63.74 -44.07 94.59 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 119.932 -0.707 . . . . 0.0 109.764 179.786 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -67.43 -36.38 81.12 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 120.681 -0.408 . . . . 0.0 109.941 179.093 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 43.9 mtt-85 -66.58 -41.68 88.15 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.454 -0.499 . . . . 0.0 110.553 179.298 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . 0.423 ' HG2' ' O ' ' A' ' 97' ' ' HIS . 15.1 ptt85 -69.24 -37.41 77.96 Favored 'General case' 0 CA--C 1.53 0.193 0 N-CA-C 109.853 -0.425 . . . . 0.0 109.853 177.449 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.41 HD23 ' CZ ' ' A' ' 16' ' ' PHE . 17.0 tp -58.72 -41.15 85.71 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 109.338 -0.615 . . . . 0.0 109.338 177.438 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 42.3 t -67.4 -36.75 77.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.922 -179.921 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . 0.481 ' O ' ' O ' ' A' ' 107' ' ' GLY . 22.6 tt0 -58.95 -40.77 85.69 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.031 -179.423 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 69.0 mt -65.36 -39.79 92.77 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 120.938 -0.305 . . . . 0.0 110.914 -179.677 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 4.8 m-80 -67.44 -49.23 64.58 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 120.79 -0.364 . . . . 0.0 110.412 179.932 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -61.05 -39.64 90.6 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.296 179.906 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . 0.481 ' O ' ' O ' ' A' ' 103' ' ' GLU . . . 142.24 -142.46 11.75 Favored Glycine 0 CA--C 1.526 0.753 0 N-CA-C 110.893 -0.883 . . . . 0.0 110.893 179.878 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -173.66 97.89 0.11 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.915 0.388 . . . . 0.0 110.526 179.888 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 15.7 mm-40 47.97 89.14 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.5 -179.876 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -142.25 -40.77 0.35 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.224 -179.911 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . 0.56 ' N ' ' CD2' ' A' ' 111' ' ' LEU . 3.3 mm? 50.86 74.71 0.22 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.57 -179.863 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.531 ' O ' ' N ' ' A' ' 114' ' ' ARG . 24.2 tp -84.26 101.73 12.12 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.295 179.903 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -58.0 78.27 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.713 -179.836 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . 0.531 ' N ' ' O ' ' A' ' 112' ' ' LEU . 36.4 ttp180 -173.45 -77.33 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.072 179.876 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 1.3 pt-20 -85.46 10.13 13.78 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.665 -0.494 . . . . 0.0 109.665 179.35 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 6.4 tp -67.2 -38.24 85.0 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.357 -179.746 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 117' ' ' ALA . . . . . 0.448 ' O ' ' CG2' ' A' ' 120' ' ' VAL . . . -69.82 -24.25 63.44 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.647 179.528 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 47.7 mt -54.86 -36.43 65.07 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 120.173 -0.611 . . . . 0.0 110.743 -177.941 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . 0.618 ' C ' ' H ' ' A' ' 121' ' ' SER . 4.0 mm? -55.85 -15.44 3.29 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.123 -0.631 . . . . 0.0 110.018 -178.618 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . 0.477 ' O ' ' CG1' ' A' ' 120' ' ' VAL . 54.7 t -56.93 0.11 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 120.984 0.421 . . . . 0.0 110.338 -179.748 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 121' ' ' SER . . . . . 0.618 ' H ' ' C ' ' A' ' 119' ' ' LEU . 28.2 t -74.73 -24.57 58.74 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 109.544 -0.539 . . . . 0.0 109.544 178.83 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -163.1 157.18 20.36 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.067 179.652 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . 0.479 ' C ' ' ND1' ' A' ' 123' ' ' HIS . 0.1 OUTLIER 176.35 178.34 0.22 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.48 -179.901 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 59.2 m-20 -123.15 -10.08 8.13 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.356 179.743 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 1.5 t70 . . . . . 0 C--O 1.22 -0.452 0 CA-C-O 118.032 -0.985 . . . . 0.0 110.527 -179.863 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 501' ' ' C2E . . . . . 0.853 ' O21' " H4'" ' A' ' 501' ' ' C2E . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 502' ' ' C2E . . . . . 0.521 ' C2 ' ' CD1' ' A' ' 77' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.649 ' O ' ' CB ' ' A' ' 2' ' ' SER . 8.3 mmm . . . . . 0 N--CA 1.489 1.512 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.649 ' CB ' ' O ' ' A' ' 1' ' ' MET . 41.3 t 120.61 -29.8 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.541 0 O-C-N 123.942 0.776 . . . . 0.0 110.182 -179.857 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -99.28 -7.54 26.24 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.977 179.646 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . 0.708 ' H ' ' NE2' ' A' ' 4' ' ' GLN . 0.0 OUTLIER -112.66 -0.83 14.97 Favored 'General case' 0 N--CA 1.464 0.248 0 C-N-CA 120.923 -0.311 . . . . 0.0 111.464 -179.938 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . 0.662 ' O ' ' NH1' ' A' ' 8' ' ' ARG . 12.7 m170 97.5 -96.92 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.456 0 O-C-N 123.533 0.521 . . . . 0.0 110.888 179.803 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . 0.401 ' O ' ' O ' ' A' ' 5' ' ' HIS . 10.1 m-20 60.09 152.52 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.784 -0.366 . . . . 0.0 110.281 -179.701 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.456 ' HA ' ' C61' ' A' ' 502' ' ' C2E . 3.4 tt0 -93.3 129.42 39.39 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-O 121.006 0.432 . . . . 0.0 110.719 -179.575 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.712 ' H ' ' C61' ' A' ' 502' ' ' C2E . 0.0 OUTLIER -126.2 -13.87 6.08 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.739 -178.618 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.713 ' O ' ' N ' ' A' ' 11' ' ' PHE . 3.2 ptt180 -108.12 79.57 1.28 Allowed 'General case' 0 N--CA 1.471 0.602 0 CA-C-O 121.108 0.48 . . . . 0.0 110.047 179.945 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.464 ' C ' ' O ' ' A' ' 9' ' ' ARG . 0.0 OUTLIER 20.24 -73.49 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.567 0 CA-C-N 114.8 -1.091 . . . . 0.0 112.062 -179.668 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . 0.713 ' N ' ' O ' ' A' ' 9' ' ' ARG . 0.7 OUTLIER -145.53 168.18 21.23 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-O 120.724 0.297 . . . . 0.0 110.397 -179.649 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -49.81 168.44 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.534 -179.76 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.501 HH12 HD11 ' A' ' 42' ' ' LEU . 8.4 mtm180 -119.03 165.19 14.43 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.375 180.0 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.411 HD12 HG23 ' A' ' 14' ' ' ILE . 7.2 mm -63.92 91.45 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 179.411 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -95.08 120.89 36.06 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.475 0.655 . . . . 0.0 111.992 -178.926 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 23.2 p90 -149.3 158.09 43.88 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 114.873 -1.058 . . . . 0.0 108.448 177.567 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -95.55 146.38 24.5 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 120.291 -0.564 . . . . 0.0 110.314 -179.591 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . 179.94 176.77 0.69 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.075 179.788 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -96.28 133.94 40.02 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.104 -179.686 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.47 ' O ' ' O ' ' A' ' 31' ' ' VAL . 11.4 p -132.94 150.32 52.17 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.081 -0.509 . . . . 0.0 109.941 178.338 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.559 ' OE1' ' NH2' ' A' ' 28' ' ' ARG . 8.3 mm-40 -132.51 138.2 47.45 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 179.59 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 43.0 mt -119.32 136.12 57.52 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 121.353 0.597 . . . . 0.0 110.987 -179.091 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.418 HD11 ' H ' ' A' ' 23' ' ' LEU . 0.1 OUTLIER -123.73 123.2 39.98 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.33 -0.85 . . . . 0.0 111.107 -179.135 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.482 ' O ' ' OE1' ' A' ' 24' ' ' GLN . 1.4 tm0? -128.65 101.57 6.2 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.328 -0.851 . . . . 0.0 109.687 178.918 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 80.99 -125.68 6.99 Favored Glycine 0 CA--C 1.525 0.662 0 N-CA-C 110.103 -1.199 . . . . 0.0 110.103 -178.664 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -101.17 11.63 39.07 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.86 0.362 . . . . 0.0 110.06 179.404 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.505 ' HB3' ' CZ2' ' A' ' 29' ' ' TRP . 36.1 mtt85 -113.5 134.65 54.56 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 112.652 0.612 . . . . 0.0 112.652 -178.146 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.559 ' NH2' ' OE1' ' A' ' 21' ' ' GLU . 70.0 ttt-85 -128.38 149.33 50.58 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.443 179.325 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.534 ' NE1' ' O ' ' A' ' 48' ' ' ASP . 7.8 m-90 -146.5 156.25 43.13 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.386 -0.825 . . . . 0.0 110.496 -179.382 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.496 ' N ' ' CD ' ' A' ' 30' ' ' GLU . 3.7 mp0 -100.77 138.85 37.27 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.975 -0.557 . . . . 0.0 109.621 179.35 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.47 ' O ' ' O ' ' A' ' 20' ' ' SER . 9.1 m -147.28 156.33 10.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-O 121.287 0.565 . . . . 0.0 110.962 -179.434 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 11.4 tp -97.04 129.92 44.42 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 108.123 -1.065 . . . . 0.0 108.123 178.631 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -92.08 124.09 35.92 Favored 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 120.29 -0.564 . . . . 0.0 110.072 -179.827 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 77.0 m-70 -90.67 -30.1 17.33 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.339 -0.846 . . . . 0.0 111.474 -178.803 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . 0.401 ' OD1' ' C ' ' A' ' 35' ' ' ASP . 2.1 p30 -170.05 160.57 8.24 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 119.538 -0.865 . . . . 0.0 110.868 177.26 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 3.4 p -144.75 169.17 8.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.055 -178.825 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 13.1 t -140.89 168.34 20.03 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 108.497 -0.927 . . . . 0.0 108.497 179.083 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.403 HD12 ' N ' ' A' ' 38' ' ' LEU . 0.3 OUTLIER -66.99 -2.02 4.82 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 119.92 -0.712 . . . . 0.0 110.687 -179.572 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -158.71 35.91 0.22 Allowed 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 120.695 -0.402 . . . . 0.0 111.185 179.889 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -174.48 157.38 24.87 Favored Glycine 0 CA--C 1.526 0.78 0 N-CA-C 110.947 -0.861 . . . . 0.0 110.947 179.681 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.412 HG21 HD12 ' A' ' 41' ' ' ILE . 0.1 OUTLIER -146.39 148.18 17.29 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.267 0 CA-C-O 121.484 0.659 . . . . 0.0 111.661 -179.239 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.501 HD11 HH12 ' A' ' 13' ' ' ARG . 0.8 OUTLIER -122.15 134.79 54.74 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 114.936 -1.029 . . . . 0.0 108.896 178.776 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 22.0 m -139.37 174.95 8.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-O 121.227 0.537 . . . . 0.0 111.837 -179.311 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -96.77 143.33 16.67 Favored Glycine 0 CA--C 1.528 0.881 0 N-CA-C 109.331 -1.508 . . . . 0.0 109.331 178.071 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . 0.44 ' O ' ' OE1' ' A' ' 45' ' ' GLN . 2.1 tm0? -85.52 115.93 63.51 Favored Pre-proline 0 N--CA 1.465 0.275 0 CA-C-N 118.041 0.921 . . . . 0.0 111.678 -178.715 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 97.8 Cg_endo -86.27 161.5 9.86 Favored 'Trans proline' 0 C--N 1.308 -1.572 0 C-N-CA 121.543 1.495 . . . . 0.0 111.241 178.732 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 19.7 mt-30 -65.41 -40.21 93.1 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 112.591 0.589 . . . . 0.0 112.591 -178.789 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . 0.534 ' O ' ' NE1' ' A' ' 29' ' ' TRP . 1.8 m-20 -71.64 8.4 1.14 Allowed 'General case' 0 N--CA 1.465 0.286 0 N-CA-C 112.013 0.375 . . . . 0.0 112.013 -178.709 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' TRP . . . . . 0.455 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 61.7 t-105 -60.56 67.84 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 111.832 0.308 . . . . 0.0 111.832 -179.426 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . 0.53 ' N ' ' O ' ' A' ' 48' ' ' ASP . 0.3 OUTLIER -93.46 78.89 4.37 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 120.155 -0.618 . . . . 0.0 109.816 178.698 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -141.24 160.3 26.79 Favored Glycine 0 CA--C 1.525 0.706 0 N-CA-C 111.223 -0.751 . . . . 0.0 111.223 -179.656 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 59.2 t0 -97.32 108.03 42.12 Favored Pre-proline 0 CA--C 1.531 0.242 0 N-CA-C 110.627 -0.138 . . . . 0.0 110.627 -179.842 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -47.52 -22.54 2.87 Favored 'Trans proline' 0 C--N 1.311 -1.439 0 C-N-CA 122.167 1.911 . . . . 0.0 112.341 179.973 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 25.1 mt-30 -74.85 -23.99 58.51 Favored 'General case' 0 C--N 1.324 -0.512 0 C-N-CA 120.51 -0.476 . . . . 0.0 111.233 -179.237 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.546 ' O ' ' CE1' ' A' ' 57' ' ' PHE . 0.0 OUTLIER -96.77 150.09 36.53 Favored Pre-proline 0 C--N 1.331 -0.237 0 N-CA-C 109.863 -0.421 . . . . 0.0 109.863 -179.948 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 25.5 Cg_endo -61.62 160.78 26.92 Favored 'Trans proline' 0 N--CA 1.495 1.615 0 C-N-CA 122.824 2.349 . . . . 0.0 113.298 -178.487 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . 0.546 ' CE1' ' O ' ' A' ' 55' ' ' ARG . 52.5 m-85 -130.98 154.69 47.89 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.012 -0.994 . . . . 0.0 109.313 179.58 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -122.16 136.39 54.9 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 109.036 -0.728 . . . . 0.0 109.036 178.372 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -118.1 138.27 52.38 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.225 0.536 . . . . 0.0 112.19 -178.099 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 20.0 mtm-85 -124.09 127.67 48.16 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 177.813 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 12.8 mt -109.76 151.02 27.48 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.002 0.43 . . . . 0.0 111.215 -178.741 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 38.2 m-85 -132.29 108.84 9.48 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.428 179.593 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.41 ' C ' ' CD2' ' A' ' 63' ' ' LEU . 1.1 tt -102.84 -84.59 0.46 Allowed 'General case' 0 C--N 1.332 -0.155 0 N-CA-C 108.941 -0.763 . . . . 0.0 108.941 179.089 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . 0.403 ' H ' ' HB3' ' A' ' 63' ' ' LEU . . . -76.65 179.35 49.27 Favored Glycine 0 CA--C 1.523 0.548 0 N-CA-C 108.819 -1.712 . . . . 0.0 108.819 178.202 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.528 ' CD1' ' N ' ' A' ' 65' ' ' LEU . 7.5 mp -74.07 -32.3 63.22 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 119.708 -0.797 . . . . 0.0 110.251 -179.589 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.401 ' O ' ' OD1' ' A' ' 66' ' ' ASP . 51.9 t0 -102.35 9.4 39.85 Favored 'General case' 0 C--N 1.332 -0.154 0 C-N-CA 122.735 0.414 . . . . 0.0 111.166 -179.865 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 8.6 t -104.36 94.36 3.12 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.238 0 CA-C-O 121.487 0.66 . . . . 0.0 111.533 -179.172 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 6.6 tp -109.74 117.44 33.9 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 114.863 -1.062 . . . . 0.0 108.214 178.542 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . 0.403 HG21 ' N ' ' A' ' 70' ' ' ARG . 7.6 mt -115.79 143.79 24.92 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.373 0 CA-C-O 121.047 0.451 . . . . 0.0 111.228 -178.632 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.424 ' C ' ' HG2' ' A' ' 71' ' ' MET . 0.0 OUTLIER -128.2 130.84 48.63 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.056 179.197 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' MET . . . . . 0.424 ' HG2' ' C ' ' A' ' 70' ' ' ARG . 0.0 OUTLIER -139.91 148.04 41.44 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.625 -0.716 . . . . 0.0 109.611 179.511 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -100.43 132.78 45.62 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 107.081 -1.452 . . . . 0.0 107.081 177.731 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.444 HD13 ' CG ' ' A' ' 85' ' ' PHE . 7.7 pt -141.69 157.44 21.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 C-N-CA 119.407 -0.917 . . . . 0.0 113.458 -176.813 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' SER . . . . . 0.506 ' OG ' ' NE2' ' A' ' 88' ' ' GLN . 0.5 OUTLIER -122.78 155.97 35.45 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 114.925 -1.034 . . . . 0.0 109.877 178.736 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -65.1 119.42 10.78 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.521 -0.308 . . . . 0.0 110.632 -179.533 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -97.1 -40.27 8.91 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 177.344 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' TRP . . . . . 0.594 ' NE1' ' HA3' ' A' ' 84' ' ' GLY . 69.2 p-90 -171.68 169.78 5.85 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.143 179.674 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -150.53 123.52 8.75 Favored 'General case' 0 N--CA 1.463 0.184 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 178.239 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 24.4 ttt85 -152.44 133.79 14.42 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 119.934 -0.706 . . . . 0.0 112.75 -179.948 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . 0.424 ' O ' ' OD1' ' A' ' 80' ' ' ASP . 25.7 t0 57.07 47.46 17.36 Favored 'General case' 0 N--CA 1.463 0.196 0 N-CA-C 113.764 1.024 . . . . 0.0 113.764 176.747 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 83.17 -27.95 3.86 Favored Glycine 0 CA--C 1.522 0.53 0 C-N-CA 120.241 -0.981 . . . . 0.0 113.284 177.073 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 4.3 mt -89.61 159.24 17.26 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 117.83 0.815 . . . . 0.0 110.436 -178.88 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 39.8 mt -131.48 135.98 47.54 Favored 'General case' 0 CA--C 1.518 -0.288 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.541 -178.811 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . 0.594 ' HA3' ' NE1' ' A' ' 77' ' ' TRP . . . -100.11 153.08 19.38 Favored Glycine 0 N--CA 1.453 -0.233 0 N-CA-C 109.748 -1.341 . . . . 0.0 109.748 178.471 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . 0.444 ' CG ' HD13 ' A' ' 73' ' ' ILE . 33.6 m-85 -145.7 135.72 23.67 Favored 'General case' 0 C--N 1.318 -0.768 0 C-N-CA 120.734 -0.386 . . . . 0.0 110.612 -179.575 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -104.18 127.31 51.77 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.06 -0.719 . . . . 0.0 109.06 179.363 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -74.27 125.35 28.24 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.173 0.511 . . . . 0.0 111.542 -178.638 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . 0.506 ' NE2' ' OG ' ' A' ' 74' ' ' SER . 0.0 OUTLIER -102.5 -29.82 11.36 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.032 179.817 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . 0.636 ' ND1' ' N ' ' A' ' 90' ' ' ILE . 0.0 OUTLIER -158.38 140.23 13.81 Favored 'General case' 0 C--O 1.226 -0.163 0 N-CA-C 109.891 -0.411 . . . . 0.0 109.891 178.735 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . 0.636 ' N ' ' ND1' ' A' ' 89' ' ' HIS . 7.0 tt -146.15 141.08 21.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-O 121.352 0.596 . . . . 0.0 109.988 -179.444 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . 0.494 ' CB ' ' OG ' ' A' ' 94' ' ' SER . 0.1 OUTLIER -53.75 142.03 24.84 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.287 -0.87 . . . . 0.0 112.05 -178.381 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 6.0 tp -54.43 -42.36 70.45 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.178 -0.919 . . . . 0.0 109.968 -179.993 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . 0.425 ' OD2' ' OD2' ' A' ' 91' ' ' ASP . 3.5 p30 -68.36 -42.49 79.13 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.145 -0.48 . . . . 0.0 109.97 179.636 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' SER . . . . . 0.494 ' OG ' ' CB ' ' A' ' 91' ' ' ASP . 1.9 p -62.31 -36.24 81.55 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.037 -0.529 . . . . 0.0 109.998 179.373 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 36.7 mt -58.86 -37.97 70.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.157 179.664 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -70.24 -39.71 74.89 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.257 -0.577 . . . . 0.0 110.914 -178.758 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 60.4 m-70 -61.84 -35.22 77.62 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 119.515 -0.874 . . . . 0.0 109.108 179.753 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 6.7 mt -67.44 -36.08 80.5 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 177.978 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 18.6 mtt-85 -66.55 -41.95 87.89 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 178.089 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 40.1 mtt85 -55.85 -37.87 69.33 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.022 178.194 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 4.1 mp -69.51 -44.6 70.72 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.542 -179.665 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . 0.439 HG12 ' N ' ' A' ' 103' ' ' GLU . 0.4 OUTLIER -61.39 -43.55 96.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.936 0.398 . . . . 0.0 110.086 179.968 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . 0.439 ' N ' HG12 ' A' ' 102' ' ' VAL . 1.8 tm-20 -65.78 -44.61 85.27 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.335 -179.769 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 27.0 mt -73.68 -22.62 59.88 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.413 -178.967 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -57.36 -36.86 71.75 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 120.761 -0.376 . . . . 0.0 110.511 -179.612 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.52 ' N ' ' CD1' ' A' ' 106' ' ' LEU . 7.0 mp -74.54 -25.18 59.16 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.682 -179.919 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 98.03 -83.82 0.69 Allowed Glycine 0 CA--C 1.525 0.694 0 N-CA-C 111.165 -0.774 . . . . 0.0 111.165 179.761 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -139.67 -76.64 0.34 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.557 0.217 . . . . 0.0 110.426 -179.796 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 173.24 18.78 0.0 OUTLIER 'General case' 0 CA--C 1.529 0.156 0 CA-C-N 116.528 -0.306 . . . . 0.0 110.493 179.92 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 82.0 mt-10 -111.59 -0.72 16.02 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.69 -179.972 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -144.63 108.31 4.67 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.346 179.983 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.582 ' N ' ' CD2' ' A' ' 112' ' ' LEU . 2.8 mm? -76.94 151.01 35.9 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.358 -179.699 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 23.3 tt0 -90.3 -70.06 0.69 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.834 -179.707 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 74.9 mtt180 -37.68 141.16 0.2 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.139 -179.823 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . 0.416 ' O ' ' HB2' ' A' ' 118' ' ' LEU . 34.4 tt0 -117.53 151.39 37.22 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.035 -0.53 . . . . 0.0 109.891 179.334 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -67.52 -34.69 77.63 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.102 -179.225 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 117' ' ' ALA . . . . . 0.475 ' O ' ' CG2' ' A' ' 120' ' ' VAL . . . -68.25 -24.6 64.91 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-O 121.404 0.621 . . . . 0.0 110.216 -179.406 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . 0.484 ' C ' ' H ' ' A' ' 120' ' ' VAL . 28.8 mt -64.17 -30.87 71.91 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 115.175 -0.92 . . . . 0.0 109.751 178.265 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . 0.49 ' C ' ' H ' ' A' ' 121' ' ' SER . 0.3 OUTLIER -55.37 -10.23 0.58 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.351 -0.841 . . . . 0.0 109.255 -178.837 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . 0.49 ' O ' ' CG1' ' A' ' 120' ' ' VAL . 29.1 t -59.28 -1.45 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.327 176.253 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 121' ' ' SER . . . . . 0.49 ' H ' ' C ' ' A' ' 119' ' ' LEU . 0.3 OUTLIER -92.47 -16.73 25.45 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 111.907 0.336 . . . . 0.0 111.907 -178.915 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -97.64 -15.23 20.52 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.064 0.459 . . . . 0.0 110.832 -179.73 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . 0.654 ' CD2' ' C ' ' A' ' 123' ' ' HIS . 0.0 OUTLIER 179.75 -177.74 0.37 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.671 -0.695 . . . . 0.0 109.652 -178.618 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . 0.531 ' N ' ' CG ' ' A' ' 123' ' ' HIS . 17.3 t0 -175.2 -47.81 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 179.034 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 . . . . . 0 C--N 1.323 -0.564 0 CA-C-O 117.992 -1.004 . . . . 0.0 110.496 179.98 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 501' ' ' C2E . . . . . 0.667 ' C21' ' NH2' ' A' ' 8' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 502' ' ' C2E . . . . . 0.712 ' C61' ' H ' ' A' ' 8' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.496 ' O ' ' O ' ' A' ' 2' ' ' SER . 2.9 ttm . . . . . 0 N--CA 1.489 1.5 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.496 ' O ' ' O ' ' A' ' 1' ' ' MET . 6.2 m 39.62 99.69 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.927 179.732 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . 0.489 ' OD1' ' N ' ' A' ' 3' ' ' ASP . 0.0 OUTLIER -99.05 14.1 30.47 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.242 179.074 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . 0.444 ' OE1' ' OD1' ' A' ' 3' ' ' ASP . 1.4 mp0 -114.22 12.1 17.64 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.087 177.883 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . 0.656 ' C ' ' CD2' ' A' ' 5' ' ' HIS . 0.0 OUTLIER 76.05 11.07 3.04 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.728 179.567 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . 0.581 ' OD1' ' N ' ' A' ' 6' ' ' ASP . 0.3 OUTLIER -29.81 149.8 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.329 179.942 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -84.12 133.48 34.62 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.199 0.523 . . . . 0.0 110.71 -179.802 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.633 ' H ' ' C61' ' A' ' 502' ' ' C2E . 0.0 OUTLIER -124.96 -8.8 7.19 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.443 -0.799 . . . . 0.0 111.307 -179.111 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.689 HH11 ' NE ' ' A' ' 13' ' ' ARG . 4.6 mtt180 -96.03 30.87 2.28 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-O 120.971 0.415 . . . . 0.0 110.594 -179.372 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER 59.57 -62.02 0.05 Allowed 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.963 179.63 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . 0.603 ' N ' ' O ' ' A' ' 9' ' ' ARG . 0.2 OUTLIER -140.4 169.51 17.53 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 110.075 -0.343 . . . . 0.0 110.075 179.909 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 80.2 m-70 -61.92 145.06 53.98 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.883 -179.758 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.689 ' NE ' HH11 ' A' ' 9' ' ' ARG . 0.0 OUTLIER -93.72 149.07 21.54 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.151 179.759 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.502 ' CD1' ' N ' ' A' ' 14' ' ' ILE . 1.7 mp -59.68 89.86 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 179.019 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.41 ' N ' ' O ' ' A' ' 13' ' ' ARG . . . -94.42 120.41 34.61 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.403 0.621 . . . . 0.0 111.676 -178.963 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 1.6 p90 -149.67 158.09 43.85 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 114.768 -1.105 . . . . 0.0 108.212 177.85 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 31.4 m-20 -95.37 146.42 24.4 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 120.14 -0.624 . . . . 0.0 110.432 -179.22 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -179.27 176.83 0.82 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.967 -0.56 . . . . 0.0 109.742 179.652 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -96.66 134.43 39.91 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.195 -179.666 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.595 ' O ' ' O ' ' A' ' 31' ' ' VAL . 16.9 p -133.43 153.98 51.16 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.01 0.434 . . . . 0.0 109.875 178.445 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.4 mt-10 -134.61 140.43 46.06 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 179.658 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 2.7 mm -118.93 135.66 58.63 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-O 121.489 0.661 . . . . 0.0 110.404 -179.639 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -127.23 123.06 35.68 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.04 -0.982 . . . . 0.0 110.482 -179.254 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.581 ' O ' ' OE1' ' A' ' 24' ' ' GLN . 1.4 tm0? -128.39 102.22 6.56 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.444 -0.798 . . . . 0.0 109.485 178.935 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 80.23 -124.22 6.39 Favored Glycine 0 CA--C 1.524 0.629 0 N-CA-C 110.204 -1.158 . . . . 0.0 110.204 -178.797 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -102.38 11.62 37.76 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.78 0.324 . . . . 0.0 110.288 179.915 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.553 ' HB3' ' CZ2' ' A' ' 29' ' ' TRP . 46.5 mtt180 -114.34 136.53 52.87 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 112.844 0.683 . . . . 0.0 112.844 -177.962 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 27.7 ttt180 -129.05 149.55 50.82 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.104 0.478 . . . . 0.0 110.272 179.344 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.553 ' CZ2' ' HB3' ' A' ' 27' ' ' ARG . 5.6 m-90 -150.26 125.66 10.15 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.682 -178.859 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -75.06 143.29 43.53 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 119.853 -0.739 . . . . 0.0 109.692 -179.0 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.595 ' O ' ' O ' ' A' ' 20' ' ' SER . 6.1 m -148.4 158.94 7.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-O 121.262 0.553 . . . . 0.0 111.176 -179.019 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.701 ' H ' ' CD2' ' A' ' 32' ' ' LEU . 1.5 pt? -99.05 130.35 45.37 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 108.816 -0.809 . . . . 0.0 108.816 178.729 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -94.24 124.94 38.58 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.311 0.577 . . . . 0.0 109.544 -179.939 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 71.1 m-70 -89.49 -26.18 21.05 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.379 -0.828 . . . . 0.0 111.882 -178.241 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -174.03 162.98 3.92 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 119.739 -0.784 . . . . 0.0 111.326 177.842 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 4.8 p -146.71 168.81 5.49 Favored 'Isoleucine or valine' 0 C--O 1.231 0.104 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.041 -179.097 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' SER . . . . . 0.457 ' CB ' HN22 ' A' ' 501' ' ' C2E . 67.5 p -142.28 168.08 20.58 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 107.321 -1.363 . . . . 0.0 107.321 177.851 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -62.41 -0.81 0.63 Allowed 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 119.33 -0.948 . . . . 0.0 110.697 -179.239 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . 0.454 ' H ' ' C ' ' A' ' 37' ' ' SER . 0.4 OUTLIER -164.92 45.62 0.09 Allowed 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 120.628 -0.429 . . . . 0.0 111.425 179.978 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -179.17 150.98 9.81 Favored Glycine 0 CA--C 1.529 0.919 0 N-CA-C 110.812 -0.915 . . . . 0.0 110.812 179.75 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -146.36 148.14 17.35 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.267 0 CA-C-O 121.445 0.64 . . . . 0.0 111.903 -179.175 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -122.52 126.62 48.19 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 114.921 -1.036 . . . . 0.0 108.963 179.059 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 30.5 m -131.3 174.96 12.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 121.392 0.615 . . . . 0.0 111.742 -179.379 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -98.28 145.61 17.83 Favored Glycine 0 CA--C 1.528 0.883 0 N-CA-C 109.638 -1.385 . . . . 0.0 109.638 178.393 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 6.9 tt0 -87.41 113.98 56.58 Favored Pre-proline 0 N--CA 1.466 0.346 0 CA-C-N 117.886 0.843 . . . . 0.0 111.992 -178.486 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -84.58 161.37 12.57 Favored 'Trans proline' 0 C--N 1.308 -1.575 0 C-N-CA 121.663 1.575 . . . . 0.0 111.359 178.474 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 4.8 tt0 -65.43 -40.06 92.87 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 112.279 0.474 . . . . 0.0 112.279 -178.894 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . 0.524 ' O ' ' N ' ' A' ' 50' ' ' ASN . 57.7 t0 -73.18 8.39 1.68 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.528 -0.306 . . . . 0.0 111.62 -178.755 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' TRP . . . . . 0.465 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 62.6 t-105 -60.93 68.2 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.564 -0.289 . . . . 0.0 111.567 -179.667 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . 0.555 ' ND2' ' C ' ' A' ' 50' ' ' ASN . 0.6 OUTLIER -93.69 78.69 4.26 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 178.468 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -138.58 161.43 25.75 Favored Glycine 0 CA--C 1.524 0.602 0 C-N-CA 120.875 -0.679 . . . . 0.0 111.721 -179.429 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . 0.464 ' H ' ' NE2' ' A' ' 24' ' ' GLN . 0.4 OUTLIER -96.14 120.39 62.81 Favored Pre-proline 0 CA--C 1.535 0.385 0 N-CA-C 109.836 -0.431 . . . . 0.0 109.836 179.774 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_endo -63.86 -22.29 68.99 Favored 'Trans proline' 0 N--CA 1.492 1.44 0 C-N-CA 122.172 1.914 . . . . 0.0 112.48 -179.368 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 42.5 mm-40 -75.95 -23.84 55.43 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 120.353 -0.539 . . . . 0.0 111.12 -179.492 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.518 ' O ' ' CE1' ' A' ' 57' ' ' PHE . 80.6 mtt180 -96.87 146.79 31.91 Favored Pre-proline 0 CA--C 1.532 0.258 0 C-N-CA 120.748 -0.381 . . . . 0.0 110.396 179.956 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_exo -57.87 160.97 13.77 Favored 'Trans proline' 0 N--CA 1.496 1.653 0 C-N-CA 122.665 2.244 . . . . 0.0 113.177 -179.332 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . 0.518 ' CE1' ' O ' ' A' ' 55' ' ' ARG . 33.9 m-85 -129.62 154.88 46.66 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 114.973 -1.012 . . . . 0.0 108.766 179.049 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 28.3 mt-10 -122.25 137.93 54.67 Favored 'General case' 0 N--CA 1.465 0.279 0 N-CA-C 109.319 -0.623 . . . . 0.0 109.319 178.54 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -121.41 139.47 53.41 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.033 0.444 . . . . 0.0 112.167 -178.026 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.491 ' CG ' HH11 ' A' ' 60' ' ' ARG . 1.9 mtt-85 -123.12 127.31 48.52 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 177.03 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 9.6 mp -106.52 151.07 25.47 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 120.777 -0.369 . . . . 0.0 110.255 -179.433 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' TYR . . . . . 0.464 ' HH ' ' CB ' ' A' ' 60' ' ' ARG . 28.4 m-85 -134.11 110.0 9.31 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.735 179.963 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.413 ' C ' ' CD2' ' A' ' 63' ' ' LEU . 2.2 tt -104.37 -82.39 0.51 Allowed 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 115.698 -0.683 . . . . 0.0 109.346 179.513 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -79.43 179.18 53.23 Favored Glycine 0 CA--C 1.523 0.535 0 N-CA-C 109.343 -1.503 . . . . 0.0 109.343 178.561 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 1.6 mt -73.58 -34.5 65.14 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 119.767 -0.773 . . . . 0.0 110.426 -179.463 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -99.96 9.23 43.27 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.954 179.908 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 9.6 t -106.35 96.04 4.29 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.228 0 CA-C-O 121.168 0.509 . . . . 0.0 111.96 -178.616 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 1.2 tp -114.97 118.06 32.38 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 178.216 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 3.1 mt -112.46 146.15 17.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-O 120.846 0.355 . . . . 0.0 111.791 -178.193 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.482 ' NH2' ' OD2' ' A' ' 91' ' ' ASP . 33.8 ptt180 -128.04 132.23 49.1 Favored 'General case' 0 C--O 1.237 0.444 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.053 179.254 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -143.95 150.18 37.94 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.341 -0.845 . . . . 0.0 110.26 -179.965 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -106.33 126.81 52.7 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 178.332 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.556 ' C ' HE21 ' A' ' 88' ' ' GLN . 10.5 pt -134.75 158.97 41.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 C-N-CA 119.77 -0.772 . . . . 0.0 113.01 -177.521 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' SER . . . . . 0.579 ' OG ' ' NE2' ' A' ' 88' ' ' GLN . 0.5 OUTLIER -122.77 155.87 35.64 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 115.048 -0.978 . . . . 0.0 110.172 179.209 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -65.66 119.23 10.78 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.311 -179.902 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -96.98 -40.75 8.73 Favored 'General case' 0 C--N 1.331 -0.203 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 177.648 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' TRP . . . . . 0.557 ' NE1' ' HA3' ' A' ' 84' ' ' GLY . 68.1 p-90 -171.28 169.3 6.4 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.517 -0.765 . . . . 0.0 109.809 179.8 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -149.43 123.79 9.62 Favored 'General case' 0 N--CA 1.464 0.245 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 178.728 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 26.7 ttt180 -152.35 134.36 14.91 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 119.706 -0.798 . . . . 0.0 113.017 179.791 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . 0.515 ' O ' ' OD1' ' A' ' 80' ' ' ASP . 11.8 t0 57.07 47.51 17.27 Favored 'General case' 0 N--CA 1.463 0.18 0 N-CA-C 113.861 1.06 . . . . 0.0 113.861 176.702 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 82.54 -27.61 3.68 Favored Glycine 0 CA--C 1.523 0.548 0 C-N-CA 120.356 -0.926 . . . . 0.0 113.491 177.121 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 4.7 mt -89.62 157.19 18.13 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 117.756 0.778 . . . . 0.0 110.285 -179.156 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 26.3 mt -128.22 135.43 49.69 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.0 -179.077 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . 0.557 ' HA3' ' NE1' ' A' ' 77' ' ' TRP . . . -98.39 152.52 19.8 Favored Glycine 0 N--CA 1.45 -0.378 0 N-CA-C 109.65 -1.38 . . . . 0.0 109.65 178.734 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 22.4 m-85 -145.66 135.31 23.32 Favored 'General case' 0 C--N 1.317 -0.819 0 C-N-CA 120.642 -0.423 . . . . 0.0 110.913 -179.199 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -104.26 126.22 51.18 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 178.843 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 2.2 t -69.13 122.39 18.68 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.956 0.407 . . . . 0.0 111.679 -178.451 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . 0.579 ' NE2' ' OG ' ' A' ' 74' ' ' SER . 24.3 mt-30 -96.17 -33.52 12.01 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.18 179.411 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . 0.5 ' ND1' ' C ' ' A' ' 89' ' ' HIS . 0.0 OUTLIER -162.99 142.54 8.89 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.394 -179.905 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 6.2 tt -145.21 141.08 22.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-N 115.856 -0.611 . . . . 0.0 109.695 -179.844 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . 0.483 ' OD1' ' N ' ' A' ' 93' ' ' ASP . 7.0 t70 -56.6 145.72 27.52 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 115.54 -0.755 . . . . 0.0 111.807 -178.109 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.435 ' N ' ' OD1' ' A' ' 91' ' ' ASP . 48.5 tp -54.24 -42.21 69.63 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 115.272 -0.877 . . . . 0.0 110.446 -179.144 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . 0.483 ' N ' ' OD1' ' A' ' 91' ' ' ASP . 1.3 m-20 -70.16 -33.07 71.32 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 179.523 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 13.3 m -69.06 -37.81 78.73 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.838 -0.619 . . . . 0.0 109.84 179.309 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 56.6 mt -58.87 -38.12 70.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.19 179.623 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -70.6 -42.06 71.5 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.421 -0.512 . . . . 0.0 111.364 -178.538 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 60.9 m-70 -61.74 -35.78 79.09 Favored 'General case' 0 C--N 1.324 -0.53 0 C-N-CA 119.143 -1.023 . . . . 0.0 109.126 179.51 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 6.0 mp -67.49 -34.86 78.02 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 177.41 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 58.3 mtp180 -66.25 -39.43 89.5 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 108.671 -0.863 . . . . 0.0 108.671 177.877 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 29.7 mmt-85 -60.15 -42.95 95.99 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.116 -0.947 . . . . 0.0 110.663 178.864 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.434 ' O ' ' OD1' ' A' ' 105' ' ' ASN . 5.6 mt -61.14 -36.34 79.51 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 -179.765 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 90.3 t -68.73 -44.86 81.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.258 179.793 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 66.2 mt-10 -65.33 -45.55 83.78 Favored 'General case' 0 N--CA 1.464 0.243 0 N-CA-C 112.261 0.467 . . . . 0.0 112.261 -178.595 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.507 ' O ' ' N ' ' A' ' 108' ' ' ASP . 6.4 mp -72.52 -41.22 66.12 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 120.872 -0.331 . . . . 0.0 111.453 -179.231 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . 0.434 ' OD1' ' O ' ' A' ' 101' ' ' LEU . 9.9 m120 -57.75 -25.79 60.95 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 120.658 -0.417 . . . . 0.0 110.201 179.909 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 1.6 tp -56.55 -18.87 13.16 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.572 -179.89 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . 0.568 ' O ' ' N ' ' A' ' 109' ' ' GLU . . . -148.5 -45.07 0.03 OUTLIER Glycine 0 CA--C 1.524 0.627 0 C-N-CA 120.865 -0.683 . . . . 0.0 111.568 -179.695 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . 0.507 ' N ' ' O ' ' A' ' 104' ' ' LEU . 7.8 m-20 -60.38 71.83 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.816 0.341 . . . . 0.0 110.496 -179.772 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . 0.568 ' N ' ' O ' ' A' ' 107' ' ' GLY . 2.7 tp10 -171.93 150.56 2.6 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.36 -179.736 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 23.5 mt-10 -62.17 -117.43 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.296 179.863 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . 0.52 ' CD1' ' N ' ' A' ' 111' ' ' LEU . 8.2 mp -67.6 -139.8 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.811 -0.44 . . . . 0.0 109.811 179.643 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.441 ' H ' ' HB3' ' A' ' 111' ' ' LEU . 1.2 mp 56.4 40.16 29.79 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.664 0.268 . . . . 0.0 111.051 179.681 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -144.79 92.64 2.3 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.887 0.375 . . . . 0.0 110.408 179.797 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -173.09 122.32 0.39 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.595 179.976 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 75.5 mm-40 -48.81 -36.2 16.18 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.226 179.732 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.486 ' O ' ' CG2' ' A' ' 120' ' ' VAL . 9.9 mp -53.86 -44.86 70.74 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.355 179.539 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -66.18 -51.68 55.47 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.897 0.38 . . . . 0.0 111.282 179.888 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 15.1 mt -58.48 -49.02 78.85 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.987 -0.551 . . . . 0.0 112.458 -177.974 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . 0.516 ' O ' ' O ' ' A' ' 122' ' ' ALA . 0.7 OUTLIER -72.77 -49.36 31.26 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 120.008 -0.677 . . . . 0.0 111.567 -178.705 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . 0.486 ' CG2' ' O ' ' A' ' 116' ' ' LEU . 87.8 t -56.76 -12.56 1.27 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 C-N-CA 120.162 -0.615 . . . . 0.0 111.136 -176.19 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 121' ' ' SER . . . . . 0.484 ' O ' ' OG ' ' A' ' 121' ' ' SER . 1.8 t -88.51 18.48 4.53 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 178.185 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . 0.516 ' O ' ' O ' ' A' ' 119' ' ' LEU . . . 170.79 -170.66 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 115.431 -0.804 . . . . 0.0 109.695 179.86 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . 0.775 ' O ' ' N ' ' A' ' 125' ' ' ASP . 4.8 p80 -175.86 -173.1 0.57 Allowed 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.72 -0.392 . . . . 0.0 111.017 179.245 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . 0.656 ' O ' ' CB ' ' A' ' 125' ' ' ASP . 0.5 OUTLIER -30.38 -17.47 0.0 OUTLIER 'General case' 0 CA--C 1.531 0.214 0 N-CA-C 113.275 0.843 . . . . 0.0 113.275 -179.428 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 125' ' ' ASP . . . . . 0.775 ' N ' ' O ' ' A' ' 123' ' ' HIS . 25.1 t70 . . . . . 0 N--CA 1.472 0.654 0 CA-C-O 118.113 -0.946 . . . . 0.0 110.08 179.9 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 501' ' ' C2E . . . . . 0.939 ' O21' " H4'" ' A' ' 501' ' ' C2E . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 502' ' ' C2E . . . . . 0.633 ' C61' ' H ' ' A' ' 8' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.615 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 8.5 t -148.81 21.09 1.01 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.778 -179.748 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 51.2 m-20 -98.75 -7.26 27.94 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.084 0.468 . . . . 0.0 110.252 179.31 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . 0.738 HE21 ' H ' ' A' ' 4' ' ' GLN . 0.0 OUTLIER -112.89 15.13 19.84 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.889 -179.093 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . 0.694 ' CD2' ' O ' ' A' ' 4' ' ' GLN . 0.0 OUTLIER 50.89 17.7 0.45 Allowed 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 108.046 -1.094 . . . . 0.0 108.046 -177.365 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . 0.667 ' H ' ' NE2' ' A' ' 4' ' ' GLN . 13.3 m-20 48.12 82.32 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 114.742 -1.117 . . . . 0.0 110.443 -179.355 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.409 ' HA ' ' C51' ' A' ' 502' ' ' C2E . 8.7 tt0 -83.72 119.69 25.11 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 179.074 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.61 ' NH2' ' N11' ' A' ' 501' ' ' C2E . 0.0 OUTLIER -126.14 21.96 7.32 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.489 -178.515 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.657 ' NH1' ' NE ' ' A' ' 13' ' ' ARG . 8.9 mtt180 -124.98 113.79 18.28 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 120.405 -0.518 . . . . 0.0 111.219 -179.14 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.678 ' CD ' ' H ' ' A' ' 11' ' ' PHE . 0.0 OUTLIER -30.19 -64.8 0.12 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.414 -0.812 . . . . 0.0 110.988 179.717 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . 0.678 ' H ' ' CD ' ' A' ' 10' ' ' ARG . 26.9 m-85 -111.83 170.91 7.82 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-O 120.97 0.414 . . . . 0.0 111.03 -179.622 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . 0.675 ' H ' ' CD2' ' A' ' 12' ' ' HIS . 0.3 OUTLIER -81.68 156.65 24.95 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.483 179.959 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.657 ' NE ' ' NH1' ' A' ' 9' ' ' ARG . 0.1 OUTLIER -102.9 145.46 29.78 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-O 120.995 0.426 . . . . 0.0 110.845 -179.899 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.598 ' CD1' ' N ' ' A' ' 14' ' ' ILE . 1.2 mp -82.52 102.21 8.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 179.162 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -94.96 120.25 34.86 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.582 0.706 . . . . 0.0 112.035 -178.924 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 2.5 p90 -149.77 158.79 44.5 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 114.686 -1.143 . . . . 0.0 107.959 177.605 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -95.26 147.11 23.83 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 119.981 -0.688 . . . . 0.0 110.574 -178.963 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -179.67 178.48 0.64 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.902 -0.59 . . . . 0.0 109.763 179.915 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -96.55 134.04 40.26 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 120.786 -0.365 . . . . 0.0 110.976 179.987 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.583 ' O ' ' O ' ' A' ' 31' ' ' VAL . 7.6 p -135.78 157.04 47.84 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.18 179.044 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.406 ' C ' ' OE1' ' A' ' 21' ' ' GLU . 0.8 OUTLIER -144.74 144.38 31.16 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.122 -0.696 . . . . 0.0 109.122 178.702 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 1.2 mm -119.24 136.75 55.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-O 121.133 0.492 . . . . 0.0 111.591 -177.995 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -121.63 123.15 41.24 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.617 -0.72 . . . . 0.0 111.017 -179.882 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.466 ' O ' ' OE1' ' A' ' 24' ' ' GLN . 1.4 tm0? -130.34 102.39 6.17 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.096 179.342 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 80.07 -126.06 7.24 Favored Glycine 0 CA--C 1.523 0.564 0 N-CA-C 109.821 -1.312 . . . . 0.0 109.821 -178.707 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -100.19 11.87 38.36 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 179.151 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.46 ' HB3' ' CZ2' ' A' ' 29' ' ' TRP . 2.2 mtt180 -112.74 131.25 55.76 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.846 -0.615 . . . . 0.0 112.364 -177.267 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.435 HH11 ' HD3' ' A' ' 28' ' ' ARG . 36.4 ttt180 -126.24 148.47 49.47 Favored 'General case' 0 CA--C 1.519 -0.238 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.783 178.875 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.53 ' NE1' ' O ' ' A' ' 48' ' ' ASP . 7.1 m-90 -147.47 156.44 42.85 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.459 -178.894 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.504 ' N ' ' CD ' ' A' ' 30' ' ' GLU . 3.1 mp0 -102.4 140.89 36.08 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.162 -0.472 . . . . 0.0 109.9 179.58 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.583 ' O ' ' O ' ' A' ' 20' ' ' SER . 12.4 m -150.25 157.25 6.16 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-O 121.159 0.504 . . . . 0.0 110.904 -179.697 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.496 HD12 ' N ' ' A' ' 33' ' ' LEU . 6.7 tp -94.23 128.54 40.74 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 107.475 -1.306 . . . . 0.0 107.475 178.144 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.496 ' N ' HD12 ' A' ' 32' ' ' LEU . 0.4 OUTLIER -90.22 126.01 35.68 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.57 -0.53 . . . . 0.0 109.57 -179.727 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 40.0 m-70 -93.06 -28.64 16.24 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.558 -0.747 . . . . 0.0 111.962 -178.218 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 2.0 p-10 -172.75 158.76 4.08 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 119.483 -0.887 . . . . 0.0 110.862 177.418 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 7.1 p -143.54 169.27 11.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.494 -0.775 . . . . 0.0 110.878 -178.904 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 17.1 t -140.91 170.72 15.2 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 178.814 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 1.1 pp -67.4 -0.11 3.39 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 119.976 -0.689 . . . . 0.0 111.11 -179.397 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . 0.514 ' NE2' ' O ' ' A' ' 87' ' ' CYS . 1.6 t60 -162.22 35.12 0.12 Allowed 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 120.73 -0.388 . . . . 0.0 111.217 179.776 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . 0.498 ' HA3' ' N3 ' ' A' ' 501' ' ' C2E . . . -171.66 156.06 25.23 Favored Glycine 0 CA--C 1.526 0.731 0 N-CA-C 110.759 -0.936 . . . . 0.0 110.759 179.903 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -148.03 150.37 14.43 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 CA-C-O 121.597 0.713 . . . . 0.0 112.606 -178.839 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -123.0 140.51 52.96 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 114.665 -1.152 . . . . 0.0 109.191 178.849 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 10.6 m -145.58 174.99 2.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-O 121.091 0.472 . . . . 0.0 111.092 179.95 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -96.96 145.38 17.84 Favored Glycine 0 CA--C 1.526 0.775 0 N-CA-C 109.47 -1.452 . . . . 0.0 109.47 178.237 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 45.2 tt0 -86.6 115.63 62.99 Favored Pre-proline 0 N--CA 1.462 0.154 0 CA-C-N 117.732 0.766 . . . . 0.0 111.79 -178.538 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 66.4 Cg_endo -85.13 161.33 11.53 Favored 'Trans proline' 0 C--N 1.306 -1.67 0 C-N-CA 121.569 1.513 . . . . 0.0 111.134 178.856 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 58.7 mt-30 -65.17 -40.14 93.89 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 112.128 0.418 . . . . 0.0 112.128 -178.885 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . 0.562 ' O ' ' N ' ' A' ' 50' ' ' ASN . 0.9 OUTLIER -72.21 8.63 1.24 Allowed 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 111.85 0.315 . . . . 0.0 111.85 -178.794 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' TRP . . . . . 0.486 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 64.9 t-105 -59.57 67.17 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 111.825 0.305 . . . . 0.0 111.825 -179.738 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . 0.562 ' N ' ' O ' ' A' ' 48' ' ' ASP . 0.2 OUTLIER -93.33 78.34 4.47 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 120.159 -0.616 . . . . 0.0 109.59 178.325 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -144.58 144.34 13.18 Favored Glycine 0 CA--C 1.523 0.533 0 N-CA-C 111.17 -0.772 . . . . 0.0 111.17 -179.38 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 23.0 t0 -77.94 113.33 31.94 Favored Pre-proline 0 CA--C 1.533 0.318 0 CA-C-N 115.878 -0.161 . . . . 0.0 111.102 -179.709 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -50.07 -22.63 8.12 Favored 'Trans proline' 0 N--CA 1.495 1.584 0 C-N-CA 122.522 2.148 . . . . 0.0 112.673 179.578 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 16.7 mm100 -77.51 -23.99 50.12 Favored 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 120.642 -0.423 . . . . 0.0 111.769 -178.853 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.575 ' O ' ' CE1' ' A' ' 57' ' ' PHE . 66.8 mtm180 -92.94 151.04 40.34 Favored Pre-proline 0 C--N 1.33 -0.252 0 C-N-CA 120.671 -0.412 . . . . 0.0 110.077 179.741 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -62.94 160.73 32.32 Favored 'Trans proline' 0 N--CA 1.495 1.596 0 C-N-CA 122.834 2.356 . . . . 0.0 113.436 -178.701 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . 0.575 ' CE1' ' O ' ' A' ' 55' ' ' ARG . 41.6 m-85 -130.59 155.18 46.97 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 114.897 -1.047 . . . . 0.0 109.147 179.343 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 14.3 mt-10 -123.06 139.07 54.46 Favored 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 178.777 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -118.66 135.93 54.2 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 112.501 0.556 . . . . 0.0 112.501 -177.772 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 2.1 mmt85 -122.74 127.67 49.5 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 108.261 -1.014 . . . . 0.0 108.261 177.107 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.429 ' CD1' ' N ' ' A' ' 61' ' ' LEU . 7.9 mp -111.48 151.22 28.85 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 120.67 -0.412 . . . . 0.0 111.241 -178.558 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 9.8 m-85 -131.76 110.09 10.61 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.625 179.446 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.423 ' C ' ' CD2' ' A' ' 63' ' ' LEU . 2.0 tt -103.78 -85.43 0.46 Allowed 'General case' 0 C--N 1.333 -0.143 0 N-CA-C 108.991 -0.744 . . . . 0.0 108.991 178.968 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . 0.411 ' H ' ' HB3' ' A' ' 63' ' ' LEU . . . -75.28 179.84 45.1 Favored Glycine 0 CA--C 1.522 0.508 0 N-CA-C 109.017 -1.633 . . . . 0.0 109.017 178.338 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.565 ' CD2' ' N ' ' A' ' 65' ' ' LEU . 2.5 mm? -74.42 -32.44 62.66 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 119.709 -0.796 . . . . 0.0 110.232 -179.479 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 24.7 m-20 -102.53 9.27 39.59 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 122.734 0.414 . . . . 0.0 111.063 -179.827 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 8.5 t -103.22 93.76 2.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-O 121.34 0.59 . . . . 0.0 111.667 -178.905 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 4.4 tp -109.99 117.66 34.37 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 178.272 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 6.3 mt -115.78 143.99 24.45 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.278 0 CA-C-O 120.982 0.42 . . . . 0.0 111.374 -178.88 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.502 ' NH2' ' OD2' ' A' ' 91' ' ' ASP . 28.5 ptt-85 -128.38 130.73 48.13 Favored 'General case' 0 C--O 1.237 0.441 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.007 179.223 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 1.5 mtm -139.95 148.19 41.58 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 115.934 -0.576 . . . . 0.0 109.691 179.453 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -101.97 132.68 47.65 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 107.87 -1.159 . . . . 0.0 107.87 178.718 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.488 ' O ' ' O ' ' A' ' 57' ' ' PHE . 4.1 pt -142.7 157.41 18.5 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 C-N-CA 119.44 -0.904 . . . . 0.0 112.977 -177.666 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' SER . . . . . 0.624 ' N ' HE22 ' A' ' 88' ' ' GLN . 3.3 t -121.91 155.45 35.42 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 115.47 -0.786 . . . . 0.0 109.763 179.032 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -65.02 118.43 9.11 Favored 'General case' 0 CA--C 1.521 -0.162 0 CA-C-O 121.161 0.505 . . . . 0.0 110.603 -178.575 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -97.22 -40.99 8.51 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.064 177.446 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' TRP . . . . . 0.595 ' CD1' ' C2 ' ' A' ' 502' ' ' C2E . 68.8 p-90 -170.42 169.76 7.33 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.79 -179.819 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -151.07 123.99 8.65 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 116.299 -0.409 . . . . 0.0 109.948 178.658 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -152.04 132.03 13.42 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 120.043 -0.663 . . . . 0.0 112.364 179.593 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 55.67 47.19 21.14 Favored 'General case' 0 N--CA 1.465 0.287 0 N-CA-C 113.089 0.774 . . . . 0.0 113.089 176.85 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 68.17 12.67 63.44 Favored Glycine 0 CA--C 1.523 0.547 0 C-N-CA 120.343 -0.932 . . . . 0.0 111.902 178.385 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 29.1 mt -115.74 136.13 53.36 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 108.474 -0.935 . . . . 0.0 108.474 178.488 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 37.6 mt -124.48 136.41 53.99 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.497 -178.928 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . 0.471 ' HA3' ' NE1' ' A' ' 77' ' ' TRP . . . -123.36 134.58 9.49 Favored Glycine 0 CA--C 1.519 0.337 0 N-CA-C 109.481 -1.448 . . . . 0.0 109.481 178.551 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 26.0 m-85 -122.65 157.78 31.46 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.964 0.412 . . . . 0.0 110.096 -179.805 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -104.8 130.55 52.89 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 178.314 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . 0.514 ' O ' ' NE2' ' A' ' 39' ' ' HIS . 44.5 t -74.78 124.23 26.42 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.826 0.346 . . . . 0.0 111.336 -178.976 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . 0.624 HE22 ' N ' ' A' ' 74' ' ' SER . 0.0 OUTLIER -100.73 -31.2 11.31 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.458 179.598 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . 0.611 ' ND1' ' N ' ' A' ' 90' ' ' ILE . 0.0 OUTLIER -159.2 141.0 13.4 Favored 'General case' 0 C--O 1.225 -0.203 0 CA-C-O 120.909 0.385 . . . . 0.0 110.08 179.283 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . 0.611 ' N ' ' ND1' ' A' ' 89' ' ' HIS . 7.7 tt -145.31 140.51 22.47 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-O 121.438 0.637 . . . . 0.0 110.15 -178.947 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . 0.502 ' OD2' ' NH2' ' A' ' 70' ' ' ARG . 0.1 OUTLIER -55.02 140.85 36.34 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 115.033 -0.985 . . . . 0.0 112.334 -178.058 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 6.6 tp -54.56 -42.62 71.21 Favored 'General case' 0 N--CA 1.462 0.136 0 CA-C-N 115.075 -0.966 . . . . 0.0 110.321 -179.642 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . 0.414 ' OD1' ' N ' ' A' ' 94' ' ' SER . 0.5 OUTLIER -71.93 -35.8 69.75 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 179.557 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' SER . . . . . 0.414 ' N ' ' OD1' ' A' ' 93' ' ' ASP . 1.5 t -64.53 -38.26 90.39 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.427 179.078 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 22.0 mt -59.01 -37.49 68.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.372 179.133 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -70.19 -40.12 74.83 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.096 -0.641 . . . . 0.0 110.612 -178.938 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 59.7 m-70 -63.08 -37.07 85.76 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 119.475 -0.89 . . . . 0.0 109.097 179.315 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -67.52 -37.5 82.85 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 178.131 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 48.7 mtp85 -66.35 -38.52 87.8 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 178.402 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 23.0 mmt180 -57.15 -39.9 76.14 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.32 178.098 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 5.4 mp -69.6 -36.75 76.49 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.359 -0.837 . . . . 0.0 110.183 -179.797 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 87.8 t -68.4 -46.67 80.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.62 179.851 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 94.2 mt-10 -65.16 -42.22 93.94 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.031 -179.667 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 44.8 mt -69.37 -40.43 77.46 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.813 -0.355 . . . . 0.0 110.684 -179.485 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -58.14 -48.98 78.58 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.692 -0.403 . . . . 0.0 110.132 179.832 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 4.8 mp -55.73 -39.92 71.76 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.191 179.96 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . 0.51 ' O ' ' N ' ' A' ' 109' ' ' GLU . . . 64.66 85.56 0.07 OUTLIER Glycine 0 CA--C 1.523 0.556 0 N-CA-C 110.616 -0.994 . . . . 0.0 110.616 -179.954 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -65.17 57.01 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.762 0.315 . . . . 0.0 110.494 -179.838 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . 0.51 ' N ' ' O ' ' A' ' 107' ' ' GLY . 0.0 OUTLIER -71.75 79.5 0.85 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.495 -179.991 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 61.26 -155.29 0.36 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.053 179.87 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 4.8 tt -41.75 138.57 1.4 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.861 -179.635 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 8.0 tp -162.5 67.63 0.23 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.308 179.877 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 16.0 mm-40 -111.25 126.17 54.59 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.88 -179.667 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . 0.582 ' C ' ' H ' ' A' ' 116' ' ' LEU . 3.1 tpt180 -175.52 -84.34 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.193 179.845 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 2.4 pt-20 -71.54 18.71 0.07 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.133 179.738 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.582 ' H ' ' C ' ' A' ' 114' ' ' ARG . 6.2 tp -66.77 -40.09 88.1 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.72 -0.673 . . . . 0.0 112.167 -179.134 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 117' ' ' ALA . . . . . 0.47 ' O ' ' CG2' ' A' ' 120' ' ' VAL . . . -68.83 -22.45 64.24 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 111.7 0.259 . . . . 0.0 111.7 -179.554 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 72.7 mt -53.26 -31.04 41.61 Favored 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 120.6 -0.44 . . . . 0.0 110.627 -178.508 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . 0.531 ' CD2' ' N ' ' A' ' 119' ' ' LEU . 1.4 mm? -58.99 -27.92 65.87 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 177.927 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . 0.47 ' CG2' ' O ' ' A' ' 117' ' ' ALA . 43.0 t -59.15 -46.81 91.78 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.169 0 CA-C-N 115.37 -0.832 . . . . 0.0 111.565 179.662 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 121' ' ' SER . . . . . 0.549 ' C ' ' H ' ' A' ' 123' ' ' HIS . 1.2 t -89.24 -30.73 18.3 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.743 -178.466 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -73.31 19.68 0.09 Allowed 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.157 -0.617 . . . . 0.0 110.583 -179.225 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . 0.654 ' CD2' ' N ' ' A' ' 124' ' ' ASP . 0.1 OUTLIER -106.6 -44.55 4.45 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.357 179.941 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . 0.654 ' N ' ' CD2' ' A' ' 123' ' ' HIS . 10.1 t0 -121.71 -27.01 4.78 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.828 -179.85 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 125' ' ' ASP . . . . . 0.461 ' O ' ' O ' ' A' ' 121' ' ' SER . 0.2 OUTLIER . . . . . 0 C--O 1.22 -0.471 0 CA-C-O 118.152 -0.928 . . . . 0.0 110.593 -179.593 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 501' ' ' C2E . . . . . 1.066 ' O21' " H4'" ' A' ' 501' ' ' C2E . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 502' ' ' C2E . . . . . 0.595 ' C2 ' ' CD1' ' A' ' 77' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.416 ' N ' ' SD ' ' A' ' 1' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.583 0 N-CA-C 109.408 -0.59 . . . . 0.0 109.408 . . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 51.6 p -119.44 65.32 0.79 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.356 179.74 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 18.1 p-10 -99.08 29.69 3.76 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.547 179.64 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . 0.549 HE22 ' N ' ' A' ' 6' ' ' ASP . 0.4 OUTLIER -111.95 12.91 20.79 Favored 'General case' 0 N--CA 1.462 0.161 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.793 -179.871 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . 0.544 ' CG ' ' O4A' ' A' ' 502' ' ' C2E . 0.0 OUTLIER 46.43 102.42 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.053 179.764 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . 0.549 ' N ' HE22 ' A' ' 4' ' ' GLN . 6.0 m-20 -52.38 158.52 1.19 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.205 179.39 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.514 ' N ' ' OE1' ' A' ' 7' ' ' GLU . 16.0 pm0 -91.81 134.75 34.47 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-O 121.089 0.471 . . . . 0.0 110.798 -179.821 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.709 HH21 ' C21' ' A' ' 501' ' ' C2E . 0.0 OUTLIER -122.47 -8.03 8.61 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.254 -178.962 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.619 ' CD ' HH11 ' A' ' 13' ' ' ARG . 1.2 ptt85 -111.73 93.07 4.28 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-O 120.917 0.389 . . . . 0.0 110.184 179.946 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.622 ' NH2' ' HE2' ' A' ' 39' ' ' HIS . 0.0 OUTLIER 17.26 -82.55 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 115.363 -0.835 . . . . 0.0 111.672 -179.775 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . 0.563 ' N ' ' O ' ' A' ' 9' ' ' ARG . 0.9 OUTLIER -127.83 156.73 42.07 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-O 120.816 0.341 . . . . 0.0 110.332 -179.642 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . 0.521 ' O ' ' CD2' ' A' ' 12' ' ' HIS . 0.5 OUTLIER -51.06 135.17 25.6 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.608 -179.888 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.619 HH11 ' CD ' ' A' ' 9' ' ' ARG . 15.6 mtm-85 -76.68 160.65 29.18 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.783 -179.72 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.577 ' CD1' ' N ' ' A' ' 14' ' ' ILE . 1.5 mp -73.31 95.93 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.762 179.745 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -95.5 120.68 36.17 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.307 0.575 . . . . 0.0 112.497 -178.806 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 28.9 p90 -149.74 158.71 44.43 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.009 -0.996 . . . . 0.0 108.316 177.199 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -95.42 147.59 23.37 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 120.152 -0.619 . . . . 0.0 110.74 -179.174 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . 179.27 176.79 0.58 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.097 179.879 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -96.26 134.16 39.71 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.946 -179.927 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.492 ' O ' ' O ' ' A' ' 31' ' ' VAL . 11.7 p -134.44 153.37 51.95 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.925 0.393 . . . . 0.0 110.375 178.952 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 68.6 mt-10 -133.49 140.02 47.0 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 109.136 -0.69 . . . . 0.0 109.136 179.437 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -119.9 135.77 59.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-O 121.311 0.577 . . . . 0.0 110.639 -179.47 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -123.71 123.26 40.14 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.407 -0.815 . . . . 0.0 111.113 -179.075 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.496 ' OE1' ' NH1' ' A' ' 27' ' ' ARG . 1.5 tm0? -129.62 102.09 6.21 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.377 -0.828 . . . . 0.0 110.042 179.079 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 81.06 -126.44 7.38 Favored Glycine 0 CA--C 1.523 0.549 0 N-CA-C 109.961 -1.256 . . . . 0.0 109.961 -178.87 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 14.7 pt-20 -100.18 11.66 38.83 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 179.269 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.496 ' NH1' ' OE1' ' A' ' 24' ' ' GLN . 0.2 OUTLIER -114.51 133.07 56.05 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.604 -0.726 . . . . 0.0 112.607 -176.443 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.433 ' O ' ' CD1' ' A' ' 29' ' ' TRP . 41.8 ttt-85 -128.12 153.0 47.33 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.334 179.555 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.433 ' CD1' ' O ' ' A' ' 28' ' ' ARG . 6.3 m-90 -150.51 156.48 41.5 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.276 -0.875 . . . . 0.0 110.501 -179.41 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.453 ' N ' ' CD ' ' A' ' 30' ' ' GLU . 4.7 mp0 -100.72 138.59 37.57 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.692 -0.485 . . . . 0.0 109.692 179.462 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.492 ' O ' ' O ' ' A' ' 20' ' ' SER . 18.4 m -148.34 158.69 7.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 121.232 0.539 . . . . 0.0 111.357 -179.241 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 15.9 tp -96.52 128.16 43.19 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 108.392 -0.966 . . . . 0.0 108.392 178.732 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -91.08 125.85 35.99 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.249 0.547 . . . . 0.0 110.061 -179.885 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 72.2 m-70 -92.1 -28.24 17.24 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.308 -0.86 . . . . 0.0 111.76 -178.809 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . 0.574 ' CG ' HH21 ' A' ' 13' ' ' ARG . 3.6 p30 -173.78 162.47 4.02 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 119.409 -0.916 . . . . 0.0 111.449 177.677 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 3.3 p -145.35 168.84 7.93 Favored 'Isoleucine or valine' 0 C--O 1.231 0.124 0 CA-C-N 115.564 -0.744 . . . . 0.0 111.098 -179.063 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' SER . . . . . 0.506 ' CB ' HN22 ' A' ' 501' ' ' C2E . 30.1 t -140.99 169.32 17.84 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 107.93 -1.137 . . . . 0.0 107.93 178.694 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.404 ' CD1' ' H ' ' A' ' 38' ' ' LEU . 5.9 mp -64.65 0.21 1.19 Allowed 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 119.44 -0.904 . . . . 0.0 110.241 -179.256 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . 0.622 ' HE2' ' NH2' ' A' ' 10' ' ' ARG . 32.9 p-80 -163.36 43.81 0.11 Allowed 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 120.633 -0.427 . . . . 0.0 111.581 179.995 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . 0.522 ' HA3' ' N3 ' ' A' ' 501' ' ' C2E . . . 178.78 158.18 20.79 Favored Glycine 0 CA--C 1.53 0.977 0 C-N-CA 120.716 -0.754 . . . . 0.0 111.525 179.784 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -149.34 149.19 15.01 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.352 0 CA-C-O 121.364 0.602 . . . . 0.0 111.751 -178.759 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.432 HD23 ' N ' ' A' ' 43' ' ' VAL . 1.1 tt -121.88 127.75 50.82 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 114.93 -1.032 . . . . 0.0 108.442 178.325 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.432 ' N ' HD23 ' A' ' 42' ' ' LEU . 23.2 m -130.9 174.72 12.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-O 121.3 0.571 . . . . 0.0 111.543 -179.028 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -96.81 144.15 17.16 Favored Glycine 0 CA--C 1.526 0.774 0 N-CA-C 109.164 -1.574 . . . . 0.0 109.164 178.062 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . 0.523 HE21 ' C ' ' A' ' 45' ' ' GLN . 0.0 OUTLIER -85.4 115.49 61.59 Favored Pre-proline 0 N--CA 1.464 0.239 0 CA-C-N 117.995 0.897 . . . . 0.0 111.713 -178.633 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 78.2 Cg_endo -85.47 160.63 11.01 Favored 'Trans proline' 0 C--N 1.307 -1.616 0 C-N-CA 121.685 1.59 . . . . 0.0 111.259 178.923 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 16.5 pt20 -65.43 -30.59 71.4 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.127 0.417 . . . . 0.0 112.127 -179.106 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . 0.543 ' O ' ' N ' ' A' ' 50' ' ' ASN . 40.7 m-20 -80.5 8.45 7.72 Favored 'General case' 0 N--CA 1.465 0.278 0 N-CA-C 111.957 0.355 . . . . 0.0 111.957 -178.699 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' TRP . . . . . 0.441 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 61.8 t-105 -60.1 66.75 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 112.089 0.403 . . . . 0.0 112.089 -179.389 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . 0.543 ' N ' ' O ' ' A' ' 48' ' ' ASP . 0.2 OUTLIER -93.25 78.9 4.48 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 120.002 -0.679 . . . . 0.0 109.555 178.386 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -143.9 160.27 27.73 Favored Glycine 0 CA--C 1.523 0.535 0 N-CA-C 111.098 -0.801 . . . . 0.0 111.098 -179.45 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -95.03 109.22 43.18 Favored Pre-proline 0 CA--C 1.534 0.358 0 CA-C-N 115.63 -0.285 . . . . 0.0 110.694 -179.756 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -48.68 -22.53 4.56 Favored 'Trans proline' 0 N--CA 1.494 1.51 0 C-N-CA 122.391 2.061 . . . . 0.0 112.549 179.831 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 8.2 mt-30 -75.71 -24.02 56.18 Favored 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 120.497 -0.481 . . . . 0.0 111.413 -179.13 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.518 ' O ' ' CE1' ' A' ' 57' ' ' PHE . 21.7 mtm180 -94.77 155.79 38.92 Favored Pre-proline 0 C--N 1.33 -0.242 0 C-N-CA 120.838 -0.345 . . . . 0.0 110.085 179.777 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -67.05 160.8 45.61 Favored 'Trans proline' 0 C--N 1.308 -1.569 0 C-N-CA 122.753 2.302 . . . . 0.0 112.935 -179.063 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . 0.518 ' CE1' ' O ' ' A' ' 55' ' ' ARG . 58.8 m-85 -130.53 156.0 45.54 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.142 -0.936 . . . . 0.0 108.953 179.418 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -122.5 138.61 54.5 Favored 'General case' 0 C--O 1.221 -0.434 0 N-CA-C 109.063 -0.717 . . . . 0.0 109.063 178.483 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -119.86 138.3 53.48 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 112.463 0.542 . . . . 0.0 112.463 -177.876 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.505 ' CZ ' ' OH ' ' A' ' 62' ' ' TYR . 31.3 mtm180 -123.92 127.68 48.34 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 177.681 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 11.2 mp -108.73 151.16 26.57 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.0 0.429 . . . . 0.0 111.053 -178.798 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' TYR . . . . . 0.505 ' OH ' ' CZ ' ' A' ' 60' ' ' ARG . 36.8 m-85 -133.42 108.6 8.77 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.29 179.539 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.446 ' CD1' ' N ' ' A' ' 63' ' ' LEU . 8.8 mp -104.47 -90.11 0.4 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.165 179.436 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -70.12 177.23 32.45 Favored Glycine 0 CA--C 1.523 0.538 0 N-CA-C 109.166 -1.574 . . . . 0.0 109.166 178.304 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.493 ' H ' ' CD1' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -73.21 -32.61 64.88 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 119.824 -0.75 . . . . 0.0 110.219 -179.544 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -102.42 9.65 39.55 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 122.846 0.459 . . . . 0.0 111.251 -179.763 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 34.3 t -106.03 96.51 4.67 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.378 0 CA-C-O 121.441 0.639 . . . . 0.0 111.997 -178.747 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 6.5 tp -113.22 117.61 32.36 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.078 -0.965 . . . . 0.0 108.421 178.514 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . 0.4 HG22 ' N ' ' A' ' 70' ' ' ARG . 3.7 mt -114.16 145.19 20.31 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-O 120.933 0.397 . . . . 0.0 111.56 -178.707 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.4 ' N ' HG22 ' A' ' 69' ' ' ILE . 6.9 ptm180 -128.01 135.47 49.93 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.801 179.018 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -146.33 149.54 34.0 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.426 -179.597 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -102.96 135.62 44.29 Favored 'General case' 0 N--CA 1.463 0.184 0 N-CA-C 108.01 -1.107 . . . . 0.0 108.01 178.166 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 1.9 pt -144.37 157.89 15.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 C-N-CA 119.467 -0.893 . . . . 0.0 113.163 -177.59 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 1.3 t -123.07 155.86 36.07 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.067 178.805 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.406 ' CD1' ' C ' ' A' ' 75' ' ' LEU . 0.2 OUTLIER -65.2 118.66 9.56 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.951 0.405 . . . . 0.0 110.338 -179.65 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -97.1 -40.83 8.63 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.047 177.658 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' TRP . . . . . 0.526 ' NE1' ' HA3' ' A' ' 84' ' ' GLY . 67.2 p-90 -171.04 169.23 6.66 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.316 -179.956 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -151.27 123.86 8.47 Favored 'General case' 0 N--CA 1.464 0.226 0 N-CA-C 109.97 -0.382 . . . . 0.0 109.97 178.778 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 2.7 ttm180 -152.27 134.08 14.78 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 119.827 -0.749 . . . . 0.0 113.016 179.651 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 40.6 m-20 56.56 47.34 18.78 Favored 'General case' 0 N--CA 1.463 0.219 0 N-CA-C 113.983 1.105 . . . . 0.0 113.983 176.485 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 84.36 -27.76 4.52 Favored Glycine 0 CA--C 1.523 0.581 0 C-N-CA 120.408 -0.901 . . . . 0.0 113.452 177.23 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 4.0 mt -89.58 155.76 19.05 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 117.847 0.824 . . . . 0.0 110.439 -179.008 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 44.1 mt -128.62 135.57 49.5 Favored 'General case' 0 CA--C 1.52 -0.208 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.456 -179.136 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . 0.526 ' HA3' ' NE1' ' A' ' 77' ' ' TRP . . . -98.98 151.51 19.5 Favored Glycine 0 N--CA 1.453 -0.199 0 N-CA-C 109.691 -1.363 . . . . 0.0 109.691 178.615 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 46.5 m-85 -145.97 136.77 24.35 Favored 'General case' 0 C--N 1.32 -0.702 0 C-N-CA 120.655 -0.418 . . . . 0.0 110.46 -179.716 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -104.06 127.28 51.63 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.411 -0.588 . . . . 0.0 109.411 179.822 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 43.3 t -77.55 128.31 33.96 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.071 0.462 . . . . 0.0 111.21 -179.065 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -103.98 -27.37 12.19 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.191 179.962 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . 0.601 ' ND1' ' N ' ' A' ' 90' ' ' ILE . 0.0 OUTLIER -159.67 140.74 12.55 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.063 0.458 . . . . 0.0 110.281 179.484 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . 0.601 ' N ' ' ND1' ' A' ' 89' ' ' HIS . 8.8 tt -146.06 141.15 21.52 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 115.741 -0.663 . . . . 0.0 109.817 -179.942 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -53.71 140.41 29.61 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.086 -0.961 . . . . 0.0 112.242 -178.004 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 6.4 tt -54.63 -42.22 70.97 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.148 -0.933 . . . . 0.0 109.847 179.822 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -68.27 -36.73 79.84 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 179.225 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 4.1 m -67.59 -36.4 80.81 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.595 -0.729 . . . . 0.0 109.738 179.146 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -58.66 -38.55 72.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.757 -0.656 . . . . 0.0 109.936 179.284 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -70.9 -38.48 72.99 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.281 -0.568 . . . . 0.0 111.281 -178.735 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' HIS . . . . . 0.421 ' O ' HD23 ' A' ' 101' ' ' LEU . 60.4 m-70 -63.38 -43.03 98.76 Favored 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 118.929 -1.108 . . . . 0.0 108.821 179.456 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 4.1 mp -59.93 -33.97 72.61 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 110.03 -0.359 . . . . 0.0 110.03 178.193 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 5.9 mtp85 -62.42 -36.9 83.84 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 120.181 -0.607 . . . . 0.0 109.731 178.966 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 15.5 mmm180 -59.17 -51.35 70.38 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.057 179.479 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.421 HD23 ' O ' ' A' ' 97' ' ' HIS . 0.2 OUTLIER -59.38 -34.65 72.68 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.494 -179.843 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 69.8 t -68.78 -44.84 81.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.698 179.224 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -63.14 -47.38 82.95 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.55 -179.081 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 6.6 mp -63.98 -40.05 95.51 Favored 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 120.545 -0.462 . . . . 0.0 110.675 -179.558 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -57.41 -47.71 81.04 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.887 -0.325 . . . . 0.0 110.504 -179.683 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 90.0 mt -66.78 -27.41 67.56 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.47 179.956 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 101.38 -72.43 0.37 Allowed Glycine 0 CA--C 1.526 0.737 0 N-CA-C 110.99 -0.844 . . . . 0.0 110.99 179.749 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 51.1 m-20 -159.8 69.49 0.42 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.803 0.335 . . . . 0.0 110.577 -179.892 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -121.48 -174.62 2.9 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.362 179.843 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 19.7 mt-10 -77.05 -133.41 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.475 179.969 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . 0.417 ' C ' ' H ' ' A' ' 113' ' ' GLU . 0.5 OUTLIER -130.1 -174.92 3.46 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.923 0.392 . . . . 0.0 110.443 -179.804 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 2.5 tp 64.53 1.96 1.47 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.031 -0.532 . . . . 0.0 110.831 179.87 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . 0.555 ' O ' ' C ' ' A' ' 114' ' ' ARG . 4.2 mp0 41.75 -129.21 0.55 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.408 -179.877 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . 0.555 ' C ' ' O ' ' A' ' 113' ' ' GLU . 63.3 mtm-85 14.69 103.66 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.486 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.752 179.691 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . 0.417 ' H ' HD11 ' A' ' 118' ' ' LEU . 10.4 tt0 -164.61 142.7 6.71 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.228 0.537 . . . . 0.0 111.274 179.921 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 4.5 tt -54.02 -34.85 61.05 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.475 -0.784 . . . . 0.0 111.013 179.617 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 117' ' ' ALA . . . . . 0.525 ' O ' ' CG2' ' A' ' 120' ' ' VAL . . . -68.82 -23.25 64.24 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.015 -0.539 . . . . 0.0 112.217 179.839 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . 0.417 HD11 ' H ' ' A' ' 115' ' ' GLU . 37.8 mt -54.22 -43.1 70.52 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 119.783 -0.767 . . . . 0.0 110.723 -177.672 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . 0.553 ' C ' ' H ' ' A' ' 121' ' ' SER . 7.2 mp -55.6 -16.69 4.32 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.085 -0.646 . . . . 0.0 110.23 -178.304 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . 0.525 ' CG2' ' O ' ' A' ' 117' ' ' ALA . 76.1 t -57.14 -2.55 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-O 120.908 0.385 . . . . 0.0 110.64 179.584 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 121' ' ' SER . . . . . 0.553 ' H ' ' C ' ' A' ' 119' ' ' LEU . 32.5 p -101.43 -35.3 9.24 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.739 -178.969 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . 0.809 ' O ' ' O ' ' A' ' 123' ' ' HIS . . . -123.29 -83.58 0.65 Allowed 'General case' 0 N--CA 1.464 0.258 0 C-N-CA 120.953 -0.299 . . . . 0.0 111.794 -179.027 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . 0.809 ' O ' ' O ' ' A' ' 122' ' ' ALA . 0.0 OUTLIER 36.36 167.27 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.516 0.674 . . . . 0.0 111.882 -179.885 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . 0.588 ' N ' ' CG ' ' A' ' 123' ' ' HIS . 2.7 p30 -162.77 -35.61 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.342 179.948 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 125' ' ' ASP . . . . . 0.516 ' C ' ' O ' ' A' ' 124' ' ' ASP . 34.6 t70 . . . . . 0 C--O 1.22 -0.465 0 CA-C-O 117.916 -1.04 . . . . 0.0 111.437 179.627 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 501' ' ' C2E . . . . . 0.905 ' O21' " H4'" ' A' ' 501' ' ' C2E . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 502' ' ' C2E . . . . . 0.656 ' C61' ' H ' ' A' ' 8' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 60.4 mtp . . . . . 0 N--CA 1.489 1.495 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 45.8 t -162.87 -37.83 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.671 -180.0 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 35.5 p-10 -95.22 62.32 2.49 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.682 -179.911 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . 0.707 ' H ' ' NE2' ' A' ' 4' ' ' GLN . 0.0 OUTLIER -69.83 -35.35 74.7 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.764 0.792 . . . . 0.0 111.13 -178.079 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . 0.627 ' CG ' ' O ' ' A' ' 4' ' ' GLN . 0.4 OUTLIER 148.68 19.42 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 113.879 -1.51 . . . . 0.0 107.699 -178.263 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . 0.647 ' O ' ' CZ ' ' A' ' 8' ' ' ARG . 10.2 m-20 56.82 65.07 1.48 Allowed 'General case' 0 N--CA 1.454 -0.226 0 CA-C-N 115.246 -0.888 . . . . 0.0 108.71 -178.257 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -81.94 132.45 35.27 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.55 -0.75 . . . . 0.0 111.112 -178.754 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.656 ' NH2' ' N11' ' A' ' 501' ' ' C2E . 0.0 OUTLIER -122.73 -8.31 8.46 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-N 115.509 -0.768 . . . . 0.0 110.956 -179.797 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.593 ' O ' ' N ' ' A' ' 11' ' ' PHE . 1.3 ptt85 -102.56 105.49 16.01 Favored 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 120.856 -0.338 . . . . 0.0 110.131 179.752 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.731 HH21 ' P11' ' A' ' 501' ' ' C2E . 0.0 OUTLIER -1.66 -65.96 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 115.367 -0.833 . . . . 0.0 111.995 -179.591 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . 0.593 ' N ' ' O ' ' A' ' 9' ' ' ARG . 0.1 OUTLIER -141.85 170.03 16.49 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-O 120.847 0.356 . . . . 0.0 110.494 -179.581 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . 0.781 ' H ' ' CD2' ' A' ' 12' ' ' HIS . 0.0 OUTLIER -58.08 162.72 3.24 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.352 -179.99 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.586 ' NH1' ' CZ ' ' A' ' 9' ' ' ARG . 0.9 OUTLIER -114.59 161.45 18.05 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 120.889 0.376 . . . . 0.0 110.691 -179.836 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 20.5 mm -72.87 93.64 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.152 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.53 179.73 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -95.25 119.72 34.24 Favored 'General case' 0 C--N 1.331 -0.225 0 C-N-CA 120.157 -0.617 . . . . 0.0 111.694 -179.744 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 6.2 p90 -150.36 159.03 44.75 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 114.876 -1.057 . . . . 0.0 108.201 177.206 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -94.99 146.47 24.23 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 119.935 -0.706 . . . . 0.0 111.176 -178.503 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -178.23 175.86 1.16 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.867 -0.606 . . . . 0.0 109.964 179.646 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -96.22 134.79 38.89 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.083 -179.615 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.58 ' O ' ' O ' ' A' ' 31' ' ' VAL . 11.4 p -134.87 154.07 51.8 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.035 0.445 . . . . 0.0 110.428 178.861 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -133.94 142.61 47.77 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 108.904 -0.776 . . . . 0.0 108.904 179.419 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 53.3 mt -122.61 136.8 58.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-O 121.429 0.633 . . . . 0.0 111.108 -179.541 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -121.94 123.81 42.56 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.133 -0.94 . . . . 0.0 110.949 -179.158 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.557 ' OE1' ' CE2' ' A' ' 57' ' ' PHE . 5.9 tt0 -126.77 131.2 51.35 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 107.876 -1.157 . . . . 0.0 107.876 178.339 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 47.47 -120.5 5.75 Favored Glycine 0 CA--C 1.528 0.876 0 N-CA-C 110.451 -1.06 . . . . 0.0 110.451 -179.234 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -105.08 13.21 31.18 Favored 'General case' 0 N--CA 1.463 0.225 0 N-CA-C 111.637 0.236 . . . . 0.0 111.637 -179.503 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.583 ' HB3' ' CZ2' ' A' ' 29' ' ' TRP . 2.6 mpt_? -111.95 133.1 54.35 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 -179.023 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.468 ' HG3' ' N ' ' A' ' 29' ' ' TRP . 0.0 OUTLIER -125.18 145.04 50.15 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.02 -0.536 . . . . 0.0 109.799 179.261 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.594 ' NE1' ' O ' ' A' ' 48' ' ' ASP . 6.3 m-90 -145.52 156.53 43.77 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.364 -0.835 . . . . 0.0 110.705 -179.03 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 16.4 mt-10 -100.6 137.94 38.34 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 178.773 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.58 ' O ' ' O ' ' A' ' 20' ' ' SER . 26.3 m -147.74 159.05 8.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-O 121.199 0.523 . . . . 0.0 111.287 -179.548 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.629 ' H ' ' CD2' ' A' ' 32' ' ' LEU . 1.4 pt? -98.38 130.04 45.03 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 108.79 -0.818 . . . . 0.0 108.79 178.652 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -93.31 126.58 38.5 Favored 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 120.179 -0.608 . . . . 0.0 109.661 -179.762 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 76.1 m-70 -91.82 -26.14 18.66 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.366 -0.834 . . . . 0.0 111.959 -178.31 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . 0.571 ' CG ' HH21 ' A' ' 13' ' ' ARG . 2.9 p30 -174.01 161.03 3.6 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 119.38 -0.928 . . . . 0.0 111.354 177.443 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 3.4 p -144.22 168.74 10.39 Favored 'Isoleucine or valine' 0 C--O 1.232 0.135 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.987 -179.128 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' SER . . . . . 0.485 ' C ' ' H ' ' A' ' 39' ' ' HIS . 6.3 t -142.2 168.42 19.79 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 107.621 -1.251 . . . . 0.0 107.621 178.659 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.586 ' CD1' ' ND1' ' A' ' 39' ' ' HIS . 0.3 OUTLIER -63.81 1.02 0.69 Allowed 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 119.216 -0.994 . . . . 0.0 110.549 -179.625 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . 0.586 ' ND1' ' CD1' ' A' ' 38' ' ' LEU . 21.9 p-80 -166.53 44.51 0.06 Allowed 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 120.718 -0.393 . . . . 0.0 111.226 179.35 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -176.97 152.04 11.81 Favored Glycine 0 CA--C 1.526 0.719 0 N-CA-C 111.012 -0.835 . . . . 0.0 111.012 179.68 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -148.01 149.01 15.69 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.259 0 CA-C-O 121.545 0.688 . . . . 0.0 111.581 -179.337 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -121.34 135.04 55.14 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 114.873 -1.058 . . . . 0.0 108.191 178.488 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 20.2 m -140.61 174.71 7.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 C-N-CA 120.261 -0.576 . . . . 0.0 111.826 -178.887 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -97.41 143.99 17.05 Favored Glycine 0 CA--C 1.526 0.746 0 N-CA-C 109.497 -1.441 . . . . 0.0 109.497 178.305 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . 0.54 ' CD ' ' O ' ' A' ' 45' ' ' GLN . 0.0 OUTLIER -86.58 115.91 64.02 Favored Pre-proline 0 CA--C 1.533 0.327 0 CA-C-N 117.74 0.77 . . . . 0.0 111.729 -178.569 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 89.7 Cg_endo -84.62 161.14 12.49 Favored 'Trans proline' 0 C--N 1.308 -1.557 0 C-N-CA 121.42 1.414 . . . . 0.0 111.262 179.003 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.2 pt20 -65.3 -38.34 89.9 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 112.437 0.532 . . . . 0.0 112.437 -178.745 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . 0.594 ' O ' ' NE1' ' A' ' 29' ' ' TRP . 1.3 m-20 -74.66 8.36 2.42 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 111.87 0.322 . . . . 0.0 111.87 -178.647 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' TRP . . . . . 0.463 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 65.4 t-105 -58.57 67.98 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 112.03 0.382 . . . . 0.0 112.03 -179.534 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . 0.561 ' N ' ' O ' ' A' ' 48' ' ' ASP . 0.2 OUTLIER -93.22 78.73 4.51 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 120.086 -0.646 . . . . 0.0 109.585 178.484 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -146.15 143.75 11.98 Favored Glycine 0 CA--C 1.526 0.733 0 N-CA-C 111.242 -0.743 . . . . 0.0 111.242 -179.492 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -77.46 122.22 85.62 Favored Pre-proline 0 CA--C 1.536 0.43 0 CA-C-N 115.77 -0.215 . . . . 0.0 110.939 -179.813 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 12.7 Cg_endo -58.35 -22.69 59.43 Favored 'Trans proline' 0 N--CA 1.496 1.654 0 C-N-CA 122.698 2.266 . . . . 0.0 112.362 -179.441 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 22.2 mp0 -78.77 -23.86 45.04 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.337 -0.545 . . . . 0.0 111.69 -179.183 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.522 ' O ' ' CE1' ' A' ' 57' ' ' PHE . 42.2 mtt180 -91.1 155.41 44.77 Favored Pre-proline 0 N--CA 1.463 0.201 0 C-N-CA 120.471 -0.492 . . . . 0.0 109.921 179.772 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 44.6 Cg_endo -67.81 160.59 47.63 Favored 'Trans proline' 0 C--N 1.308 -1.601 0 C-N-CA 122.762 2.308 . . . . 0.0 113.243 -178.846 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . 0.557 ' CE2' ' OE1' ' A' ' 24' ' ' GLN . 51.5 m-85 -130.64 156.54 44.72 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 114.935 -1.029 . . . . 0.0 108.953 179.433 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 19.5 mt-10 -121.95 135.07 54.84 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 108.852 -0.796 . . . . 0.0 108.852 178.466 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -116.49 136.92 52.58 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.088 0.47 . . . . 0.0 111.56 -178.431 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.503 ' CB ' ' HH ' ' A' ' 62' ' ' TYR . 7.0 mtt180 -123.65 127.77 48.7 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 108.538 -0.912 . . . . 0.0 108.538 177.848 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 6.6 mt -107.07 144.82 33.19 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.593 -0.443 . . . . 0.0 110.54 -179.184 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' TYR . . . . . 0.517 ' CD1' ' N ' ' A' ' 62' ' ' TYR . 6.5 m-85 -128.58 110.3 12.13 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.719 179.899 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 9.1 mp -105.57 -91.15 0.4 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.257 179.294 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -68.84 178.8 24.35 Favored Glycine 0 CA--C 1.521 0.461 0 N-CA-C 109.484 -1.446 . . . . 0.0 109.484 178.689 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.42 ' CD1' ' C ' ' A' ' 65' ' ' LEU . 0.9 OUTLIER -74.0 -31.4 62.94 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.015 -0.674 . . . . 0.0 110.122 -179.893 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.416 ' OD1' ' O ' ' A' ' 66' ' ' ASP . 37.5 t0 -103.39 9.23 37.94 Favored 'General case' 0 C--N 1.333 -0.141 0 C-N-CA 122.663 0.385 . . . . 0.0 111.272 -179.802 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 16.4 t -104.08 95.26 3.68 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.3 0 CA-C-O 121.4 0.619 . . . . 0.0 111.761 -178.876 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 3.7 tp -111.51 117.19 32.32 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 107.859 -1.163 . . . . 0.0 107.859 178.128 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 5.1 mt -114.37 144.12 22.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-O 120.959 0.409 . . . . 0.0 111.086 -178.812 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.402 HH11 ' HD3' ' A' ' 70' ' ' ARG . 4.1 ptt180 -128.28 130.6 48.1 Favored 'General case' 0 C--O 1.238 0.48 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.828 179.189 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' MET . . . . . 0.433 ' SD ' ' CD1' ' A' ' 90' ' ' ILE . 1.2 mtm -140.01 147.47 40.44 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.66 -0.7 . . . . 0.0 109.622 179.583 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -99.68 132.59 44.92 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 107.627 -1.249 . . . . 0.0 107.627 178.529 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.557 HD13 ' CG ' ' A' ' 85' ' ' PHE . 13.1 pt -142.0 157.21 20.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 C-N-CA 119.109 -1.036 . . . . 0.0 113.132 -177.467 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 2.7 p -123.65 155.48 37.67 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 114.983 -1.008 . . . . 0.0 110.021 179.219 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.476 ' CD1' ' CZ ' ' A' ' 85' ' ' PHE . 5.6 tp -66.01 119.45 11.38 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.0 0.429 . . . . 0.0 110.802 -179.699 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -97.22 -41.05 8.48 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.342 177.796 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' TRP . . . . . 0.552 ' NE1' ' HA3' ' A' ' 84' ' ' GLY . 67.8 p-90 -171.0 170.73 6.13 Favored 'General case' 0 N--CA 1.466 0.375 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.051 -179.782 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -151.28 124.11 8.58 Favored 'General case' 0 N--CA 1.465 0.289 0 N-CA-C 110.197 -0.298 . . . . 0.0 110.197 178.89 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 1.2 ttp180 -152.37 134.07 14.69 Favored 'General case' 0 CA--C 1.533 0.326 0 N-CA-C 113.148 0.796 . . . . 0.0 113.148 179.795 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 57.11 47.41 17.34 Favored 'General case' 0 N--CA 1.463 0.225 0 N-CA-C 114.124 1.157 . . . . 0.0 114.124 176.434 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 84.55 -28.64 4.28 Favored Glycine 0 CA--C 1.523 0.571 0 C-N-CA 120.382 -0.913 . . . . 0.0 113.157 177.184 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 6.4 mt -89.5 157.81 17.94 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 117.574 0.687 . . . . 0.0 110.57 -178.927 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 38.0 mt -128.74 135.25 48.94 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.833 -0.622 . . . . 0.0 111.016 -179.397 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . 0.552 ' HA3' ' NE1' ' A' ' 77' ' ' TRP . . . -95.04 152.1 20.32 Favored Glycine 0 N--CA 1.45 -0.392 0 N-CA-C 109.471 -1.451 . . . . 0.0 109.471 178.544 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . 0.557 ' CG ' HD13 ' A' ' 73' ' ' ILE . 22.5 m-85 -145.74 132.44 19.96 Favored 'General case' 0 C--N 1.32 -0.716 0 C-N-CA 120.641 -0.424 . . . . 0.0 110.675 -179.247 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.412 ' O ' ' CG ' ' A' ' 86' ' ' GLU . 7.4 pt-20 -104.02 127.45 51.58 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 179.67 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 1.8 t -74.8 125.69 29.33 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.16 0.505 . . . . 0.0 111.824 -178.685 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -100.79 -29.22 12.38 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.162 179.327 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . 0.622 ' ND1' ' N ' ' A' ' 90' ' ' ILE . 0.0 OUTLIER -160.39 141.18 11.9 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.958 0.409 . . . . 0.0 110.143 179.512 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . 0.622 ' N ' ' ND1' ' A' ' 89' ' ' HIS . 6.5 tt -145.65 140.71 22.02 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.096 -179.23 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -56.33 139.64 47.77 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 115.21 -0.905 . . . . 0.0 112.373 -178.079 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 5.5 tp -54.29 -42.29 69.88 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 115.145 -0.934 . . . . 0.0 110.431 -180.0 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 25.6 t0 -69.06 -37.76 78.69 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 179.277 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 1.2 t -68.54 -35.19 77.1 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.639 179.183 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 20.3 mt -58.64 -37.27 64.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.771 179.233 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -70.33 -40.71 73.97 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 120.278 -0.569 . . . . 0.0 110.669 -178.999 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 61.6 m-70 -61.81 -36.08 80.07 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 119.499 -0.88 . . . . 0.0 109.149 179.454 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -67.62 -34.21 76.52 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.16 -0.473 . . . . 0.0 109.775 178.012 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -66.31 -37.92 86.52 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 109.5 -0.556 . . . . 0.0 109.5 178.846 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 71.7 mtt180 -56.43 -37.92 70.89 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.277 178.389 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 4.4 mt -69.99 -47.27 62.9 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.237 -179.547 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 51.6 t -60.67 -41.2 87.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.729 -179.831 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -63.44 -48.48 77.58 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.969 -179.756 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 39.1 mt -65.48 -41.79 92.92 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.389 -0.368 . . . . 0.0 110.814 -179.578 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -60.83 -31.77 71.18 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 120.703 -0.399 . . . . 0.0 110.184 -179.903 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -55.96 -18.78 10.07 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.29 -0.413 . . . . 0.0 109.994 179.72 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . 0.47 ' O ' ' O ' ' A' ' 108' ' ' ASP . . . -113.37 -41.58 0.95 Allowed Glycine 0 CA--C 1.526 0.745 0 N-CA-C 111.056 -0.817 . . . . 0.0 111.056 179.971 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . 0.47 ' O ' ' O ' ' A' ' 107' ' ' GLY . 2.2 m-20 -58.63 -142.36 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.821 0.343 . . . . 0.0 110.575 -179.893 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . 0.487 ' O ' ' CD1' ' A' ' 112' ' ' LEU . 48.8 tt0 56.01 105.08 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.355 -179.932 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -87.98 43.32 1.11 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.861 -179.751 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 4.5 mp -141.66 30.79 1.67 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.512 179.777 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.487 ' CD1' ' O ' ' A' ' 109' ' ' GLU . 11.1 mp -48.34 101.2 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.87 0.367 . . . . 0.0 110.369 -179.942 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 52.0 mm-40 -140.47 -45.61 0.41 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.383 -179.975 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -42.27 143.17 0.65 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.028 179.896 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -78.02 148.11 34.52 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.245 0.545 . . . . 0.0 111.182 -179.393 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.581 ' H ' ' CD2' ' A' ' 116' ' ' LEU . 2.6 mm? -67.04 -38.89 86.69 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.241 -0.89 . . . . 0.0 111.035 179.605 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 117' ' ' ALA . . . . . 0.488 ' O ' ' CG2' ' A' ' 120' ' ' VAL . . . -68.34 -22.12 64.71 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.119 -0.491 . . . . 0.0 112.004 -179.206 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 37.0 mt -53.06 -31.58 42.39 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 120.641 -0.423 . . . . 0.0 110.883 -178.362 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 15.0 mt -58.14 -27.7 64.01 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 178.832 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . 0.488 ' CG2' ' O ' ' A' ' 117' ' ' ALA . 43.7 t -58.67 -45.83 90.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 115.326 -0.852 . . . . 0.0 111.909 179.732 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 3.0 t -72.94 -12.11 60.83 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 112.991 0.737 . . . . 0.0 112.991 -177.817 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -104.74 -4.74 22.0 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 120.179 -0.609 . . . . 0.0 111.958 -179.016 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . 0.651 ' ND1' ' O ' ' A' ' 123' ' ' HIS . 5.8 p80 -173.37 28.6 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.534 -0.466 . . . . 0.0 111.051 179.651 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . 0.502 ' C ' ' O ' ' A' ' 123' ' ' HIS . 35.2 t0 -24.91 82.77 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.348 0 N-CA-C 111.967 0.358 . . . . 0.0 111.967 -178.878 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 125' ' ' ASP . . . . . 0.623 ' N ' ' O ' ' A' ' 123' ' ' HIS . 0.9 OUTLIER . . . . . 0 C--O 1.22 -0.483 0 CA-C-O 118.04 -0.981 . . . . 0.0 110.389 179.675 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 501' ' ' C2E . . . . . 0.731 ' P11' HH21 ' A' ' 10' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 502' ' ' C2E . . . . . 0.546 ' C21' ' NH1' ' A' ' 9' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.502 ' C ' HE21 ' A' ' 4' ' ' GLN . 66.6 mmm . . . . . 0 N--CA 1.491 1.575 0 N-CA-C 109.449 -0.575 . . . . 0.0 109.449 . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.555 ' O ' ' NE2' ' A' ' 4' ' ' GLN . 1.9 t 75.66 -132.65 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.81 -179.972 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -100.75 63.22 1.04 Allowed 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 121.179 0.514 . . . . 0.0 109.935 177.766 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . 0.717 ' CD ' ' H ' ' A' ' 4' ' ' GLN . 0.0 OUTLIER -81.25 11.91 3.94 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.274 -0.875 . . . . 0.0 111.916 -179.189 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . 0.527 ' HB2' ' O ' ' A' ' 4' ' ' GLN . 10.2 m170 79.01 15.17 1.07 Allowed 'General case' 0 C--N 1.33 -0.279 0 O-C-N 123.285 0.366 . . . . 0.0 111.771 179.345 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . 0.489 ' O ' ' CZ ' ' A' ' 8' ' ' ARG . 75.4 m-20 -49.57 138.77 13.37 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 108.852 -0.796 . . . . 0.0 108.852 179.388 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.455 ' C ' ' CD ' ' A' ' 7' ' ' GLU . 0.4 OUTLIER -79.53 133.08 36.47 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 120.122 -0.631 . . . . 0.0 111.157 -178.841 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.636 HH21 ' C21' ' A' ' 501' ' ' C2E . 0.0 OUTLIER -123.46 -6.3 8.16 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-N 115.747 -0.66 . . . . 0.0 111.079 -179.502 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.536 ' O ' ' C ' ' A' ' 10' ' ' ARG . 1.0 OUTLIER -110.81 94.87 5.22 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 120.944 0.402 . . . . 0.0 110.068 179.532 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.536 ' C ' ' O ' ' A' ' 9' ' ' ARG . 0.0 OUTLIER 18.27 -84.72 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.475 0 CA-C-N 115.399 -0.819 . . . . 0.0 111.346 -179.649 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . 0.534 ' N ' ' O ' ' A' ' 9' ' ' ARG . 0.1 OUTLIER -138.49 160.76 38.75 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 110.124 -0.324 . . . . 0.0 110.124 179.914 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 5.9 p80 -39.04 153.68 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.955 0.407 . . . . 0.0 110.829 -179.734 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.569 ' NH1' ' N1 ' ' A' ' 501' ' ' C2E . 0.4 OUTLIER -108.65 149.04 29.5 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.224 -179.911 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.451 ' CD1' ' N ' ' A' ' 14' ' ' ILE . 1.8 mp -54.56 96.27 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-O 121.008 0.432 . . . . 0.0 110.21 179.862 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -94.91 120.57 35.35 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.954 -179.834 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -149.48 153.43 37.23 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.058 -0.974 . . . . 0.0 108.453 178.399 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -95.36 149.64 21.15 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 120.299 -0.56 . . . . 0.0 111.149 -178.503 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . 178.39 178.78 0.38 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.802 -0.635 . . . . 0.0 109.99 179.626 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -96.36 134.71 39.16 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.892 -179.941 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.67 ' O ' ' O ' ' A' ' 31' ' ' VAL . 5.8 p -136.5 159.03 43.02 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.34 179.169 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.414 ' C ' ' OE1' ' A' ' 21' ' ' GLU . 0.5 OUTLIER -146.71 146.23 30.26 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 178.674 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 1.1 mm -120.37 136.47 57.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-O 121.208 0.528 . . . . 0.0 111.645 -178.091 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -121.25 123.11 41.42 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.836 -179.902 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.575 ' OE1' ' CE2' ' A' ' 57' ' ' PHE . 22.9 tt0 -130.39 102.27 6.11 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.303 -0.862 . . . . 0.0 109.775 179.028 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 79.89 -126.51 7.48 Favored Glycine 0 CA--C 1.525 0.657 0 N-CA-C 110.053 -1.219 . . . . 0.0 110.053 -179.022 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.4 pm0 -100.61 10.89 40.58 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.816 0.341 . . . . 0.0 110.213 179.444 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.545 ' HB3' ' CZ2' ' A' ' 29' ' ' TRP . 6.5 mtt180 -112.56 133.82 54.4 Favored 'General case' 0 CA--C 1.52 -0.175 0 N-CA-C 112.228 0.455 . . . . 0.0 112.228 -178.758 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 74.7 ttt180 -128.02 149.2 50.47 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.182 179.417 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.545 ' CZ2' ' HB3' ' A' ' 27' ' ' ARG . 6.7 m-90 -147.15 155.54 42.22 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.246 -179.079 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.519 ' CD ' ' H ' ' A' ' 30' ' ' GLU . 3.0 mp0 -101.5 137.89 39.23 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 179.566 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.67 ' O ' ' O ' ' A' ' 20' ' ' SER . 19.2 m -146.71 157.45 10.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 121.261 0.553 . . . . 0.0 111.16 -179.768 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.714 ' H ' ' CD2' ' A' ' 32' ' ' LEU . 1.6 pt? -96.17 130.27 43.27 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 108.614 -0.884 . . . . 0.0 108.614 178.363 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.478 ' N ' ' HG ' ' A' ' 20' ' ' SER . 1.7 tt -91.47 125.97 36.39 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.241 0.543 . . . . 0.0 110.088 -179.329 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 75.2 m-70 -91.85 -28.57 17.24 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.225 -0.898 . . . . 0.0 111.86 -178.5 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 2.0 p30 -173.39 162.99 4.42 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 119.412 -0.915 . . . . 0.0 111.461 177.632 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 7.3 p -145.48 168.01 8.65 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.084 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.777 -179.193 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 6.5 t -141.78 170.39 15.81 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 107.907 -1.145 . . . . 0.0 107.907 179.042 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -66.11 -0.62 2.55 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 119.488 -0.885 . . . . 0.0 110.832 -178.909 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . 0.43 ' NE2' ' O ' ' A' ' 87' ' ' CYS . 3.0 t60 -163.09 40.03 0.1 Allowed 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 120.682 -0.407 . . . . 0.0 111.128 179.713 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -175.05 155.38 20.46 Favored Glycine 0 CA--C 1.526 0.749 0 N-CA-C 111.144 -0.782 . . . . 0.0 111.144 179.849 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -148.2 148.94 15.69 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.204 0 CA-C-O 121.359 0.599 . . . . 0.0 111.375 -179.17 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -122.09 137.33 54.85 Favored 'General case' 0 N--CA 1.462 0.134 0 CA-C-N 115.133 -0.94 . . . . 0.0 108.642 178.932 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 19.8 m -141.39 174.88 6.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 C-N-CA 120.27 -0.572 . . . . 0.0 111.788 -179.181 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -96.58 145.25 17.75 Favored Glycine 0 CA--C 1.529 0.968 0 N-CA-C 109.572 -1.411 . . . . 0.0 109.572 178.257 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.4 tm0? -87.34 114.18 57.45 Favored Pre-proline 0 N--CA 1.465 0.283 0 CA-C-N 117.877 0.839 . . . . 0.0 111.947 -178.518 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 94.3 Cg_endo -85.26 161.42 11.34 Favored 'Trans proline' 0 C--N 1.309 -1.524 0 C-N-CA 121.714 1.609 . . . . 0.0 111.723 179.082 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.428 ' HG2' ' H ' ' A' ' 48' ' ' ASP . 0.5 OUTLIER -65.57 -40.32 92.63 Favored 'General case' 0 CA--C 1.532 0.277 0 N-CA-C 112.439 0.533 . . . . 0.0 112.439 -179.081 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . 0.531 ' O ' ' NE1' ' A' ' 29' ' ' TRP . 37.7 m-20 -72.85 8.06 1.7 Allowed 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 111.839 0.311 . . . . 0.0 111.839 -178.565 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' TRP . . . . . 0.448 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 60.3 t-105 -60.67 68.28 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.712 -179.58 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . 0.531 ' N ' ' O ' ' A' ' 48' ' ' ASP . 0.6 OUTLIER -93.22 78.78 4.51 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 120.207 -0.597 . . . . 0.0 109.572 178.643 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -141.45 159.54 26.77 Favored Glycine 0 CA--C 1.524 0.638 0 N-CA-C 111.31 -0.716 . . . . 0.0 111.31 -179.381 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 22.4 t0 -94.47 110.34 48.29 Favored Pre-proline 0 CA--C 1.533 0.291 0 CA-C-N 115.823 -0.189 . . . . 0.0 110.546 -179.98 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_exo -46.39 -22.72 1.76 Allowed 'Trans proline' 0 N--CA 1.495 1.579 0 C-N-CA 122.647 2.232 . . . . 0.0 112.393 -179.919 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.612 HE21 ' NH1' ' A' ' 55' ' ' ARG . 16.0 mt-30 -79.61 -24.05 42.24 Favored 'General case' 0 C--N 1.326 -0.444 0 C-N-CA 120.648 -0.421 . . . . 0.0 111.815 -178.751 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.612 ' NH1' HE21 ' A' ' 54' ' ' GLN . 0.0 OUTLIER -93.55 150.72 39.32 Favored Pre-proline 0 C--N 1.329 -0.283 0 C-N-CA 120.531 -0.468 . . . . 0.0 110.166 179.941 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . 0.453 ' O ' ' OE1' ' A' ' 24' ' ' GLN . 35.9 Cg_endo -64.43 160.68 38.18 Favored 'Trans proline' 0 N--CA 1.495 1.582 0 C-N-CA 122.841 2.361 . . . . 0.0 113.421 -178.655 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . 0.578 ' CE1' ' O ' ' A' ' 55' ' ' ARG . 50.4 m-85 -131.22 157.02 44.34 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 114.845 -1.07 . . . . 0.0 109.134 179.594 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 83.5 mt-10 -122.72 137.18 54.99 Favored 'General case' 0 N--CA 1.468 0.444 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 178.535 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -116.29 135.41 53.91 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.026 0.441 . . . . 0.0 111.894 -178.44 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 39.2 mmt-85 -122.05 127.22 49.96 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 107.757 -1.201 . . . . 0.0 107.757 177.141 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.413 ' CD1' ' N ' ' A' ' 61' ' ' LEU . 9.0 mp -112.07 151.23 29.63 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.945 0.402 . . . . 0.0 111.21 -178.447 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 9.4 m-85 -131.32 108.45 9.66 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.447 179.471 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -103.93 -84.58 0.47 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.65 -0.704 . . . . 0.0 109.232 179.521 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -76.09 175.96 51.94 Favored Glycine 0 CA--C 1.521 0.438 0 N-CA-C 108.76 -1.736 . . . . 0.0 108.76 178.065 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 9.8 mt -72.5 -32.64 66.33 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 119.537 -0.865 . . . . 0.0 110.103 -179.557 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -102.84 9.53 38.88 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 122.912 0.485 . . . . 0.0 111.034 -179.842 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 9.1 t -106.71 96.61 4.76 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.343 0 CA-C-O 121.4 0.619 . . . . 0.0 111.738 -179.108 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 6.4 tp -112.24 117.35 32.29 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 108.032 -1.099 . . . . 0.0 108.032 178.168 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 5.7 mt -112.55 143.43 22.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.86 0.362 . . . . 0.0 111.222 -178.648 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 11.1 mtm180 -128.05 130.65 48.6 Favored 'General case' 0 C--O 1.238 0.463 0 CA-C-O 121.224 0.535 . . . . 0.0 111.346 179.715 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 2.4 mtp -140.28 148.56 41.62 Favored 'General case' 0 C--N 1.334 -0.1 0 CA-C-N 115.535 -0.757 . . . . 0.0 109.881 179.666 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 27.8 tt0 -106.51 125.54 51.12 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 107.793 -1.188 . . . . 0.0 107.793 177.997 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.457 HD13 ' CG ' ' A' ' 85' ' ' PHE . 9.9 pt -133.09 160.26 42.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 N-CA-C 113.279 0.844 . . . . 0.0 113.279 -176.945 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 37.6 m -121.67 151.87 39.98 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 114.564 -1.198 . . . . 0.0 109.357 178.763 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.515 ' CD1' ' CZ ' ' A' ' 85' ' ' PHE . 6.3 tp -67.09 123.02 19.08 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.297 0.57 . . . . 0.0 110.5 -179.679 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -97.81 -41.84 7.86 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 115.146 -0.934 . . . . 0.0 110.667 178.241 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' TRP . . . . . 0.56 ' NE1' ' HA3' ' A' ' 84' ' ' GLY . 67.5 p-90 -170.51 168.64 7.66 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.356 -179.349 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -147.46 123.87 10.98 Favored 'General case' 0 N--CA 1.465 0.299 0 N-CA-C 109.95 -0.389 . . . . 0.0 109.95 178.67 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 38.6 ttt180 -152.3 133.76 14.52 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 119.944 -0.703 . . . . 0.0 112.826 179.931 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . 0.452 ' O ' ' OD1' ' A' ' 80' ' ' ASP . 33.4 t0 56.98 47.22 18.04 Favored 'General case' 0 N--CA 1.463 0.181 0 N-CA-C 113.951 1.093 . . . . 0.0 113.951 176.585 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 82.29 -27.42 3.62 Favored Glycine 0 CA--C 1.524 0.597 0 C-N-CA 120.397 -0.906 . . . . 0.0 113.162 177.28 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 6.9 mt -89.5 156.73 18.45 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 117.672 0.736 . . . . 0.0 110.447 -179.084 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 36.2 mt -128.88 135.51 49.17 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.202 -179.282 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . 0.56 ' HA3' ' NE1' ' A' ' 77' ' ' TRP . . . -96.18 153.19 20.46 Favored Glycine 0 N--CA 1.45 -0.424 0 N-CA-C 109.576 -1.409 . . . . 0.0 109.576 178.692 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . 0.515 ' CZ ' ' CD1' ' A' ' 75' ' ' LEU . 26.6 m-85 -145.62 132.36 20.0 Favored 'General case' 0 C--N 1.317 -0.808 0 C-N-CA 120.792 -0.363 . . . . 0.0 110.733 -179.298 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.463 ' CG ' HE21 ' A' ' 88' ' ' GLN . 6.5 pt-20 -103.66 126.21 50.66 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 108.632 -0.877 . . . . 0.0 108.632 179.059 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . 0.43 ' O ' ' NE2' ' A' ' 39' ' ' HIS . 7.8 t -64.55 119.6 10.77 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 112.278 0.473 . . . . 0.0 112.278 -177.984 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . 0.463 HE21 ' CG ' ' A' ' 86' ' ' GLU . 46.8 mm-40 -89.32 -37.82 14.62 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.693 179.323 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . 0.412 ' ND1' ' N ' ' A' ' 90' ' ' ILE . 0.0 OUTLIER -164.66 144.85 7.55 Favored 'General case' 0 C--O 1.222 -0.375 0 CA-C-N 115.716 -0.674 . . . . 0.0 109.82 179.928 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . 0.412 ' N ' ' ND1' ' A' ' 89' ' ' HIS . 7.2 tt -143.81 140.45 25.47 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-O 121.407 0.623 . . . . 0.0 110.063 -179.814 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . 0.503 ' CB ' ' OG ' ' A' ' 94' ' ' SER . 0.2 OUTLIER -57.38 141.08 48.46 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 115.001 -1.0 . . . . 0.0 112.084 -178.001 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 3.2 tp -54.36 -42.06 69.85 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.254 -0.885 . . . . 0.0 110.403 -179.84 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -65.1 -42.94 93.55 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 179.295 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' SER . . . . . 0.503 ' OG ' ' CB ' ' A' ' 91' ' ' ASP . 1.1 p -66.86 -35.45 80.07 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.718 179.184 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 31.3 mt -58.73 -38.33 71.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.248 179.769 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -69.79 -37.7 76.41 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 119.876 -0.73 . . . . 0.0 111.422 -177.945 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 60.3 m-70 -61.89 -35.67 79.03 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 119.567 -0.853 . . . . 0.0 109.578 179.767 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 6.9 mp -62.11 -35.63 79.29 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 178.08 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.44 HH11 ' HD2' ' A' ' 99' ' ' ARG . 1.7 mmm180 -66.31 -39.75 89.49 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 119.847 -0.741 . . . . 0.0 109.008 178.177 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -61.8 -47.65 84.16 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.968 179.502 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.442 ' O ' ' OD1' ' A' ' 105' ' ' ASN . 4.1 mm? -61.91 -40.7 96.35 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.136 0.494 . . . . 0.0 110.124 -179.913 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 96.3 t -68.06 -47.41 78.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 115.618 -0.719 . . . . 0.0 111.594 -179.341 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 18.2 mm-40 -64.25 -43.06 96.06 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.436 -179.125 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 69.2 mt -66.16 -27.53 68.09 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.219 -178.981 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . 0.442 ' OD1' ' O ' ' A' ' 101' ' ' LEU . 13.1 m120 -59.46 -31.42 69.3 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 120.779 -0.368 . . . . 0.0 110.771 -179.766 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.497 ' CD2' ' N ' ' A' ' 106' ' ' LEU . 3.6 mm? -60.09 -18.7 48.89 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.492 179.888 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -70.12 1.11 19.64 Favored Glycine 0 CA--C 1.524 0.647 0 N-CA-C 110.429 -1.068 . . . . 0.0 110.429 179.899 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . 0.529 ' C ' ' H ' ' A' ' 110' ' ' GLU . 41.4 p30 -82.34 11.89 5.01 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.816 0.341 . . . . 0.0 110.582 -179.93 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 25.3 mm-40 -73.94 23.31 0.08 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.546 179.981 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . 0.529 ' H ' ' C ' ' A' ' 108' ' ' ASP . 66.4 mt-10 -67.14 -98.88 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.437 179.788 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 78.0 mt -140.86 78.39 1.65 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.303 179.903 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 21.2 tp -172.43 -85.55 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.721 -179.791 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 16.9 tt0 -50.79 152.01 2.24 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.912 -179.506 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 28.1 ptt180 -166.78 -176.55 3.51 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.445 179.729 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -79.32 -30.56 42.87 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.748 -179.842 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.404 ' O ' ' CG2' ' A' ' 120' ' ' VAL . 9.5 mp -54.51 -47.7 72.77 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.564 179.971 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -67.56 -51.94 44.71 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.477 179.676 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 95.0 mt -57.88 -49.35 77.01 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 112.802 0.668 . . . . 0.0 112.802 -177.53 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . 0.467 ' O ' ' N ' ' A' ' 123' ' ' HIS . 1.1 mt -72.9 -49.25 30.86 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 119.9 -0.72 . . . . 0.0 111.66 -178.709 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . 0.592 ' C ' ' H ' ' A' ' 122' ' ' ALA . 99.1 t -57.92 -15.8 5.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 C-N-CA 120.204 -0.598 . . . . 0.0 111.047 -177.467 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 121' ' ' SER . . . . . 0.548 ' O ' ' CB ' ' A' ' 122' ' ' ALA . 0.3 OUTLIER -70.79 21.27 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.42 179.051 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . 0.764 ' O ' ' O ' ' A' ' 123' ' ' HIS . . . 154.25 4.64 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.351 179.301 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . 0.764 ' O ' ' O ' ' A' ' 122' ' ' ALA . 0.5 OUTLIER -41.38 -131.72 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 121.148 0.499 . . . . 0.0 111.891 -179.19 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . 0.587 ' H ' ' CG ' ' A' ' 123' ' ' HIS . 42.0 t0 61.89 -26.78 0.05 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.881 -179.439 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 125' ' ' ASP . . . . . 0.688 ' H ' ' C ' ' A' ' 123' ' ' HIS . 15.5 m-20 . . . . . 0 C--O 1.22 -0.465 0 CA-C-O 118.019 -0.991 . . . . 0.0 110.87 -179.811 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 501' ' ' C2E . . . . . 0.636 ' C21' HH21 ' A' ' 8' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 502' ' ' C2E . . . . . 0.515 ' C4 ' ' CE2' ' A' ' 77' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.646 ' N ' HD12 ' A' ' 14' ' ' ILE . 1.8 mp . . . . . 0 CA--C 1.521 -0.161 0 CA-C-O 120.889 0.376 . . . . 0.0 110.093 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -95.02 120.16 34.76 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.338 0.59 . . . . 0.0 111.262 -179.675 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 5.1 p90 -150.25 158.92 44.68 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 177.668 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' ASP . . . . . 0.437 ' OD1' ' N ' ' A' ' 17' ' ' ASP . 0.1 OUTLIER -95.49 146.03 24.74 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 120.304 -0.558 . . . . 0.0 110.858 -179.028 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -178.49 176.56 1.02 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.783 179.148 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -96.54 133.63 40.76 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.023 -179.454 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.538 ' O ' ' O ' ' A' ' 31' ' ' VAL . 4.9 p -132.51 149.9 52.25 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.316 0.579 . . . . 0.0 110.201 178.378 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 12.5 mm-40 -131.0 138.97 49.92 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.435 -0.802 . . . . 0.0 108.838 179.708 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 1.1 mm -120.27 136.39 57.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-O 121.282 0.563 . . . . 0.0 110.704 -179.374 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.712 ' H ' HD12 ' A' ' 23' ' ' LEU . 0.0 OUTLIER -126.12 123.4 38.23 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.393 -0.821 . . . . 0.0 111.014 -179.133 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.691 ' NE2' ' CE2' ' A' ' 57' ' ' PHE . 9.2 tt0 -129.35 102.18 6.31 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.094 -0.957 . . . . 0.0 109.676 178.826 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 80.3 -127.33 7.88 Favored Glycine 0 CA--C 1.524 0.606 0 N-CA-C 109.94 -1.264 . . . . 0.0 109.94 -178.97 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -100.22 11.32 39.66 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.833 0.349 . . . . 0.0 110.179 179.586 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.579 ' HB3' ' CZ2' ' A' ' 29' ' ' TRP . 35.4 mtt180 -113.14 133.82 54.85 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 112.423 0.527 . . . . 0.0 112.423 -178.34 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.439 ' HG2' ' N ' ' A' ' 29' ' ' TRP . 17.2 ttt180 -128.35 149.22 50.61 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.582 179.786 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.579 ' CZ2' ' HB3' ' A' ' 27' ' ' ARG . 6.8 m-90 -146.7 155.79 42.68 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.505 -179.286 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.539 ' OE1' ' N ' ' A' ' 30' ' ' GLU . 1.9 mp0 -100.56 135.44 42.0 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.774 179.459 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.538 ' O ' ' O ' ' A' ' 20' ' ' SER . 15.4 m -145.61 157.33 12.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-O 121.315 0.579 . . . . 0.0 111.026 -179.612 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 1.057 ' H ' HD23 ' A' ' 32' ' ' LEU . 1.5 pt? -96.86 130.57 44.12 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 178.759 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -91.97 125.0 36.5 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.278 0.561 . . . . 0.0 109.908 -179.512 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 69.6 m-70 -91.4 -28.54 17.61 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.307 -0.861 . . . . 0.0 111.662 -178.695 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 -172.66 161.07 4.76 Favored 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 119.484 -0.886 . . . . 0.0 111.08 177.577 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' VAL . . . . . 0.531 HG22 ' H ' ' A' ' 37' ' ' SER . 4.6 p -145.56 169.08 7.3 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.243 -178.894 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' SER . . . . . 0.531 ' H ' HG22 ' A' ' 36' ' ' VAL . 32.1 t -142.18 169.59 17.31 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 107.894 -1.15 . . . . 0.0 107.894 178.348 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 2.6 mt -66.36 -0.82 2.88 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 119.793 -0.763 . . . . 0.0 110.856 -179.461 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' HIS . . . . . 0.546 ' CE1' ' O ' ' A' ' 87' ' ' CYS . 36.3 t60 -159.72 40.17 0.2 Allowed 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 120.664 -0.415 . . . . 0.0 111.472 -179.908 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -179.83 157.74 20.82 Favored Glycine 0 CA--C 1.525 0.681 0 N-CA-C 111.021 -0.832 . . . . 0.0 111.021 179.803 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -148.47 148.83 15.67 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.259 0 CA-C-O 121.382 0.61 . . . . 0.0 111.628 -178.804 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.491 HD23 ' N ' ' A' ' 43' ' ' VAL . 1.0 OUTLIER -121.95 137.4 54.81 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 115.016 -0.993 . . . . 0.0 108.759 178.664 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.491 ' N ' HD23 ' A' ' 42' ' ' LEU . 32.7 m -141.98 174.53 6.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-O 121.214 0.531 . . . . 0.0 111.534 -179.447 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -96.43 145.48 17.85 Favored Glycine 0 CA--C 1.528 0.882 0 N-CA-C 109.506 -1.438 . . . . 0.0 109.506 178.39 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' GLN . . . . . 0.463 ' O ' ' OE1' ' A' ' 45' ' ' GLN . 1.9 tm0? -86.86 115.19 61.62 Favored Pre-proline 0 N--CA 1.464 0.235 0 CA-C-N 117.88 0.84 . . . . 0.0 111.838 -178.492 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 97.4 Cg_endo -84.92 160.55 11.86 Favored 'Trans proline' 0 C--N 1.307 -1.613 0 C-N-CA 121.51 1.473 . . . . 0.0 111.22 178.715 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.491 ' N ' ' CD ' ' A' ' 47' ' ' GLN . 12.4 mp0 -65.33 -40.4 93.66 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 112.422 0.527 . . . . 0.0 112.422 -178.677 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' ASP . . . . . 0.549 ' O ' ' N ' ' A' ' 50' ' ' ASN . 46.8 t0 -73.09 8.37 1.65 Allowed 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 111.89 0.33 . . . . 0.0 111.89 -178.592 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 49' ' ' TRP . . . . . 0.444 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 60.6 t-105 -59.3 69.62 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 111.828 0.307 . . . . 0.0 111.828 -179.579 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 50' ' ' ASN . . . . . 0.549 ' N ' ' O ' ' A' ' 48' ' ' ASP . 0.5 OUTLIER -93.21 79.06 4.5 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 120.439 -0.505 . . . . 0.0 110.024 178.909 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -142.94 161.25 27.54 Favored Glycine 0 CA--C 1.526 0.765 0 N-CA-C 111.417 -0.673 . . . . 0.0 111.417 -179.44 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -95.44 109.94 48.08 Favored Pre-proline 0 CA--C 1.535 0.366 0 N-CA-C 110.512 -0.181 . . . . 0.0 110.512 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 78.7 Cg_exo -46.32 -22.98 1.8 Allowed 'Trans proline' 0 N--CA 1.498 1.769 0 C-N-CA 122.713 2.275 . . . . 0.0 112.813 -179.785 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 3.4 mm100 -79.86 -24.23 41.4 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 120.354 -0.539 . . . . 0.0 111.652 -178.718 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.578 ' O ' ' CE1' ' A' ' 57' ' ' PHE . 82.1 mtt180 -92.15 148.81 37.49 Favored Pre-proline 0 C--N 1.33 -0.246 0 C-N-CA 120.721 -0.391 . . . . 0.0 110.403 -179.978 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 56' ' ' PRO . . . . . 0.575 ' O ' ' NE2' ' A' ' 24' ' ' GLN . 29.8 Cg_endo -63.23 160.87 32.79 Favored 'Trans proline' 0 N--CA 1.497 1.724 0 C-N-CA 123.07 2.514 . . . . 0.0 113.436 -178.761 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.691 ' CE2' ' NE2' ' A' ' 24' ' ' GLN . 49.0 m-85 -131.12 157.3 43.49 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 114.971 -1.013 . . . . 0.0 109.161 179.419 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.6 ' O ' HD12 ' A' ' 23' ' ' LEU . 64.8 mt-10 -122.21 138.46 54.47 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 178.245 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -118.98 137.08 53.76 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.316 0.487 . . . . 0.0 112.316 -178.116 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.622 ' HG3' HD11 ' A' ' 23' ' ' LEU . 9.4 mtm180 -123.11 127.73 49.13 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 108.379 -0.971 . . . . 0.0 108.379 177.237 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.556 HD23 ' C ' ' A' ' 60' ' ' ARG . 0.4 OUTLIER -109.88 144.16 38.75 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 120.638 -0.425 . . . . 0.0 110.736 -178.898 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 62' ' ' TYR . . . . . 0.431 ' N ' ' CD1' ' A' ' 62' ' ' TYR . 14.3 m-85 -125.47 109.47 12.75 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.694 179.862 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -106.17 -85.87 0.49 Allowed 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.39 -0.823 . . . . 0.0 109.488 179.579 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.413 ' H ' ' HB ' ' A' ' 67' ' ' VAL . . . -74.65 176.06 48.89 Favored Glycine 0 CA--C 1.521 0.428 0 N-CA-C 109.168 -1.573 . . . . 0.0 109.168 178.46 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.409 HD23 ' N ' ' A' ' 65' ' ' LEU . 2.0 mt -73.12 -33.18 65.39 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 119.667 -0.813 . . . . 0.0 110.011 -179.587 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 51.4 t0 -102.35 8.82 40.17 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.869 179.858 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' VAL . . . . . 0.54 ' O ' HG12 ' A' ' 67' ' ' VAL . 13.2 t -106.05 96.68 4.81 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.283 0 CA-C-O 121.364 0.602 . . . . 0.0 111.833 -178.832 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 7.9 tp -113.04 117.4 31.92 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 107.977 -1.12 . . . . 0.0 107.977 178.089 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.485 HG23 ' CB ' ' A' ' 94' ' ' SER . 8.5 mt -111.64 142.54 23.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-O 120.909 0.385 . . . . 0.0 110.881 -178.541 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 26.3 ttp180 -128.49 130.64 47.8 Favored 'General case' 0 C--O 1.24 0.553 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.343 179.824 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' MET . . . . . 0.783 ' SD ' HD12 ' A' ' 90' ' ' ILE . 1.4 mtm -139.42 147.63 41.69 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.739 -0.664 . . . . 0.0 109.575 179.238 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 22.0 tt0 -104.75 124.5 49.52 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 107.529 -1.286 . . . . 0.0 107.529 178.273 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.405 HG22 ' HA ' ' A' ' 87' ' ' CYS . 2.7 pt -134.34 160.75 41.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 C-N-CA 119.673 -0.811 . . . . 0.0 113.0 -177.162 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 35.5 m -121.13 152.2 39.0 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.057 -0.974 . . . . 0.0 109.46 178.804 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.59 HD12 ' CE1' ' A' ' 85' ' ' PHE . 10.2 tp -66.44 123.36 19.8 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.274 0.559 . . . . 0.0 109.97 -179.659 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -97.68 -41.7 7.98 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.854 178.373 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' TRP . . . . . 0.554 ' NE1' ' HA3' ' A' ' 84' ' ' GLY . 65.9 p-90 -171.22 165.04 7.3 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.556 -179.121 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -143.59 123.98 13.89 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 109.622 -0.511 . . . . 0.0 109.622 178.437 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 6.7 ttt180 -152.1 133.46 14.5 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 119.634 -0.826 . . . . 0.0 112.96 179.868 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 3.6 t70 57.01 47.03 18.32 Favored 'General case' 0 N--CA 1.462 0.139 0 N-CA-C 113.735 1.013 . . . . 0.0 113.735 176.804 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 82.56 -26.68 3.98 Favored Glycine 0 CA--C 1.523 0.532 0 C-N-CA 120.445 -0.883 . . . . 0.0 113.263 177.238 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.405 ' N ' HD23 ' A' ' 82' ' ' LEU . 5.0 mt -89.66 159.21 17.24 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 117.631 0.715 . . . . 0.0 110.362 -179.11 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 44.0 mt -132.0 135.73 46.75 Favored 'General case' 0 CA--C 1.516 -0.356 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.344 -179.16 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 84' ' ' GLY . . . . . 0.554 ' HA3' ' NE1' ' A' ' 77' ' ' TRP . . . -102.58 154.0 18.39 Favored Glycine 0 N--CA 1.452 -0.278 0 N-CA-C 109.758 -1.337 . . . . 0.0 109.758 178.714 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 85' ' ' PHE . . . . . 0.59 ' CE1' HD12 ' A' ' 75' ' ' LEU . 50.5 m-85 -145.36 136.55 24.89 Favored 'General case' 0 C--N 1.318 -0.763 0 C-N-CA 120.921 -0.312 . . . . 0.0 110.45 -179.66 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -104.01 128.96 51.6 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 179.53 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 87' ' ' CYS . . . . . 0.546 ' O ' ' CE1' ' A' ' 39' ' ' HIS . 42.9 t -69.38 120.45 15.2 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 112.378 0.51 . . . . 0.0 112.378 -178.237 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 7.5 mm100 -94.58 -34.79 12.51 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.075 178.935 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 89' ' ' HIS . . . . . 0.449 ' ND1' ' C ' ' A' ' 89' ' ' HIS . 0.0 OUTLIER -161.41 141.89 10.9 Favored 'General case' 0 C--O 1.223 -0.338 0 CA-C-N 116.187 -0.46 . . . . 0.0 109.848 179.761 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.783 HD12 ' SD ' ' A' ' 71' ' ' MET . 6.0 tt -145.04 140.9 23.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-O 121.332 0.587 . . . . 0.0 110.465 -178.833 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -56.9 142.86 39.78 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 115.153 -0.931 . . . . 0.0 112.297 -178.455 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 5.0 tp -54.28 -42.04 69.57 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 114.892 -1.049 . . . . 0.0 110.319 -179.343 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 26.3 t0 -68.3 -42.65 79.15 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.04 179.603 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 94' ' ' SER . . . . . 0.485 ' CB ' HG23 ' A' ' 69' ' ' ILE . 14.8 m -60.07 -38.39 82.7 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.062 179.5 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 50.8 mt -58.79 -38.46 72.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.317 179.913 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -70.97 -40.79 71.73 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.235 -0.586 . . . . 0.0 111.157 -179.204 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 60.0 m-70 . . . . . 0 C--N 1.325 -0.494 0 C-N-CA 119.177 -1.009 . . . . 0.0 108.704 179.87 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 12.2 mm . . . . . 0 C--O 1.232 0.18 0 N-CA-C 110.085 -0.339 . . . . 0.0 110.085 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -93.67 120.55 34.08 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.506 0.669 . . . . 0.0 111.714 -179.221 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 2.9 p90 -149.37 156.9 42.78 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 114.803 -1.09 . . . . 0.0 108.2 178.298 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -95.51 146.18 24.63 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 120.009 -0.676 . . . . 0.0 110.82 -179.106 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . 179.57 176.75 0.63 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.065 179.865 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -96.47 134.23 39.92 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.731 -179.659 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.508 ' O ' ' O ' ' A' ' 31' ' ' VAL . 6.5 p -134.06 151.89 51.6 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.16 0.505 . . . . 0.0 110.451 178.914 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 22.8 mm-40 -129.27 144.43 51.22 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.679 -0.691 . . . . 0.0 109.169 179.654 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 75.4 mt -126.9 136.46 60.73 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.326 0 C-N-CA 120.352 -0.539 . . . . 0.0 110.869 -179.782 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -125.46 123.27 38.85 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.538 -0.756 . . . . 0.0 111.256 -178.893 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.548 ' OE1' ' CE2' ' A' ' 57' ' ' PHE . 23.8 tt0 -129.58 102.33 6.32 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.453 -0.794 . . . . 0.0 109.717 178.715 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 80.41 -126.23 7.31 Favored Glycine 0 CA--C 1.523 0.564 0 N-CA-C 109.789 -1.324 . . . . 0.0 109.789 -178.96 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -101.42 11.77 38.54 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.816 0.341 . . . . 0.0 110.277 179.58 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.559 ' HB3' ' CZ2' ' A' ' 29' ' ' TRP . 48.0 mtt180 -114.29 134.18 55.13 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 112.664 0.616 . . . . 0.0 112.664 -178.189 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 56.5 ttt180 -127.88 149.48 50.28 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.421 179.288 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.559 ' CZ2' ' HB3' ' A' ' 27' ' ' ARG . 7.2 m-90 -146.31 156.04 43.07 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.477 -179.568 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -100.7 135.23 42.47 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.585 179.22 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.508 ' O ' ' O ' ' A' ' 20' ' ' SER . 28.9 m -145.73 156.3 12.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 C-N-CA 120.652 -0.419 . . . . 0.0 110.83 -179.663 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.519 ' H ' HD23 ' A' ' 32' ' ' LEU . 0.3 OUTLIER -95.12 130.32 41.87 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 108.518 -0.919 . . . . 0.0 108.518 178.429 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.5 tt -90.1 126.01 35.63 Favored 'General case' 0 C--N 1.325 -0.492 0 C-N-CA 120.203 -0.599 . . . . 0.0 110.179 -179.478 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' HIS . . . . . 0.408 ' NE2' HD12 ' A' ' 32' ' ' LEU . 79.3 m-70 -90.29 -30.98 17.15 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.055 -0.975 . . . . 0.0 111.704 -178.811 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -173.67 162.31 4.08 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 119.632 -0.827 . . . . 0.0 111.434 178.303 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' VAL . . . . . 0.536 HG22 ' H ' ' A' ' 37' ' ' SER . 4.1 p -144.75 168.77 9.21 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.112 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.117 -179.549 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' SER . . . . . 0.536 ' H ' HG22 ' A' ' 36' ' ' VAL . 18.8 t -142.33 167.27 22.49 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 107.402 -1.333 . . . . 0.0 107.402 178.262 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.527 ' H ' HD12 ' A' ' 38' ' ' LEU . 1.7 mp -62.42 1.4 0.35 Allowed 'General case' 0 C--N 1.322 -0.588 0 C-N-CA 119.412 -0.915 . . . . 0.0 110.635 -179.483 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' HIS . . . . . 0.483 ' H ' ' C ' ' A' ' 37' ' ' SER . 0.0 OUTLIER -168.34 44.89 0.04 OUTLIER 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 120.655 -0.418 . . . . 0.0 111.338 179.868 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -177.71 150.44 9.99 Favored Glycine 0 CA--C 1.527 0.782 0 N-CA-C 110.573 -1.011 . . . . 0.0 110.573 179.768 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.588 HG21 HG21 ' A' ' 73' ' ' ILE . 0.1 OUTLIER -147.02 148.65 16.45 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.222 0 CA-C-O 121.317 0.579 . . . . 0.0 111.656 -179.082 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.529 HD23 ' N ' ' A' ' 43' ' ' VAL . 1.1 tt -121.87 139.69 53.32 Favored 'General case' 0 N--CA 1.464 0.262 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 178.596 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.529 ' N ' HD23 ' A' ' 42' ' ' LEU . 18.8 m -143.72 175.15 3.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 C-N-CA 120.129 -0.628 . . . . 0.0 112.058 -178.8 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -98.13 143.98 16.99 Favored Glycine 0 CA--C 1.528 0.853 0 N-CA-C 109.224 -1.55 . . . . 0.0 109.224 177.845 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' GLN . . . . . 0.499 ' O ' ' CD ' ' A' ' 45' ' ' GLN . 0.0 OUTLIER -86.25 120.16 72.11 Favored Pre-proline 0 CA--C 1.532 0.262 0 CA-C-N 118.075 0.938 . . . . 0.0 112.046 -178.224 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_endo -86.24 159.64 9.83 Favored 'Trans proline' 0 C--N 1.308 -1.564 0 C-N-CA 121.797 1.665 . . . . 0.0 110.906 178.278 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 65.7 mt-30 -65.38 -40.23 93.25 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.315 0.487 . . . . 0.0 112.315 -178.936 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' ASP . . . . . 0.554 ' O ' ' NE1' ' A' ' 29' ' ' TRP . 29.5 m-20 -73.59 8.4 1.87 Allowed 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 111.975 0.361 . . . . 0.0 111.975 -178.71 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 49' ' ' TRP . . . . . 0.445 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 58.9 t-105 -59.51 69.57 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 111.914 0.338 . . . . 0.0 111.914 -179.308 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 50' ' ' ASN . . . . . 0.551 ' N ' ' O ' ' A' ' 48' ' ' ASP . 26.7 t-20 -93.39 78.92 4.41 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 120.159 -0.616 . . . . 0.0 109.953 178.729 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -142.88 159.93 27.42 Favored Glycine 0 CA--C 1.524 0.632 0 N-CA-C 111.548 -0.621 . . . . 0.0 111.548 -179.647 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -94.2 111.25 52.65 Favored Pre-proline 0 CA--C 1.536 0.422 0 CA-C-N 115.543 -0.329 . . . . 0.0 110.744 -179.817 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_exo -47.99 -23.31 4.21 Favored 'Trans proline' 0 N--CA 1.497 1.721 0 C-N-CA 122.473 2.116 . . . . 0.0 112.366 179.762 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 1.7 mm100 -78.25 -24.01 47.07 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.782 -178.96 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.558 ' O ' ' CE1' ' A' ' 57' ' ' PHE . 44.3 mtp85 -94.54 148.9 35.72 Favored Pre-proline 0 C--N 1.331 -0.232 0 C-N-CA 120.598 -0.441 . . . . 0.0 110.138 179.94 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 56' ' ' PRO . . . . . 0.423 ' O ' ' OE1' ' A' ' 24' ' ' GLN . 31.1 Cg_endo -63.43 160.82 33.74 Favored 'Trans proline' 0 N--CA 1.494 1.527 0 C-N-CA 122.93 2.42 . . . . 0.0 113.337 -178.598 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.558 ' CE1' ' O ' ' A' ' 55' ' ' ARG . 34.2 m-85 -130.5 158.42 39.99 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 114.8 -1.091 . . . . 0.0 108.922 179.346 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 69.3 mt-10 -121.39 135.34 55.08 Favored 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 108.644 -0.873 . . . . 0.0 108.644 178.175 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' ALA . . . . . 0.563 ' HB2' ' CD1' ' A' ' 73' ' ' ILE . . . -118.02 138.15 52.41 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.281 0.562 . . . . 0.0 111.645 -177.958 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 47.6 mtm180 -124.71 128.11 48.29 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 178.024 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 10.2 mt -107.16 143.0 35.97 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 120.431 -0.508 . . . . 0.0 111.098 -178.522 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' TYR . . . . . 0.473 ' N ' ' CD1' ' A' ' 62' ' ' TYR . 7.7 m-85 -125.93 107.78 10.79 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.242 179.471 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.486 HD23 ' C ' ' A' ' 63' ' ' LEU . 1.9 tt -104.53 -85.37 0.47 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.441 -0.799 . . . . 0.0 109.436 179.688 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.447 ' H ' ' HB ' ' A' ' 67' ' ' VAL . . . -74.23 178.09 44.79 Favored Glycine 0 CA--C 1.522 0.482 0 N-CA-C 109.139 -1.584 . . . . 0.0 109.139 178.403 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.66 HD12 ' N ' ' A' ' 65' ' ' LEU . 7.9 mp -74.63 -31.44 61.98 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 119.846 -0.742 . . . . 0.0 110.151 -179.777 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -103.84 9.5 36.86 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 123.054 0.542 . . . . 0.0 110.798 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' VAL . . . . . 0.521 ' O ' HG12 ' A' ' 67' ' ' VAL . 20.7 t -105.71 96.06 4.3 Favored 'Isoleucine or valine' 0 C--O 1.234 0.277 0 CA-C-O 121.206 0.527 . . . . 0.0 111.855 -178.929 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 3.8 tp -113.14 117.3 31.55 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 108.128 -1.064 . . . . 0.0 108.128 178.405 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.471 HG23 ' CB ' ' A' ' 94' ' ' SER . 17.7 mm -112.5 143.82 21.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 120.926 0.393 . . . . 0.0 111.049 -178.677 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.473 ' C ' ' HG2' ' A' ' 71' ' ' MET . 59.2 mtp180 -127.64 130.31 48.74 Favored 'General case' 0 C--O 1.239 0.516 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.374 179.3 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 71' ' ' MET . . . . . 0.739 ' SD ' HD12 ' A' ' 90' ' ' ILE . 0.1 OUTLIER -142.4 147.69 36.61 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.223 -0.898 . . . . 0.0 109.476 -179.576 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -102.05 128.89 48.31 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 108.017 -1.105 . . . . 0.0 108.017 178.587 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.588 HG21 HG21 ' A' ' 41' ' ' ILE . 25.9 pt -136.77 157.62 36.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 C-N-CA 119.836 -0.746 . . . . 0.0 112.836 -177.611 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 2.0 p -122.63 155.41 36.42 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 115.068 -0.969 . . . . 0.0 109.414 178.393 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.524 ' CD1' ' CZ ' ' A' ' 85' ' ' PHE . 7.1 tp -70.43 126.13 28.76 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.591 0.71 . . . . 0.0 110.782 -179.752 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -98.36 -43.66 6.84 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 114.515 -1.22 . . . . 0.0 111.138 178.103 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' TRP . . . . . 0.674 ' NE1' ' HA3' ' A' ' 84' ' ' GLY . 69.3 p-90 -167.71 172.4 9.28 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.425 -178.884 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -151.36 123.69 8.32 Favored 'General case' 0 N--CA 1.467 0.39 0 N-CA-C 110.032 -0.358 . . . . 0.0 110.032 178.373 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 61.4 ttt180 -152.58 133.54 14.11 Favored 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 112.91 0.708 . . . . 0.0 112.91 179.842 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 25.7 t0 56.71 47.22 18.66 Favored 'General case' 0 N--CA 1.464 0.229 0 N-CA-C 114.055 1.132 . . . . 0.0 114.055 176.154 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 83.98 -27.51 4.41 Favored Glycine 0 CA--C 1.522 0.529 0 C-N-CA 120.385 -0.912 . . . . 0.0 113.242 177.128 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 4.4 mt -89.52 161.26 16.31 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 117.664 0.732 . . . . 0.0 110.41 -178.994 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.406 HD11 ' CB ' ' A' ' 45' ' ' GLN . 42.3 mt -133.93 135.36 43.52 Favored 'General case' 0 CA--C 1.518 -0.272 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.242 -179.236 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 84' ' ' GLY . . . . . 0.674 ' HA3' ' NE1' ' A' ' 77' ' ' TRP . . . -94.84 152.36 20.47 Favored Glycine 0 N--CA 1.451 -0.331 0 N-CA-C 109.962 -1.255 . . . . 0.0 109.962 178.999 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 85' ' ' PHE . . . . . 0.524 ' CZ ' ' CD1' ' A' ' 75' ' ' LEU . 29.0 m-85 -145.47 133.77 21.75 Favored 'General case' 0 C--N 1.319 -0.754 0 C-N-CA 120.985 -0.286 . . . . 0.0 110.492 -179.602 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -103.8 127.93 51.25 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 108.555 -0.905 . . . . 0.0 108.555 179.242 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 87' ' ' CYS . . . . . 0.565 ' HA ' HG22 ' A' ' 73' ' ' ILE . 2.3 t -67.69 119.89 13.16 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.925 0.393 . . . . 0.0 111.704 -178.595 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 4.4 tp60 -89.33 -36.35 15.59 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.973 179.782 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 89' ' ' HIS . . . . . 0.485 ' C ' ' ND1' ' A' ' 89' ' ' HIS . 0.0 OUTLIER -166.43 147.8 6.45 Favored 'General case' 0 C--O 1.224 -0.237 0 CA-C-N 116.028 -0.533 . . . . 0.0 109.921 179.371 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.739 HD12 ' SD ' ' A' ' 71' ' ' MET . 10.4 tt -145.27 141.1 22.7 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-O 121.418 0.628 . . . . 0.0 110.568 -178.984 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 91' ' ' ASP . . . . . 0.504 ' CB ' ' OG ' ' A' ' 94' ' ' SER . 0.0 OUTLIER -55.6 141.56 37.04 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 115.045 -0.98 . . . . 0.0 112.27 -178.077 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 5.2 tp -54.72 -42.33 71.42 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.192 -0.913 . . . . 0.0 110.294 -179.937 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -68.62 -42.9 77.43 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.264 -0.425 . . . . 0.0 109.93 179.625 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 94' ' ' SER . . . . . 0.504 ' OG ' ' CB ' ' A' ' 91' ' ' ASP . 1.5 p -60.24 -36.32 77.47 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.022 -0.536 . . . . 0.0 109.918 179.303 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 95' ' ' ILE . . . . . 0.412 ' CG1' HG23 ' A' ' 90' ' ' ILE . 38.2 mt -60.35 -38.77 78.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.16 179.894 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -70.44 -37.53 74.39 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 120.342 -0.543 . . . . 0.0 110.852 -178.856 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 67.2 m-70 . . . . . 0 C--N 1.323 -0.548 0 C-N-CA 119.666 -0.814 . . . . 0.0 109.385 179.668 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 41.1 mm . . . . . 0 CA--C 1.52 -0.204 0 CA-C-O 120.654 0.264 . . . . 0.0 110.386 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -91.82 120.22 32.33 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.416 0.627 . . . . 0.0 110.99 179.907 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 3.1 p90 -149.8 158.65 44.37 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.034 -0.984 . . . . 0.0 108.423 178.18 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 3.1 p30 -95.34 144.67 25.7 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 120.184 -0.606 . . . . 0.0 110.051 -179.62 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -177.49 175.7 1.39 Allowed 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 179.697 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -96.37 134.24 39.77 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.704 -179.716 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.542 ' O ' ' O ' ' A' ' 31' ' ' VAL . 10.7 p -134.04 152.7 51.95 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.109 0.481 . . . . 0.0 110.293 178.851 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 12.0 mm-40 -129.5 141.53 50.98 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 179.625 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -122.21 135.72 61.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 C-N-CA 120.096 -0.642 . . . . 0.0 110.371 179.771 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.432 ' H ' HD12 ' A' ' 23' ' ' LEU . 0.1 OUTLIER -126.12 123.15 37.66 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.32 -0.854 . . . . 0.0 110.934 -179.133 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.732 ' NE2' ' CE2' ' A' ' 57' ' ' PHE . 8.7 tt0 -128.79 101.82 6.28 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.245 -0.889 . . . . 0.0 109.678 178.849 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 80.11 -126.77 7.59 Favored Glycine 0 CA--C 1.523 0.55 0 N-CA-C 110.138 -1.185 . . . . 0.0 110.138 -178.999 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -99.65 11.31 39.53 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.844 0.354 . . . . 0.0 110.325 179.57 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.551 ' HB3' ' CZ2' ' A' ' 29' ' ' TRP . 67.7 mtt180 -113.24 134.97 54.32 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 112.422 0.527 . . . . 0.0 112.422 -178.369 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 28.0 ttt180 -129.29 150.62 50.58 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.51 179.65 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.551 ' CZ2' ' HB3' ' A' ' 27' ' ' ARG . 7.0 m-90 -149.0 156.5 42.35 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.675 -178.919 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 14.7 mt-10 -100.28 134.59 42.99 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.003 179.292 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.542 ' O ' ' O ' ' A' ' 20' ' ' SER . 16.8 m -145.9 158.03 12.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 121.104 0.478 . . . . 0.0 111.306 -179.628 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.957 ' H ' HD23 ' A' ' 32' ' ' LEU . 1.4 pt? -97.0 130.21 44.36 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 178.505 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.4 tt -93.29 126.63 38.5 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.27 0.557 . . . . 0.0 109.731 -179.946 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 45.8 m-70 -92.31 -26.09 18.27 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.397 -0.819 . . . . 0.0 111.923 -178.36 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -174.24 159.45 3.15 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 119.528 -0.869 . . . . 0.0 111.12 177.652 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' VAL . . . . . 0.531 HG22 ' N ' ' A' ' 37' ' ' SER . 6.7 p -142.82 168.89 13.14 Favored 'Isoleucine or valine' 0 C--O 1.231 0.099 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.84 -179.178 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' SER . . . . . 0.531 ' N ' HG22 ' A' ' 36' ' ' VAL . 22.9 t -142.36 169.15 18.12 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 107.889 -1.152 . . . . 0.0 107.889 178.926 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 91.4 mt -66.23 -1.25 3.12 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 119.642 -0.823 . . . . 0.0 110.941 -179.438 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' HIS . . . . . 0.513 ' NE2' ' O ' ' A' ' 87' ' ' CYS . 3.7 t60 -161.32 38.98 0.14 Allowed 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 120.839 -0.344 . . . . 0.0 111.179 -179.847 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -175.77 154.67 17.98 Favored Glycine 0 CA--C 1.527 0.825 0 N-CA-C 110.929 -0.868 . . . . 0.0 110.929 179.88 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -148.04 148.87 15.82 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.345 0 CA-C-O 121.389 0.614 . . . . 0.0 111.809 -178.87 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.694 HD23 ' N ' ' A' ' 43' ' ' VAL . 1.8 tt -122.22 140.85 52.11 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 115.088 -0.96 . . . . 0.0 109.1 178.836 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.694 ' N ' HD23 ' A' ' 42' ' ' LEU . 20.8 m -145.42 174.84 2.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-O 121.12 0.486 . . . . 0.0 111.633 -179.568 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -97.9 145.77 17.93 Favored Glycine 0 CA--C 1.529 0.913 0 N-CA-C 109.961 -1.256 . . . . 0.0 109.961 178.86 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 1.6 tm0? -87.64 113.76 55.85 Favored Pre-proline 0 N--CA 1.463 0.184 0 CA-C-N 117.923 0.862 . . . . 0.0 111.841 -178.574 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 77.2 Cg_endo -85.26 163.37 11.32 Favored 'Trans proline' 0 C--N 1.305 -1.752 0 C-N-CA 121.625 1.55 . . . . 0.0 111.289 178.899 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -65.39 -40.52 93.56 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 116.519 -0.309 . . . . 0.0 111.815 -179.054 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 48' ' ' ASP . . . . . 0.53 ' O ' ' N ' ' A' ' 50' ' ' ASN . 86.0 m-20 -71.28 8.63 0.96 Allowed 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 111.926 0.343 . . . . 0.0 111.926 -178.819 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 49' ' ' TRP . . . . . 0.46 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 61.8 t-105 -61.56 67.4 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 111.856 0.317 . . . . 0.0 111.856 -179.576 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 50' ' ' ASN . . . . . 0.53 ' N ' ' O ' ' A' ' 48' ' ' ASP . 11.5 t30 -93.1 78.71 4.57 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 178.569 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -142.7 159.34 27.28 Favored Glycine 0 CA--C 1.523 0.583 0 N-CA-C 111.239 -0.745 . . . . 0.0 111.239 -179.581 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 14.3 t0 -92.91 121.57 65.58 Favored Pre-proline 0 CA--C 1.534 0.362 0 N-CA-C 110.321 -0.251 . . . . 0.0 110.321 179.886 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -61.29 -22.38 74.44 Favored 'Trans proline' 0 N--CA 1.495 1.587 0 C-N-CA 122.477 2.118 . . . . 0.0 112.075 -179.513 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 58.7 mt-30 -77.45 -20.08 55.04 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.12 -179.492 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.471 ' O ' ' CE1' ' A' ' 57' ' ' PHE . 1.3 mtt85 -97.85 157.32 34.82 Favored Pre-proline 0 CA--C 1.531 0.215 0 CA-C-O 120.745 0.307 . . . . 0.0 110.23 179.926 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 56' ' ' PRO . . . . . 0.593 ' O ' ' NE2' ' A' ' 24' ' ' GLN . 55.7 Cg_endo -70.22 161.0 47.62 Favored 'Trans proline' 0 N--CA 1.495 1.606 0 C-N-CA 122.913 2.409 . . . . 0.0 113.298 -178.766 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.732 ' CE2' ' NE2' ' A' ' 24' ' ' GLN . 53.3 m-85 -131.16 155.63 46.7 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.053 -0.976 . . . . 0.0 109.142 179.605 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -121.34 137.74 54.56 Favored 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 178.517 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -119.74 137.82 53.7 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.143 0.497 . . . . 0.0 111.963 -178.201 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.601 ' HE ' ' CD1' ' A' ' 68' ' ' LEU . 7.0 mmm-85 -123.43 127.56 48.6 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 108.404 -0.961 . . . . 0.0 108.404 177.612 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 12.4 mt -107.18 149.08 28.09 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.906 0.384 . . . . 0.0 110.836 -178.965 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 10.3 m-85 -134.14 111.8 10.61 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.711 -179.735 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.548 HD23 ' C ' ' A' ' 63' ' ' LEU . 2.9 tt -105.94 -83.35 0.52 Allowed 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 115.812 -0.631 . . . . 0.0 109.5 179.444 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.456 ' H ' ' HB ' ' A' ' 67' ' ' VAL . . . -76.81 -177.12 44.42 Favored Glycine 0 CA--C 1.521 0.436 0 N-CA-C 109.326 -1.509 . . . . 0.0 109.326 178.699 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.667 HD12 ' N ' ' A' ' 65' ' ' LEU . 7.3 mp -75.45 -33.2 60.86 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 119.988 -0.685 . . . . 0.0 110.477 -179.612 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -102.63 8.96 39.59 Favored 'General case' 0 C--N 1.332 -0.168 0 C-N-CA 122.67 0.388 . . . . 0.0 111.323 -179.902 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' VAL . . . . . 0.573 ' O ' HG12 ' A' ' 67' ' ' VAL . 9.5 t -101.49 93.56 2.89 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.245 0 CA-C-O 121.197 0.523 . . . . 0.0 111.694 -178.864 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.601 ' CD1' ' HE ' ' A' ' 60' ' ' ARG . 1.9 tp -111.69 117.81 33.9 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 108.446 -0.946 . . . . 0.0 108.446 178.62 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.653 HG23 ' OG ' ' A' ' 94' ' ' SER . 3.6 mt -115.28 144.78 22.09 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.247 0 CA-C-O 120.945 0.402 . . . . 0.0 111.155 -178.815 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -128.46 134.42 48.73 Favored 'General case' 0 C--O 1.238 0.492 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.251 179.417 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 71' ' ' MET . . . . . 0.55 ' HE3' HD12 ' A' ' 90' ' ' ILE . 0.1 OUTLIER -143.75 148.15 35.22 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.439 -0.8 . . . . 0.0 109.557 179.472 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -110.82 121.49 45.47 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 107.975 -1.12 . . . . 0.0 107.975 178.509 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.683 HD12 ' CB ' ' A' ' 85' ' ' PHE . 4.2 pt -132.19 165.41 32.12 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 N-CA-C 113.627 0.973 . . . . 0.0 113.627 -176.621 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 3.3 p -120.09 148.96 42.96 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 114.926 -1.033 . . . . 0.0 109.642 178.71 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.535 HD12 ' CE1' ' A' ' 85' ' ' PHE . 14.2 tp -66.1 124.4 22.48 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-O 121.239 0.542 . . . . 0.0 110.542 -179.002 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -98.58 -44.89 6.28 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 115.307 -0.861 . . . . 0.0 111.429 178.205 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' TRP . . . . . 0.581 ' NE1' ' HA3' ' A' ' 84' ' ' GLY . 69.2 p-90 -164.91 172.34 12.96 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.808 -179.091 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -151.3 123.78 8.4 Favored 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 178.117 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' ARG . . . . . 0.547 ' O ' ' OD1' ' A' ' 80' ' ' ASP . 5.2 ttm180 -152.2 131.81 13.1 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 119.916 -0.713 . . . . 0.0 112.617 179.891 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 80' ' ' ASP . . . . . 0.563 ' OD2' ' O ' ' A' ' 80' ' ' ASP . 0.6 OUTLIER 53.61 46.76 25.36 Favored 'General case' 0 N--CA 1.467 0.418 0 N-CA-C 113.699 0.999 . . . . 0.0 113.699 177.117 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 72.32 12.15 76.38 Favored Glycine 0 CA--C 1.521 0.461 0 C-N-CA 120.433 -0.889 . . . . 0.0 111.856 178.114 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 52.4 mt -116.24 140.27 49.49 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 178.734 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 35.2 mt -128.17 135.72 50.13 Favored 'General case' 0 CA--C 1.512 -0.501 0 C-N-CA 120.715 -0.394 . . . . 0.0 111.339 -178.988 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 84' ' ' GLY . . . . . 0.581 ' HA3' ' NE1' ' A' ' 77' ' ' TRP . . . -110.66 156.67 15.43 Favored Glycine 0 N--CA 1.448 -0.558 0 N-CA-C 109.317 -1.513 . . . . 0.0 109.317 178.301 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 85' ' ' PHE . . . . . 0.683 ' CB ' HD12 ' A' ' 73' ' ' ILE . 78.4 m-85 -145.37 143.94 30.4 Favored 'General case' 0 C--N 1.312 -1.028 0 N-CA-C 110.001 -0.37 . . . . 0.0 110.001 -179.53 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 52.4 tt0 -103.64 130.16 51.06 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 179.355 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 87' ' ' CYS . . . . . 0.513 ' O ' ' NE2' ' A' ' 39' ' ' HIS . 4.6 t -69.26 118.67 12.44 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.492 0.553 . . . . 0.0 112.492 -177.926 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 58.7 mm-40 -92.43 -36.76 12.93 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.77 178.876 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 89' ' ' HIS . . . . . 0.449 ' ND1' ' C ' ' A' ' 89' ' ' HIS . 0.0 OUTLIER -164.0 143.79 8.06 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.966 179.955 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.602 HD11 ' OG ' ' A' ' 94' ' ' SER . 9.0 tt -145.61 141.3 22.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-O 121.254 0.55 . . . . 0.0 109.994 -179.592 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -58.5 141.04 53.03 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 115.272 -0.876 . . . . 0.0 112.434 -178.029 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 6.3 tp -54.15 -41.73 68.77 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 114.853 -1.067 . . . . 0.0 110.725 -179.491 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 93' ' ' ASP . . . . . 0.524 ' OD1' ' N ' ' A' ' 94' ' ' SER . 2.8 p30 -68.5 -37.18 79.86 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 179.469 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 94' ' ' SER . . . . . 0.653 ' OG ' HG23 ' A' ' 69' ' ' ILE . 1.6 t -67.2 -38.45 85.36 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.08 179.337 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 95' ' ' ILE . . . . . 0.471 ' CG1' HG23 ' A' ' 90' ' ' ILE . 56.4 mt -58.65 -37.81 67.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.324 179.886 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -70.24 -40.66 74.32 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.158 -0.617 . . . . 0.0 111.195 -178.489 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 61.2 m-70 . . . . . 0 C--N 1.326 -0.434 0 C-N-CA 119.359 -0.936 . . . . 0.0 109.207 179.767 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.752 ' N ' HD12 ' A' ' 14' ' ' ILE . 1.8 mp . . . . . 0 CA--C 1.521 -0.171 0 N-CA-C 109.863 -0.421 . . . . 0.0 109.863 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -95.19 120.5 35.53 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.506 0.669 . . . . 0.0 111.623 -179.363 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -149.73 155.57 40.39 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 114.791 -1.095 . . . . 0.0 108.363 178.022 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -95.44 146.81 24.13 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 120.159 -0.616 . . . . 0.0 110.863 -178.919 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.538 ' O ' HD12 ' A' ' 32' ' ' LEU . . . -179.79 176.99 0.72 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.9 -0.591 . . . . 0.0 109.926 179.598 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -96.12 133.88 39.86 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.79 -179.855 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.583 ' O ' ' O ' ' A' ' 31' ' ' VAL . 13.0 t -133.8 152.86 52.0 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.186 0.517 . . . . 0.0 110.215 178.692 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.538 ' OE1' ' NH2' ' A' ' 28' ' ' ARG . 97.0 mt-10 -129.09 155.67 45.09 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 109.136 -0.691 . . . . 0.0 109.136 179.291 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' ILE . . . . . 0.477 ' HA ' ' O ' ' A' ' 58' ' ' GLU . 34.2 mt -138.47 136.36 43.94 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.437 0 C-N-CA 120.005 -0.678 . . . . 0.0 111.263 -179.603 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.75 HD11 ' HE ' ' A' ' 60' ' ' ARG . 0.0 OUTLIER -125.29 127.79 47.23 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.419 -0.809 . . . . 0.0 111.261 -178.793 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.469 ' O ' ' OE1' ' A' ' 24' ' ' GLN . 1.6 tm0? -132.49 101.95 5.53 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.082 -0.963 . . . . 0.0 109.532 178.519 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 80.71 -126.51 7.43 Favored Glycine 0 CA--C 1.523 0.554 0 N-CA-C 110.111 -1.195 . . . . 0.0 110.111 -178.729 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.613 ' N ' ' OE1' ' A' ' 26' ' ' GLU . 6.0 pm0 -100.68 13.21 35.58 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 110.084 -0.339 . . . . 0.0 110.084 179.583 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.558 ' HB3' ' CZ2' ' A' ' 29' ' ' TRP . 33.5 mtt180 -114.54 135.83 53.69 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 112.755 0.65 . . . . 0.0 112.755 -178.312 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.538 ' NH2' ' OE1' ' A' ' 21' ' ' GLU . 26.7 ttt180 -128.74 148.7 50.87 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.174 179.206 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.558 ' CZ2' ' HB3' ' A' ' 27' ' ' ARG . 6.7 m-90 -147.2 156.13 42.7 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.655 -179.144 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 18.8 mt-10 -100.34 138.54 37.27 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 178.986 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.583 ' O ' ' O ' ' A' ' 20' ' ' SER . 12.0 m -148.06 157.96 8.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-O 121.223 0.535 . . . . 0.0 111.274 -179.454 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.538 HD12 ' O ' ' A' ' 18' ' ' ALA . 8.3 tp -98.31 130.03 45.0 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 108.301 -1.0 . . . . 0.0 108.301 178.816 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.537 ' N ' HD12 ' A' ' 32' ' ' LEU . 0.8 OUTLIER -92.12 125.96 37.01 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 120.334 -0.547 . . . . 0.0 109.881 179.895 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 73.3 m-70 -90.48 -28.74 18.36 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.418 -0.81 . . . . 0.0 111.742 -178.706 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -171.98 162.23 5.88 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 119.493 -0.883 . . . . 0.0 111.283 177.568 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' VAL . . . . . 0.511 HG22 ' H ' ' A' ' 37' ' ' SER . 4.8 p -146.04 168.88 6.64 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.11 0 CA-C-N 115.782 -0.645 . . . . 0.0 111.193 -178.798 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' SER . . . . . 0.511 ' H ' HG22 ' A' ' 36' ' ' VAL . 23.0 t -142.11 168.46 19.69 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 107.632 -1.247 . . . . 0.0 107.632 178.513 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 3.6 tp -64.41 -0.6 1.36 Allowed 'General case' 0 C--N 1.322 -0.588 0 C-N-CA 119.555 -0.858 . . . . 0.0 110.795 -179.277 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 2.0 p80 -162.25 43.16 0.13 Allowed 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 120.693 -0.403 . . . . 0.0 111.41 179.747 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 179.83 156.58 18.18 Favored Glycine 0 CA--C 1.528 0.898 0 N-CA-C 111.039 -0.824 . . . . 0.0 111.039 179.765 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.45 HG21 HG21 ' A' ' 73' ' ' ILE . 0.1 OUTLIER -148.57 148.76 15.69 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.355 0 CA-C-O 121.453 0.644 . . . . 0.0 111.664 -178.745 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.434 HD23 ' N ' ' A' ' 43' ' ' VAL . 0.9 OUTLIER -121.83 132.29 54.51 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 115.069 -0.969 . . . . 0.0 108.53 178.79 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.434 ' N ' HD23 ' A' ' 42' ' ' LEU . 31.7 m -136.62 174.84 11.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 121.316 0.579 . . . . 0.0 112.078 -179.172 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -98.57 144.56 17.3 Favored Glycine 0 CA--C 1.526 0.725 0 N-CA-C 109.263 -1.535 . . . . 0.0 109.263 178.109 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' GLN . . . . . 0.516 ' O ' ' CD ' ' A' ' 45' ' ' GLN . 0.0 OUTLIER -87.16 117.73 69.01 Favored Pre-proline 0 CA--C 1.534 0.33 0 CA-C-N 118.052 0.926 . . . . 0.0 111.862 -178.284 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 74.6 Cg_endo -85.85 160.16 10.43 Favored 'Trans proline' 0 C--N 1.306 -1.673 0 C-N-CA 121.772 1.648 . . . . 0.0 111.576 178.89 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 24.0 mm-40 -65.2 -25.33 67.66 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 112.291 0.478 . . . . 0.0 112.291 -178.888 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' ASP . . . . . 0.532 ' O ' ' N ' ' A' ' 50' ' ' ASN . 3.3 m-20 -86.68 8.82 20.84 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 111.661 0.245 . . . . 0.0 111.661 -178.897 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 49' ' ' TRP . . . . . 0.463 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 59.3 t-105 -60.56 66.9 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 112.265 0.468 . . . . 0.0 112.265 -179.421 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 50' ' ' ASN . . . . . 0.584 ' C ' HD22 ' A' ' 50' ' ' ASN . 0.2 OUTLIER -93.16 78.66 4.54 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 120.047 -0.661 . . . . 0.0 109.246 178.105 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -145.65 146.25 16.24 Favored Glycine 0 CA--C 1.523 0.54 0 N-CA-C 111.601 -0.6 . . . . 0.0 111.601 -179.07 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -77.75 121.97 84.99 Favored Pre-proline 0 C--N 1.328 -0.365 0 CA-C-N 115.427 -0.386 . . . . 0.0 110.714 -179.969 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 21.5 Cg_endo -62.12 -22.41 74.16 Favored 'Trans proline' 0 N--CA 1.496 1.634 0 C-N-CA 122.61 2.207 . . . . 0.0 112.113 -179.757 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 78.6 mt-30 -77.19 -24.19 51.41 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 120.477 -0.489 . . . . 0.0 111.429 -179.2 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.535 ' O ' ' CE1' ' A' ' 57' ' ' PHE . 17.1 mtp85 -92.88 155.42 41.56 Favored Pre-proline 0 C--N 1.331 -0.223 0 C-N-CA 120.836 -0.345 . . . . 0.0 110.383 -179.955 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_endo -68.0 161.16 45.42 Favored 'Trans proline' 0 N--CA 1.497 1.694 0 C-N-CA 123.059 2.506 . . . . 0.0 113.03 -179.057 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.535 ' CE1' ' O ' ' A' ' 55' ' ' ARG . 43.5 m-85 -131.09 157.31 43.42 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.35 -0.841 . . . . 0.0 109.415 179.595 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.477 ' O ' ' HA ' ' A' ' 22' ' ' ILE . 42.0 mt-10 -123.13 139.23 54.28 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 109.095 -0.706 . . . . 0.0 109.095 178.319 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -124.92 142.08 51.7 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 112.817 0.673 . . . . 0.0 112.817 -177.531 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.75 ' HE ' HD11 ' A' ' 23' ' ' LEU . 0.0 OUTLIER -124.95 128.08 48.05 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.115 -0.948 . . . . 0.0 109.288 177.215 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.538 HD11 ' SD ' ' A' ' 71' ' ' MET . 7.4 mt -108.59 129.38 55.32 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 120.569 -0.452 . . . . 0.0 110.431 -179.658 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 62' ' ' TYR . . . . . 0.43 ' CD1' ' N ' ' A' ' 62' ' ' TYR . 19.9 m-85 -110.67 109.66 20.02 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.002 0.429 . . . . 0.0 110.742 -179.957 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.526 HD23 ' C ' ' A' ' 63' ' ' LEU . 3.5 tt -104.19 -85.03 0.47 Allowed 'General case' 0 C--N 1.333 -0.116 0 CA-C-N 115.76 -0.655 . . . . 0.0 109.545 179.476 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.467 ' H ' ' HB ' ' A' ' 67' ' ' VAL . . . -76.3 176.89 51.49 Favored Glycine 0 CA--C 1.523 0.585 0 N-CA-C 109.337 -1.505 . . . . 0.0 109.337 178.7 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.725 ' C ' HD13 ' A' ' 65' ' ' LEU . 3.0 tm? -71.93 -37.31 70.05 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 120.031 -0.668 . . . . 0.0 109.604 -179.636 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 66' ' ' ASP . . . . . 0.427 ' O ' ' OD1' ' A' ' 66' ' ' ASP . 55.6 t0 -98.52 9.2 43.72 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.105 179.49 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 67' ' ' VAL . . . . . 0.558 ' O ' HG12 ' A' ' 67' ' ' VAL . 8.7 t -106.06 96.15 4.37 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.305 0 CA-C-O 121.405 0.621 . . . . 0.0 111.741 -178.875 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 7.8 tp -113.24 117.55 32.18 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 108.102 -1.073 . . . . 0.0 108.102 178.221 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.763 HG23 ' OG ' ' A' ' 94' ' ' SER . 3.6 mt -112.64 144.76 19.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 120.798 0.333 . . . . 0.0 110.948 -178.974 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 9.8 ptt180 -128.16 130.98 48.92 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.835 179.214 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' MET . . . . . 0.538 ' SD ' HD11 ' A' ' 61' ' ' LEU . 2.0 mtp -140.18 148.14 41.16 Favored 'General case' 0 C--O 1.227 -0.117 0 CA-C-N 115.719 -0.673 . . . . 0.0 109.902 179.836 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -103.78 126.54 50.98 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 107.627 -1.249 . . . . 0.0 107.627 178.143 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.45 HG21 HG21 ' A' ' 41' ' ' ILE . 11.2 pt -134.83 157.68 41.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 N-CA-C 112.953 0.723 . . . . 0.0 112.953 -177.44 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -122.52 154.69 37.53 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.023 -0.99 . . . . 0.0 109.623 178.723 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.523 ' CD1' ' CZ ' ' A' ' 85' ' ' PHE . 5.2 tp -66.47 120.74 13.9 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.226 0.536 . . . . 0.0 110.558 -179.828 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -97.69 -41.75 7.96 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.422 177.927 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' TRP . . . . . 0.597 ' NE1' ' HA3' ' A' ' 84' ' ' GLY . 67.6 p-90 -170.45 168.52 7.81 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 115.485 -0.78 . . . . 0.0 109.898 -179.647 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -148.15 123.89 10.53 Favored 'General case' 0 N--CA 1.464 0.27 0 N-CA-C 109.932 -0.395 . . . . 0.0 109.932 178.795 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 38.4 ttt85 -152.37 133.68 14.41 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 113.215 0.82 . . . . 0.0 113.215 179.863 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 13.3 t70 56.92 47.15 18.3 Favored 'General case' 0 N--CA 1.464 0.246 0 N-CA-C 114.227 1.195 . . . . 0.0 114.227 176.405 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 83.77 -28.08 4.12 Favored Glycine 0 CA--C 1.524 0.656 0 C-N-CA 120.314 -0.946 . . . . 0.0 113.153 177.114 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 3.5 mt -89.69 157.89 17.8 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 117.637 0.719 . . . . 0.0 110.206 -179.283 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 36.5 mt -129.62 135.34 48.42 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.308 -179.078 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 84' ' ' GLY . . . . . 0.597 ' HA3' ' NE1' ' A' ' 77' ' ' TRP . . . -96.29 152.4 20.21 Favored Glycine 0 N--CA 1.451 -0.347 0 N-CA-C 109.894 -1.283 . . . . 0.0 109.894 178.935 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 85' ' ' PHE . . . . . 0.523 ' CZ ' ' CD1' ' A' ' 75' ' ' LEU . 23.8 m-85 -145.67 132.75 20.36 Favored 'General case' 0 C--N 1.318 -0.772 0 C-N-CA 120.79 -0.364 . . . . 0.0 110.892 -179.2 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -103.92 126.32 50.95 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 178.994 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 5.6 t -68.72 122.12 17.89 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.015 0.436 . . . . 0.0 112.007 -178.408 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 6.8 mm100 -95.14 -34.05 12.42 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.078 179.348 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 89' ' ' HIS . . . . . 0.442 ' ND1' ' C ' ' A' ' 89' ' ' HIS . 0.0 OUTLIER -161.5 141.69 10.65 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.031 179.66 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.41 HD11 ' OG ' ' A' ' 94' ' ' SER . 7.1 tt -143.36 139.33 26.52 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-O 121.169 0.509 . . . . 0.0 109.988 -179.045 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -57.21 142.69 42.0 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 115.508 -0.769 . . . . 0.0 112.057 -178.312 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 3.3 tp -54.1 -42.05 68.98 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.222 -0.899 . . . . 0.0 110.457 -179.337 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 93' ' ' ASP . . . . . 0.522 ' OD1' ' N ' ' A' ' 94' ' ' SER . 1.4 p30 -67.07 -39.07 86.79 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 179.273 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 94' ' ' SER . . . . . 0.763 ' OG ' HG23 ' A' ' 69' ' ' ILE . 6.7 t -66.24 -37.0 84.47 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.573 -0.74 . . . . 0.0 110.185 179.268 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 95' ' ' ILE . . . . . 0.41 ' CG1' HG23 ' A' ' 90' ' ' ILE . 38.5 mt -58.61 -38.3 70.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.137 179.973 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -70.88 -41.54 71.23 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.354 -0.538 . . . . 0.0 111.203 -179.003 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 60.7 m-70 . . . . . 0 C--N 1.325 -0.465 0 C-N-CA 119.408 -0.917 . . . . 0.0 109.303 179.791 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.567 ' N ' HD12 ' A' ' 14' ' ' ILE . 2.4 mp . . . . . 0 CA--C 1.522 -0.134 0 CA-C-O 120.92 0.39 . . . . 0.0 111.043 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -95.14 120.21 34.96 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.635 179.145 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 2.2 p90 -150.11 157.82 43.52 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 108.503 -0.925 . . . . 0.0 108.503 178.02 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -95.77 143.37 27.07 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 120.139 -0.624 . . . . 0.0 110.77 -179.372 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.559 ' O ' HD12 ' A' ' 32' ' ' LEU . . . -176.48 175.23 1.79 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.665 179.091 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -96.33 134.03 39.96 Favored 'General case' 0 C--N 1.326 -0.45 0 C-N-CA 120.647 -0.421 . . . . 0.0 111.141 -179.598 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.495 ' O ' ' O ' ' A' ' 31' ' ' VAL . 11.0 p -133.52 152.39 51.9 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.019 178.588 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.442 ' CG ' HH21 ' A' ' 28' ' ' ARG . 6.1 mm-40 -131.31 136.74 48.38 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 179.814 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 1.1 mm -117.45 135.37 58.08 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.552 0 C-N-CA 120.197 -0.601 . . . . 0.0 110.338 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -130.56 122.78 28.16 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.78 -179.321 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.535 ' OE1' ' CZ ' ' A' ' 57' ' ' PHE . 24.2 tt0 -124.64 101.78 7.28 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 114.735 -1.12 . . . . 0.0 109.823 179.097 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 82.14 -124.53 6.52 Favored Glycine 0 CA--C 1.523 0.557 0 N-CA-C 110.055 -1.218 . . . . 0.0 110.055 -178.952 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -100.53 10.64 40.91 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.776 0.322 . . . . 0.0 110.197 179.555 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.53 ' HB3' ' CZ2' ' A' ' 29' ' ' TRP . 17.5 mtt180 -112.58 133.57 54.56 Favored 'General case' 0 C--N 1.332 -0.158 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 -178.502 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.442 HH21 ' CG ' ' A' ' 21' ' ' GLU . 49.2 ttt180 -128.47 152.88 47.73 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.388 179.212 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.53 ' CZ2' ' HB3' ' A' ' 27' ' ' ARG . 6.6 m-90 -151.02 156.9 42.08 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.709 -178.691 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.538 ' H ' ' CD ' ' A' ' 30' ' ' GLU . 2.3 mp0 -99.94 136.18 40.24 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 179.159 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.495 ' O ' ' O ' ' A' ' 20' ' ' SER . 30.7 m -145.36 156.65 13.35 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-O 121.049 0.452 . . . . 0.0 111.001 -179.451 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.559 HD12 ' O ' ' A' ' 18' ' ' ALA . 10.7 tp -97.41 129.71 44.61 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 108.42 -0.956 . . . . 0.0 108.42 178.811 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.472 ' N ' HD12 ' A' ' 32' ' ' LEU . 0.5 OUTLIER -90.14 124.41 34.79 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.152 0.501 . . . . 0.0 110.111 -179.729 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 75.4 m-70 -91.02 -31.56 16.26 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.375 -0.829 . . . . 0.0 111.414 -178.87 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 1.9 p30 -170.8 161.87 7.4 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 119.577 -0.849 . . . . 0.0 111.125 177.387 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' VAL . . . . . 0.512 HG22 ' N ' ' A' ' 37' ' ' SER . 5.4 p -146.78 169.11 5.16 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.168 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.307 -178.572 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' SER . . . . . 0.512 ' N ' HG22 ' A' ' 36' ' ' VAL . 14.7 t -140.09 171.78 13.7 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 107.956 -1.127 . . . . 0.0 107.956 178.224 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 4.0 tp -68.18 0.79 3.35 Favored 'General case' 0 C--N 1.324 -0.514 0 C-N-CA 120.124 -0.63 . . . . 0.0 111.185 -179.091 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -160.78 35.21 0.15 Allowed 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.573 -0.451 . . . . 0.0 111.141 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -174.02 159.93 29.55 Favored Glycine 0 CA--C 1.524 0.656 0 N-CA-C 110.943 -0.863 . . . . 0.0 110.943 179.673 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -148.22 148.91 15.7 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.277 0 CA-C-O 121.46 0.648 . . . . 0.0 111.839 -178.664 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -121.57 134.84 55.02 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 114.839 -1.073 . . . . 0.0 108.612 178.662 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 33.3 m -139.63 175.05 7.79 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-O 121.234 0.54 . . . . 0.0 111.698 -179.444 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -99.47 143.7 16.66 Favored Glycine 0 N--CA 1.467 0.746 0 N-CA-C 108.774 -1.73 . . . . 0.0 108.774 177.987 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' GLN . . . . . 0.52 ' O ' ' CD ' ' A' ' 45' ' ' GLN . 4.0 pp0? -85.66 121.7 73.3 Favored Pre-proline 0 CA--C 1.534 0.332 0 CA-C-N 118.221 1.01 . . . . 0.0 111.659 -178.314 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 79.8 Cg_endo -86.6 161.74 9.38 Favored 'Trans proline' 0 C--N 1.303 -1.82 0 C-N-CA 121.766 1.644 . . . . 0.0 111.106 178.447 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.4 mm100 -65.72 -39.65 91.41 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 111.9 0.334 . . . . 0.0 111.9 -179.32 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' ASP . . . . . 0.528 ' O ' ' N ' ' A' ' 50' ' ' ASN . 79.2 m-20 -72.48 8.7 1.29 Allowed 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 111.912 0.338 . . . . 0.0 111.912 -178.873 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 49' ' ' TRP . . . . . 0.462 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 64.8 t-105 -59.84 66.72 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 112.324 0.49 . . . . 0.0 112.324 -179.344 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' ASN . . . . . 0.538 ' O ' ' ND2' ' A' ' 50' ' ' ASN . 1.8 t30 -93.07 78.71 4.59 Favored 'General case' 0 C--N 1.326 -0.43 0 C-N-CA 119.947 -0.701 . . . . 0.0 109.302 178.176 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -144.39 144.23 13.11 Favored Glycine 0 CA--C 1.525 0.682 0 N-CA-C 111.578 -0.609 . . . . 0.0 111.578 -179.199 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -78.62 121.99 84.31 Favored Pre-proline 0 CA--C 1.534 0.357 0 CA-C-N 115.795 -0.203 . . . . 0.0 110.811 -179.898 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -60.93 -22.93 75.97 Favored 'Trans proline' 0 N--CA 1.495 1.59 0 C-N-CA 122.443 2.096 . . . . 0.0 112.433 -179.576 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' GLN . . . . . 0.589 ' C ' ' HE ' ' A' ' 55' ' ' ARG . 28.2 mt-30 -75.5 -23.73 56.78 Favored 'General case' 0 C--N 1.323 -0.544 0 C-N-CA 120.36 -0.536 . . . . 0.0 111.059 -179.634 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.589 ' HE ' ' C ' ' A' ' 54' ' ' GLN . 0.0 OUTLIER -94.11 151.45 39.64 Favored Pre-proline 0 C--N 1.33 -0.252 0 CA-C-O 120.851 0.358 . . . . 0.0 110.043 179.981 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 56' ' ' PRO . . . . . 0.438 ' O ' ' OE1' ' A' ' 24' ' ' GLN . 33.2 Cg_endo -64.03 160.92 35.5 Favored 'Trans proline' 0 N--CA 1.495 1.615 0 C-N-CA 123.068 2.512 . . . . 0.0 113.532 -178.833 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.535 ' CZ ' ' OE1' ' A' ' 24' ' ' GLN . 58.7 m-85 -130.79 156.38 45.09 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 114.926 -1.034 . . . . 0.0 109.191 179.366 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -123.36 136.74 54.8 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 178.537 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' ALA . . . . . 0.605 ' HB2' HD13 ' A' ' 73' ' ' ILE . . . -115.33 135.42 54.16 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.971 0.415 . . . . 0.0 111.915 -178.545 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 3.7 mmm180 -122.91 127.42 48.92 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 108.547 -0.908 . . . . 0.0 108.547 177.725 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 13.5 mt -108.35 151.24 26.26 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.908 0.385 . . . . 0.0 111.001 -178.895 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' TYR . . . . . 0.407 ' CD1' ' N ' ' A' ' 62' ' ' TYR . 12.7 m-85 -134.61 110.68 9.47 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.62 179.809 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.472 HD23 ' C ' ' A' ' 63' ' ' LEU . 1.4 tt -106.01 -81.91 0.54 Allowed 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.625 179.608 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.464 ' H ' ' HB ' ' A' ' 67' ' ' VAL . . . -79.84 -177.88 50.96 Favored Glycine 0 CA--C 1.521 0.41 0 N-CA-C 109.343 -1.503 . . . . 0.0 109.343 178.678 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 5.5 mt -76.13 -33.42 59.43 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 119.806 -0.758 . . . . 0.0 110.478 -179.535 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -101.67 8.35 41.68 Favored 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 122.616 0.367 . . . . 0.0 110.849 179.886 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' VAL . . . . . 0.563 ' O ' HG12 ' A' ' 67' ' ' VAL . 12.1 t -103.95 94.1 2.99 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.195 0 CA-C-O 121.336 0.589 . . . . 0.0 111.877 -178.769 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 5.4 tp -113.65 117.33 31.26 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 108.088 -1.079 . . . . 0.0 108.088 178.156 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.516 HG23 ' CB ' ' A' ' 94' ' ' SER . 3.9 mt -112.09 144.39 19.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-O 120.943 0.401 . . . . 0.0 111.174 -178.814 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.442 ' C ' ' HG2' ' A' ' 71' ' ' MET . 0.5 OUTLIER -128.2 130.1 47.49 Favored 'General case' 0 C--O 1.239 0.547 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.653 179.183 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 71' ' ' MET . . . . . 0.769 ' SD ' HD12 ' A' ' 90' ' ' ILE . 0.0 OUTLIER -138.54 146.83 42.37 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.771 -0.649 . . . . 0.0 109.829 179.551 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 72' ' ' GLU . . . . . 0.454 ' OE2' ' O ' ' A' ' 57' ' ' PHE . 15.4 tp10 -99.59 132.83 44.67 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 107.551 -1.277 . . . . 0.0 107.551 178.663 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.605 HD13 ' HB2' ' A' ' 59' ' ' ALA . 2.0 pt -143.16 157.17 17.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 C-N-CA 119.182 -1.007 . . . . 0.0 113.102 -177.732 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 7.2 m -123.11 155.87 36.1 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-N 115.111 -0.95 . . . . 0.0 110.022 179.043 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.587 HD22 ' CE1' ' A' ' 85' ' ' PHE . 0.2 OUTLIER -64.56 118.33 8.67 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.793 0.33 . . . . 0.0 110.698 -179.252 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 76' ' ' ALA . . . . . 0.556 ' N ' HD13 ' A' ' 75' ' ' LEU . . . -97.1 -43.32 7.45 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-O 121.136 0.493 . . . . 0.0 110.022 177.659 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 77' ' ' TRP . . . . . 0.569 ' NE1' ' HA3' ' A' ' 84' ' ' GLY . 67.5 p-90 -171.22 167.75 6.92 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.042 179.946 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -146.96 123.73 11.23 Favored 'General case' 0 N--CA 1.465 0.278 0 N-CA-C 109.878 -0.416 . . . . 0.0 109.878 178.575 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 10.9 ttp180 -152.48 134.23 14.69 Favored 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 113.163 0.801 . . . . 0.0 113.163 -179.98 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 56.97 47.18 18.12 Favored 'General case' 0 C--N 1.333 -0.15 0 N-CA-C 113.788 1.033 . . . . 0.0 113.788 176.487 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 82.39 -27.94 3.54 Favored Glycine 0 CA--C 1.523 0.58 0 C-N-CA 120.319 -0.943 . . . . 0.0 113.033 177.268 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 4.9 mt -89.39 154.0 20.4 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 117.381 0.59 . . . . 0.0 110.335 -179.004 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.427 HD11 ' CB ' ' A' ' 45' ' ' GLN . 70.1 mt -126.87 135.67 51.28 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.402 -178.969 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 84' ' ' GLY . . . . . 0.569 ' HA3' ' NE1' ' A' ' 77' ' ' TRP . . . -98.49 150.84 19.46 Favored Glycine 0 N--CA 1.45 -0.375 0 N-CA-C 109.546 -1.421 . . . . 0.0 109.546 178.64 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 85' ' ' PHE . . . . . 0.587 ' CE1' HD22 ' A' ' 75' ' ' LEU . 45.8 m-85 -145.57 134.85 22.95 Favored 'General case' 0 C--N 1.318 -0.766 0 C-N-CA 120.863 -0.335 . . . . 0.0 110.458 -179.542 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -103.97 125.73 50.57 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 179.646 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -70.38 125.44 26.8 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.979 0.419 . . . . 0.0 111.542 -178.744 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 8.2 mm100 -98.22 -31.94 11.82 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.302 179.468 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 89' ' ' HIS . . . . . 0.472 ' ND1' ' C ' ' A' ' 89' ' ' HIS . 0.0 OUTLIER -160.48 141.59 12.06 Favored 'General case' 0 C--O 1.222 -0.342 0 CA-C-N 116.043 -0.526 . . . . 0.0 109.842 179.617 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.769 HD12 ' SD ' ' A' ' 71' ' ' MET . 7.1 tt -145.26 140.72 22.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-O 121.381 0.61 . . . . 0.0 110.235 -179.13 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 91' ' ' ASP . . . . . 0.545 ' OD1' ' N ' ' A' ' 92' ' ' LEU . 12.9 t0 -56.88 142.42 41.29 Favored 'General case' 0 N--CA 1.462 0.131 0 CA-C-N 115.148 -0.933 . . . . 0.0 112.003 -178.294 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.545 ' N ' ' OD1' ' A' ' 91' ' ' ASP . 6.5 tt -53.87 -41.84 67.96 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 114.82 -1.082 . . . . 0.0 110.233 -179.051 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 93' ' ' ASP . . . . . 0.43 ' N ' ' OD1' ' A' ' 91' ' ' ASP . 0.6 OUTLIER -67.52 -42.46 82.76 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.815 -0.439 . . . . 0.0 109.815 179.254 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 94' ' ' SER . . . . . 0.516 ' CB ' HG23 ' A' ' 69' ' ' ILE . 6.4 m -60.79 -37.8 83.17 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.176 179.615 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 95' ' ' ILE . . . . . 0.403 ' CG1' HG23 ' A' ' 90' ' ' ILE . 61.4 mt -58.62 -38.32 70.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.243 -179.991 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -70.97 -40.81 71.72 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.206 -0.597 . . . . 0.0 111.337 -179.131 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 68.7 m-70 . . . . . 0 C--N 1.326 -0.428 0 C-N-CA 119.503 -0.879 . . . . 0.0 109.316 179.945 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 40.5 mm . . . . . 0 CA--C 1.521 -0.149 0 CA-C-O 120.659 0.266 . . . . 0.0 110.412 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -95.58 119.86 34.82 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.33 0.586 . . . . 0.0 111.663 -179.861 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -149.93 154.64 38.62 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.036 -0.983 . . . . 0.0 108.433 177.816 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -95.57 147.03 24.0 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 120.013 -0.675 . . . . 0.0 111.478 -178.328 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.508 ' O ' HD12 ' A' ' 32' ' ' LEU . . . -179.11 176.8 0.85 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.698 -0.683 . . . . 0.0 109.846 179.375 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 22.2 t0 -96.11 134.26 39.39 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.95 -179.737 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.594 ' O ' ' O ' ' A' ' 31' ' ' VAL . 21.5 p -134.37 154.06 51.55 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.135 0.493 . . . . 0.0 110.263 179.002 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 18.7 mt-10 -135.29 143.16 46.08 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 109.041 -0.726 . . . . 0.0 109.041 179.487 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -122.35 136.3 59.64 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 C-N-CA 120.21 -0.596 . . . . 0.0 110.986 -179.023 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.47 ' H ' HD12 ' A' ' 23' ' ' LEU . 0.2 OUTLIER -123.89 123.32 40.17 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.927 -179.44 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.696 ' NE2' ' CZ ' ' A' ' 57' ' ' PHE . 13.3 tt0 -131.15 102.7 6.11 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.32 -0.855 . . . . 0.0 109.635 178.858 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 78.56 -128.38 8.64 Favored Glycine 0 CA--C 1.522 0.524 0 N-CA-C 109.77 -1.332 . . . . 0.0 109.77 -178.94 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -98.89 11.24 39.42 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.675 0.274 . . . . 0.0 110.456 179.612 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.586 ' HB3' ' CZ2' ' A' ' 29' ' ' TRP . 0.6 OUTLIER -111.78 132.5 54.62 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 121.007 0.432 . . . . 0.0 112.011 -179.056 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.417 ' HG2' ' N ' ' A' ' 29' ' ' TRP . 4.5 ttt85 -126.79 147.43 50.01 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.8 -0.637 . . . . 0.0 109.947 178.931 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.623 ' HE1' ' CG ' ' A' ' 48' ' ' ASP . 6.5 m-90 -145.85 155.44 42.9 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.497 -179.0 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.52 ' OE1' ' N ' ' A' ' 30' ' ' GLU . 0.0 OUTLIER -99.33 138.53 36.3 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 178.982 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.594 ' O ' ' O ' ' A' ' 20' ' ' SER . 17.7 m -149.12 157.82 6.67 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-O 121.226 0.536 . . . . 0.0 110.947 -179.335 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.544 HD12 ' N ' ' A' ' 33' ' ' LEU . 8.2 tp -98.24 129.84 44.97 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 107.975 -1.12 . . . . 0.0 107.975 178.511 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.544 ' N ' HD12 ' A' ' 32' ' ' LEU . 1.9 tt -92.17 126.46 37.26 Favored 'General case' 0 C--N 1.325 -0.489 0 C-N-CA 120.271 -0.572 . . . . 0.0 109.61 -179.922 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 73.4 m-70 -90.46 -28.16 18.78 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.428 -0.805 . . . . 0.0 111.732 -178.299 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -172.44 161.46 5.11 Favored 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 119.635 -0.826 . . . . 0.0 111.205 177.578 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' VAL . . . . . 0.532 HG22 ' H ' ' A' ' 37' ' ' SER . 4.8 p -144.92 168.99 8.57 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.165 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.949 -179.026 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' SER . . . . . 0.532 ' H ' HG22 ' A' ' 36' ' ' VAL . 9.4 t -141.88 170.55 15.5 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 107.924 -1.139 . . . . 0.0 107.924 178.717 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.916 ' O ' HD23 ' A' ' 38' ' ' LEU . 4.0 tt -67.13 -1.08 3.85 Favored 'General case' 0 C--N 1.322 -0.611 0 C-N-CA 119.691 -0.804 . . . . 0.0 110.58 -179.243 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' HIS . . . . . 0.539 ' CE1' ' O ' ' A' ' 87' ' ' CYS . 26.1 t60 -159.86 35.4 0.18 Allowed 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 120.642 -0.423 . . . . 0.0 111.609 179.926 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -171.83 155.59 24.17 Favored Glycine 0 CA--C 1.528 0.862 0 N-CA-C 111.135 -0.786 . . . . 0.0 111.135 179.79 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -147.33 149.09 15.89 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.454 0 CA-C-O 121.368 0.604 . . . . 0.0 111.774 -179.182 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -122.7 139.58 53.8 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 115.205 -0.907 . . . . 0.0 109.185 178.984 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.0 m -144.1 175.29 3.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 121.178 0.514 . . . . 0.0 111.709 -179.474 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -97.18 145.47 17.87 Favored Glycine 0 CA--C 1.531 1.073 0 N-CA-C 109.692 -1.363 . . . . 0.0 109.692 178.545 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' GLN . . . . . 0.541 ' NE2' ' O ' ' A' ' 46' ' ' PRO . 17.9 tm0? -87.65 114.3 58.32 Favored Pre-proline 0 N--CA 1.467 0.411 0 CA-C-N 117.954 0.877 . . . . 0.0 112.06 -178.467 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.541 ' O ' ' NE2' ' A' ' 45' ' ' GLN . 83.7 Cg_endo -84.24 161.5 13.26 Favored 'Trans proline' 0 C--N 1.308 -1.557 0 C-N-CA 121.569 1.513 . . . . 0.0 110.97 178.524 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -65.26 -40.17 93.62 Favored 'General case' 0 N--CA 1.465 0.317 0 N-CA-C 112.7 0.629 . . . . 0.0 112.7 -178.621 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' ASP . . . . . 0.623 ' CG ' ' HE1' ' A' ' 29' ' ' TRP . 38.5 t0 -73.95 8.84 1.79 Allowed 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 112.068 0.396 . . . . 0.0 112.068 -178.571 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' TRP . . . . . 0.475 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 65.2 t-105 -59.17 69.32 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 111.636 0.235 . . . . 0.0 111.636 -179.781 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' ASN . . . . . 0.547 ' N ' ' O ' ' A' ' 48' ' ' ASP . 62.4 t-20 -93.41 78.82 4.4 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 120.203 -0.599 . . . . 0.0 110.019 178.913 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -142.52 159.48 27.22 Favored Glycine 0 CA--C 1.526 0.731 0 N-CA-C 111.22 -0.752 . . . . 0.0 111.22 -179.765 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 45.3 t0 -95.26 109.05 42.85 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-N 115.759 -0.22 . . . . 0.0 111.022 -179.544 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 78.1 Cg_exo -47.27 -22.69 2.59 Favored 'Trans proline' 0 N--CA 1.493 1.485 0 C-N-CA 122.358 2.039 . . . . 0.0 112.077 179.532 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.51 -23.84 53.7 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.285 -179.386 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.487 ' O ' ' CE1' ' A' ' 57' ' ' PHE . 26.6 mtm180 -95.26 155.22 39.1 Favored Pre-proline 0 N--CA 1.463 0.207 0 C-N-CA 120.616 -0.434 . . . . 0.0 110.22 179.635 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 56' ' ' PRO . . . . . 0.535 ' O ' ' NE2' ' A' ' 24' ' ' GLN . 9.3 Cg_exo -66.92 160.73 45.63 Favored 'Trans proline' 0 N--CA 1.493 1.49 0 C-N-CA 122.685 2.256 . . . . 0.0 113.305 -178.864 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.696 ' CZ ' ' NE2' ' A' ' 24' ' ' GLN . 49.3 m-85 -130.76 155.31 46.86 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 114.851 -1.068 . . . . 0.0 108.937 179.313 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -122.16 139.17 54.06 Favored 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 178.326 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -119.77 137.69 53.8 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 112.217 0.451 . . . . 0.0 112.217 -178.059 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 13.0 mtt180 -123.17 127.6 48.88 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 108.623 -0.88 . . . . 0.0 108.623 177.385 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.478 HD11 ' SD ' ' A' ' 71' ' ' MET . 9.7 mt -109.39 150.98 27.25 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.942 0.401 . . . . 0.0 110.757 -178.966 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 62' ' ' TYR . . . . . 0.425 ' CD1' ' N ' ' A' ' 62' ' ' TYR . 20.1 m-85 -132.61 109.68 9.91 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.438 179.73 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.484 HD23 ' C ' ' A' ' 63' ' ' LEU . 1.9 tt -104.55 -82.48 0.51 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.731 -0.668 . . . . 0.0 109.398 179.501 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.471 ' H ' ' HB ' ' A' ' 67' ' ' VAL . . . -78.68 179.01 52.82 Favored Glycine 0 CA--C 1.522 0.497 0 N-CA-C 109.156 -1.578 . . . . 0.0 109.156 178.423 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.698 ' N ' HD22 ' A' ' 65' ' ' LEU . 3.1 mm? -74.22 -33.06 63.25 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 119.827 -0.749 . . . . 0.0 110.118 -179.498 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -101.96 9.32 40.61 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.95 179.929 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' VAL . . . . . 0.564 ' O ' HG12 ' A' ' 67' ' ' VAL . 8.9 t -106.08 95.91 4.18 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.242 0 CA-C-O 121.309 0.576 . . . . 0.0 111.807 -178.621 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 6.5 tp -113.1 117.46 32.03 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 108.169 -1.049 . . . . 0.0 108.169 178.176 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.502 HG23 ' HB3' ' A' ' 94' ' ' SER . 3.5 mt -111.04 142.92 22.02 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-O 120.97 0.414 . . . . 0.0 110.836 -178.962 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 5.7 ttp180 -128.2 130.97 48.83 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.734 179.572 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' MET . . . . . 0.478 ' SD ' HD11 ' A' ' 61' ' ' LEU . 0.0 OUTLIER -139.64 147.4 40.98 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.643 179.846 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -106.38 123.74 48.53 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 107.52 -1.289 . . . . 0.0 107.52 178.257 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.713 HD12 ' CB ' ' A' ' 85' ' ' PHE . 3.8 pt -134.47 162.35 39.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 N-CA-C 113.348 0.87 . . . . 0.0 113.348 -176.923 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 1.9 t -119.0 148.58 42.84 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 114.808 -1.087 . . . . 0.0 108.71 178.251 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.429 ' HA ' ' CD1' ' A' ' 85' ' ' PHE . 2.3 tt -66.46 126.74 29.79 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.569 0.7 . . . . 0.0 110.119 -179.127 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -98.2 -41.39 7.92 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 114.923 -1.035 . . . . 0.0 110.928 178.284 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' TRP . . . . . 0.545 ' NE1' ' HA3' ' A' ' 84' ' ' GLY . 69.2 p-90 -169.59 171.94 7.24 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.096 -179.409 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -149.19 123.13 9.37 Favored 'General case' 0 N--CA 1.465 0.301 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 177.725 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 20.4 ttt-85 -152.91 134.66 14.59 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 119.775 -0.77 . . . . 0.0 113.033 -179.882 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 56.54 46.84 19.78 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 113.372 0.878 . . . . 0.0 113.372 176.586 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 80.82 -25.22 3.53 Favored Glycine 0 CA--C 1.524 0.632 0 C-N-CA 120.485 -0.864 . . . . 0.0 113.082 177.479 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 7.6 mt -89.76 161.41 16.05 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 117.882 0.841 . . . . 0.0 110.825 -178.948 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 54.3 mt -136.37 136.24 39.48 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.278 -179.308 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 84' ' ' GLY . . . . . 0.545 ' HA3' ' NE1' ' A' ' 77' ' ' TRP . . . -109.61 156.2 15.72 Favored Glycine 0 N--CA 1.451 -0.316 0 N-CA-C 109.294 -1.522 . . . . 0.0 109.294 178.169 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 85' ' ' PHE . . . . . 0.713 ' CB ' HD12 ' A' ' 73' ' ' ILE . 81.4 m-85 -145.46 143.3 29.94 Favored 'General case' 0 C--N 1.318 -0.788 0 C-N-CA 120.829 -0.348 . . . . 0.0 110.214 -179.655 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.485 ' OE2' ' CD2' ' A' ' 39' ' ' HIS . 14.5 tm-20 -103.37 128.74 50.4 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 179.276 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 87' ' ' CYS . . . . . 0.539 ' O ' ' CE1' ' A' ' 39' ' ' HIS . 41.0 t -78.28 127.14 31.8 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 112.267 0.469 . . . . 0.0 112.267 -178.236 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 1.5 pt20 -102.98 -27.99 12.28 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.462 179.367 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 89' ' ' HIS . . . . . 0.558 ' ND1' ' N ' ' A' ' 90' ' ' ILE . 0.0 OUTLIER -160.46 141.28 11.88 Favored 'General case' 0 C--O 1.227 -0.104 0 CA-C-O 121.019 0.438 . . . . 0.0 110.55 179.433 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.558 ' N ' ' ND1' ' A' ' 89' ' ' HIS . 9.3 tt -145.74 141.16 21.99 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.966 -179.843 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 5.5 t0 -54.67 141.9 30.38 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 115.334 -0.848 . . . . 0.0 112.23 -178.248 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.434 ' HA ' HD12 ' A' ' 95' ' ' ILE . 57.3 tp -54.12 -41.97 68.93 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 114.929 -1.032 . . . . 0.0 109.979 -179.704 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -68.89 -41.53 78.15 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 109.558 -0.534 . . . . 0.0 109.558 179.228 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 94' ' ' SER . . . . . 0.502 ' HB3' HG23 ' A' ' 69' ' ' ILE . 13.4 m -61.39 -37.3 82.93 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.863 -0.608 . . . . 0.0 109.878 179.325 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 95' ' ' ILE . . . . . 0.457 ' CG1' HG23 ' A' ' 90' ' ' ILE . 47.6 mt -58.62 -38.03 68.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 115.635 -0.712 . . . . 0.0 110.011 179.74 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -70.86 -37.79 73.11 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 120.266 -0.574 . . . . 0.0 110.686 -179.465 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 73.5 m-70 . . . . . 0 C--N 1.326 -0.448 0 C-N-CA 119.657 -0.817 . . . . 0.0 109.235 179.491 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 42.2 mm . . . . . 0 CA--C 1.522 -0.121 0 CA-C-O 120.566 0.222 . . . . 0.0 110.887 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -93.75 120.39 33.96 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.315 0.579 . . . . 0.0 111.19 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 2.3 p90 -149.76 157.66 43.42 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.164 -0.926 . . . . 0.0 108.683 178.045 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -95.6 146.21 24.65 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 120.343 -0.543 . . . . 0.0 110.502 -179.472 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . 179.32 174.45 0.76 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.367 179.703 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -96.15 133.84 39.94 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.544 179.924 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.531 ' O ' ' O ' ' A' ' 31' ' ' VAL . 3.3 p -134.64 154.11 51.66 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.976 0.417 . . . . 0.0 110.18 179.076 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -132.93 143.67 49.63 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.172 -0.677 . . . . 0.0 109.172 179.427 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 53.3 mt -124.33 136.41 60.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 C-N-CA 120.176 -0.61 . . . . 0.0 111.184 -179.477 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.596 ' H ' HD12 ' A' ' 23' ' ' LEU . 0.0 OUTLIER -121.11 123.39 42.2 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.659 -179.34 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.555 HE22 ' HA2' ' A' ' 51' ' ' GLY . 0.0 OUTLIER -130.78 101.9 5.86 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.135 -0.939 . . . . 0.0 109.551 179.361 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 78.37 -129.08 9.1 Favored Glycine 0 CA--C 1.523 0.553 0 N-CA-C 109.785 -1.326 . . . . 0.0 109.785 -178.668 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 19.2 pt-20 -98.81 11.49 38.56 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.903 0.382 . . . . 0.0 110.21 179.367 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.486 ' HB3' ' CZ2' ' A' ' 29' ' ' TRP . 1.1 mpt_? -112.42 133.79 54.31 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.074 -0.512 . . . . 0.0 112.01 -178.922 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 17.2 ttt180 -127.12 149.58 49.88 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.873 -0.603 . . . . 0.0 109.764 178.777 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.566 ' NE1' ' O ' ' A' ' 48' ' ' ASP . 6.1 m-90 -147.74 156.45 42.76 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.769 -178.927 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 78.1 mt-10 -99.3 131.3 45.42 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.693 -0.685 . . . . 0.0 109.212 178.81 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.531 ' O ' ' O ' ' A' ' 20' ' ' SER . 14.4 m -137.15 154.7 31.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-O 121.256 0.551 . . . . 0.0 111.214 -179.504 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 13.0 tp -95.23 126.57 40.64 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 108.531 -0.914 . . . . 0.0 108.531 178.987 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.471 ' HG ' ' N ' ' A' ' 34' ' ' HIS . 2.3 tt -83.02 150.75 26.15 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 179.631 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' HIS . . . . . 0.471 ' N ' ' HG ' ' A' ' 33' ' ' LEU . 64.7 m-70 -123.01 -28.33 4.08 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.155 179.604 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -173.83 160.62 3.65 Favored 'General case' 0 C--N 1.327 -0.413 0 C-N-CA 119.802 -0.759 . . . . 0.0 111.109 176.953 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' VAL . . . . . 0.538 HG22 ' N ' ' A' ' 37' ' ' SER . 6.5 p -145.24 169.08 7.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.146 -179.06 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' SER . . . . . 0.538 ' N ' HG22 ' A' ' 36' ' ' VAL . 29.8 t -142.17 167.68 21.55 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 107.985 -1.117 . . . . 0.0 107.985 178.6 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 2.7 pp -62.99 -0.16 0.65 Allowed 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 119.758 -0.777 . . . . 0.0 110.963 -179.157 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' HIS . . . . . 0.427 ' H ' ' C ' ' A' ' 37' ' ' SER . 0.4 OUTLIER -165.61 43.04 0.07 Allowed 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 120.793 -0.363 . . . . 0.0 111.467 -179.91 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -178.85 154.95 15.09 Favored Glycine 0 CA--C 1.528 0.881 0 N-CA-C 110.816 -0.914 . . . . 0.0 110.816 179.812 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.426 ' CG2' HG21 ' A' ' 73' ' ' ILE . 0.1 OUTLIER -148.21 148.77 15.84 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.238 0 CA-C-O 121.469 0.652 . . . . 0.0 111.873 -178.9 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.458 HD23 ' N ' ' A' ' 43' ' ' VAL . 0.9 OUTLIER -120.79 132.42 55.02 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 114.813 -1.085 . . . . 0.0 108.187 178.355 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.458 ' N ' HD23 ' A' ' 42' ' ' LEU . 5.4 m -139.26 175.9 6.88 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-O 121.368 0.604 . . . . 0.0 111.821 -178.737 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -98.0 143.87 16.94 Favored Glycine 0 CA--C 1.529 0.968 0 N-CA-C 109.758 -1.337 . . . . 0.0 109.758 178.148 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' GLN . . . . . 0.483 ' O ' ' OE1' ' A' ' 45' ' ' GLN . 1.7 tm0? -85.78 117.73 69.26 Favored Pre-proline 0 N--CA 1.466 0.345 0 CA-C-N 117.625 0.713 . . . . 0.0 111.686 -178.78 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_endo -86.79 161.76 9.1 Favored 'Trans proline' 0 C--N 1.311 -1.446 0 C-N-CA 121.628 1.552 . . . . 0.0 111.037 178.687 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.579 ' CD ' ' H ' ' A' ' 47' ' ' GLN . 1.2 mp0 -65.49 -40.63 93.31 Favored 'General case' 0 N--CA 1.467 0.407 0 N-CA-C 112.604 0.594 . . . . 0.0 112.604 -178.877 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 48' ' ' ASP . . . . . 0.566 ' O ' ' NE1' ' A' ' 29' ' ' TRP . 1.2 m-20 -72.2 8.56 1.27 Allowed 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 111.866 0.321 . . . . 0.0 111.866 -178.371 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 49' ' ' TRP . . . . . 0.463 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 63.5 t-105 -60.13 68.9 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.55 -0.295 . . . . 0.0 111.717 -179.521 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 50' ' ' ASN . . . . . 0.533 ' N ' ' O ' ' A' ' 48' ' ' ASP . 30.8 t-20 -93.35 78.76 4.44 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 120.074 -0.651 . . . . 0.0 109.806 178.737 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' GLY . . . . . 0.555 ' HA2' HE22 ' A' ' 24' ' ' GLN . . . -143.93 151.22 23.19 Favored Glycine 0 CA--C 1.525 0.707 0 N-CA-C 110.896 -0.882 . . . . 0.0 110.896 -179.729 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 11.0 t0 -88.17 114.18 58.29 Favored Pre-proline 0 CA--C 1.536 0.415 0 CA-C-O 120.339 0.114 . . . . 0.0 111.014 -179.677 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_exo -46.93 -22.42 2.0 Favored 'Trans proline' 0 N--CA 1.497 1.694 0 C-N-CA 122.735 2.29 . . . . 0.0 112.671 179.618 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -78.27 -24.12 46.94 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 120.571 -0.452 . . . . 0.0 111.894 -178.632 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.553 ' O ' ' CE1' ' A' ' 57' ' ' PHE . 12.7 mtp85 -93.9 152.59 40.69 Favored Pre-proline 0 C--N 1.33 -0.247 0 C-N-CA 120.598 -0.441 . . . . 0.0 110.177 179.839 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_endo -65.01 160.57 40.89 Favored 'Trans proline' 0 N--CA 1.495 1.565 0 C-N-CA 122.734 2.289 . . . . 0.0 112.93 -178.912 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.553 ' CE1' ' O ' ' A' ' 55' ' ' ARG . 43.1 m-85 -130.41 156.43 44.76 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.094 -0.957 . . . . 0.0 109.17 179.469 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.428 ' O ' HD12 ' A' ' 23' ' ' LEU . 35.8 mt-10 -123.1 136.8 54.95 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 178.357 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 59' ' ' ALA . . . . . 0.602 ' HB2' ' CD1' ' A' ' 73' ' ' ILE . . . -116.66 136.08 53.26 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.097 0.475 . . . . 0.0 111.931 -178.152 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 16.1 mmm-85 -123.02 127.56 48.95 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 177.864 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 6.9 mt -105.99 151.06 25.1 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.063 0.458 . . . . 0.0 111.243 -178.43 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' TYR . . . . . 0.478 ' N ' ' CD1' ' A' ' 62' ' ' TYR . 13.6 m-85 -135.88 108.9 7.66 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.002 179.291 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -105.34 -81.3 0.54 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.681 -0.69 . . . . 0.0 109.589 179.911 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.472 ' H ' ' HB ' ' A' ' 67' ' ' VAL . . . -78.82 -176.44 47.93 Favored Glycine 0 CA--C 1.521 0.428 0 N-CA-C 109.254 -1.538 . . . . 0.0 109.254 178.421 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.616 HD23 ' H ' ' A' ' 65' ' ' LEU . 0.3 OUTLIER -76.39 -33.34 58.88 Favored 'General case' 0 C--N 1.329 -0.326 0 C-N-CA 119.918 -0.713 . . . . 0.0 110.59 -179.62 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 66' ' ' ASP . . . . . 0.41 ' O ' ' OD1' ' A' ' 66' ' ' ASP . 48.2 t0 -103.06 9.21 38.64 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 122.753 0.421 . . . . 0.0 111.075 -179.789 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 67' ' ' VAL . . . . . 0.472 ' HB ' ' H ' ' A' ' 64' ' ' GLY . 28.7 t -103.33 95.21 3.66 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.249 0 CA-C-O 121.288 0.566 . . . . 0.0 111.698 -178.652 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.661 HD12 ' N ' ' A' ' 69' ' ' ILE . 1.3 tp -114.2 117.6 31.65 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 178.917 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.661 ' N ' HD12 ' A' ' 68' ' ' LEU . 18.7 mm -113.15 145.24 19.35 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.252 0 CA-C-O 121.012 0.434 . . . . 0.0 111.726 -178.422 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 3.2 ptm180 -128.51 133.42 48.44 Favored 'General case' 0 C--O 1.239 0.502 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.078 179.133 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -146.16 150.42 35.84 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.273 -0.876 . . . . 0.0 110.144 -179.765 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -103.81 128.2 51.25 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 107.851 -1.166 . . . . 0.0 107.851 178.335 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.602 ' CD1' ' HB2' ' A' ' 59' ' ' ALA . 14.5 pt -135.97 156.98 38.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 C-N-CA 119.995 -0.682 . . . . 0.0 112.757 -177.594 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 31.3 t -122.41 151.35 41.34 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 114.781 -1.1 . . . . 0.0 109.903 179.195 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.56 HD12 ' CE1' ' A' ' 85' ' ' PHE . 7.1 tp -66.21 121.2 14.66 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.184 0.516 . . . . 0.0 110.365 -179.68 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -97.57 -42.57 7.62 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 115.454 -0.793 . . . . 0.0 110.522 178.175 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' TRP . . . . . 0.586 ' NE1' ' HA3' ' A' ' 84' ' ' GLY . 66.8 p-90 -168.52 167.37 11.69 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 115.419 -0.809 . . . . 0.0 110.084 -179.357 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -147.51 123.77 10.89 Favored 'General case' 0 N--CA 1.465 0.325 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 178.612 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 33.9 ttt85 -152.4 134.29 14.81 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 119.789 -0.764 . . . . 0.0 113.043 179.87 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 57.05 47.3 17.7 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 113.781 1.03 . . . . 0.0 113.781 176.839 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 82.78 -27.48 3.82 Favored Glycine 0 CA--C 1.522 0.495 0 C-N-CA 120.292 -0.956 . . . . 0.0 113.28 177.075 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 3.9 mt -89.67 158.85 17.4 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 117.744 0.772 . . . . 0.0 110.153 -179.096 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 63.4 mt -130.68 135.44 47.83 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.387 -179.119 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 84' ' ' GLY . . . . . 0.586 ' HA3' ' NE1' ' A' ' 77' ' ' TRP . . . -93.93 151.69 20.38 Favored Glycine 0 N--CA 1.448 -0.561 0 N-CA-C 109.477 -1.449 . . . . 0.0 109.477 178.434 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 85' ' ' PHE . . . . . 0.56 ' CE1' HD12 ' A' ' 75' ' ' LEU . 26.8 m-85 -145.81 131.3 18.73 Favored 'General case' 0 C--N 1.317 -0.823 0 C-N-CA 120.647 -0.421 . . . . 0.0 110.692 -179.234 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.527 ' OE1' ' NE2' ' A' ' 88' ' ' GLN . 4.0 tt0 -103.76 127.56 51.23 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 179.664 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 87' ' ' CYS . . . . . 0.531 ' HA ' HG22 ' A' ' 73' ' ' ILE . 4.9 t -70.67 122.77 20.42 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.929 0.395 . . . . 0.0 111.907 -178.616 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 88' ' ' GLN . . . . . 0.527 ' NE2' ' OE1' ' A' ' 86' ' ' GLU . 32.0 mm-40 -94.74 -32.43 13.33 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.898 -0.592 . . . . 0.0 109.774 179.16 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 89' ' ' HIS . . . . . 0.498 ' ND1' ' N ' ' A' ' 90' ' ' ILE . 0.0 OUTLIER -163.38 143.72 8.93 Favored 'General case' 0 C--O 1.223 -0.316 0 CA-C-N 115.74 -0.664 . . . . 0.0 109.984 179.751 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.498 ' N ' ' ND1' ' A' ' 89' ' ' HIS . 10.7 tt -144.89 141.06 23.32 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-O 121.379 0.609 . . . . 0.0 109.918 -179.83 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 91' ' ' ASP . . . . . 0.553 ' O ' ' OG ' ' A' ' 94' ' ' SER . 4.7 t0 -56.43 142.11 39.8 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-N 115.209 -0.905 . . . . 0.0 112.1 -177.903 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 3.7 tp -54.44 -41.56 69.55 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 114.885 -1.052 . . . . 0.0 109.895 -179.635 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -70.51 -37.71 74.2 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.208 179.45 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 94' ' ' SER . . . . . 0.553 ' OG ' ' O ' ' A' ' 91' ' ' ASP . 2.2 p -63.16 -35.18 79.44 Favored 'General case' 0 C--N 1.333 -0.149 0 N-CA-C 109.841 -0.429 . . . . 0.0 109.841 179.706 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 36.2 mt -62.08 -39.16 82.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.209 179.539 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -70.53 -42.73 70.83 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.386 -0.526 . . . . 0.0 111.785 -178.371 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 57.4 m-70 . . . . . 0 C--N 1.323 -0.567 0 C-N-CA 119.153 -1.019 . . . . 0.0 109.264 -179.778 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.782 ' N ' HD12 ' A' ' 14' ' ' ILE . 1.9 mp . . . . . 0 CA--C 1.519 -0.215 0 N-CA-C 110.276 -0.268 . . . . 0.0 110.276 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -93.0 120.57 33.43 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.297 0.57 . . . . 0.0 111.402 -179.524 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 2.0 p90 -149.68 157.06 42.88 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.135 -0.939 . . . . 0.0 108.565 178.134 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -95.55 147.22 23.8 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 120.341 -0.544 . . . . 0.0 110.62 -179.223 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . 178.94 176.2 0.57 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.241 179.795 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -96.43 134.51 39.51 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.933 -179.608 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.654 ' O ' ' O ' ' A' ' 31' ' ' VAL . 11.5 p -136.48 159.93 40.29 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.07 179.092 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.474 ' OE2' HD21 ' A' ' 23' ' ' LEU . 0.3 OUTLIER -148.29 145.2 28.07 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 108.717 -0.845 . . . . 0.0 108.717 178.772 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 22' ' ' ILE . . . . . 0.471 ' N ' ' OE1' ' A' ' 21' ' ' GLU . 61.6 mt -119.58 136.73 55.77 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.323 0 CA-C-O 121.237 0.542 . . . . 0.0 112.056 -177.776 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.758 ' H ' HD12 ' A' ' 23' ' ' LEU . 0.0 OUTLIER -117.8 123.24 45.46 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.492 -0.776 . . . . 0.0 110.443 179.678 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.433 ' HG3' ' O ' ' A' ' 56' ' ' PRO . 38.1 tt0 -129.26 101.42 5.99 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.446 -0.797 . . . . 0.0 109.823 179.101 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 78.09 -126.78 7.84 Favored Glycine 0 CA--C 1.521 0.418 0 N-CA-C 109.877 -1.289 . . . . 0.0 109.877 -179.089 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.457 ' OE1' ' O ' ' A' ' 26' ' ' GLU . 0.0 OUTLIER -100.24 9.82 42.16 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.894 0.378 . . . . 0.0 110.084 179.53 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.496 ' HB3' ' CZ2' ' A' ' 29' ' ' TRP . 36.7 mtt85 -112.37 134.62 53.81 Favored 'General case' 0 CA--C 1.521 -0.15 0 CA-C-N 116.06 -0.518 . . . . 0.0 112.066 -178.806 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.405 ' HG2' ' N ' ' A' ' 29' ' ' TRP . 60.1 ttt-85 -129.24 150.15 50.74 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.346 179.852 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.528 ' NE1' ' O ' ' A' ' 48' ' ' ASP . 6.5 m-90 -147.49 155.01 41.48 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.171 -179.169 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.608 ' H ' ' CD ' ' A' ' 30' ' ' GLU . 1.4 mp0 -101.23 140.32 35.69 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 179.517 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.654 ' O ' ' O ' ' A' ' 20' ' ' SER . 18.9 m -148.89 157.11 7.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-O 121.149 0.499 . . . . 0.0 111.121 -179.466 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 1.093 ' H ' HD23 ' A' ' 32' ' ' LEU . 1.2 pt? -95.71 129.82 42.81 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 108.456 -0.942 . . . . 0.0 108.456 178.294 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.423 HD13 HD21 ' A' ' 61' ' ' LEU . 1.4 tt -93.57 126.11 38.54 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.403 0.62 . . . . 0.0 110.239 -179.255 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 50.2 m-70 -90.65 -25.75 19.95 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.009 -0.996 . . . . 0.0 111.863 -178.375 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -175.2 161.78 2.89 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 119.721 -0.792 . . . . 0.0 111.341 177.78 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' VAL . . . . . 0.528 HG22 ' H ' ' A' ' 37' ' ' SER . 4.3 p -143.42 168.37 12.47 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.157 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.871 -179.472 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' SER . . . . . 0.528 ' H ' HG22 ' A' ' 36' ' ' VAL . 25.3 t -142.92 167.06 22.97 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 107.789 -1.189 . . . . 0.0 107.789 178.399 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.488 ' C ' ' CG ' ' A' ' 39' ' ' HIS . 1.0 OUTLIER -63.28 -1.32 1.04 Allowed 'General case' 0 C--N 1.322 -0.588 0 C-N-CA 119.602 -0.839 . . . . 0.0 110.31 -179.811 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 39' ' ' HIS . . . . . 0.488 ' CG ' ' C ' ' A' ' 38' ' ' LEU . 0.0 OUTLIER -163.3 46.31 0.13 Allowed 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 120.713 -0.395 . . . . 0.0 111.301 179.995 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 177.14 153.58 11.05 Favored Glycine 0 CA--C 1.528 0.86 0 N-CA-C 111.221 -0.752 . . . . 0.0 111.221 179.568 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -148.77 149.36 15.08 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.255 0 CA-C-O 121.33 0.586 . . . . 0.0 111.64 -179.198 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -121.18 136.47 54.97 Favored 'General case' 0 N--CA 1.464 0.27 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 178.685 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 19.3 m -140.22 175.29 6.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 C-N-CA 120.226 -0.589 . . . . 0.0 111.887 -179.561 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -97.3 144.36 17.28 Favored Glycine 0 CA--C 1.527 0.829 0 N-CA-C 109.247 -1.541 . . . . 0.0 109.247 177.938 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 60.4 tt0 -86.82 114.66 59.23 Favored Pre-proline 0 N--CA 1.466 0.349 0 CA-C-N 117.938 0.869 . . . . 0.0 111.839 -178.504 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 93.8 Cg_endo -84.85 162.7 12.03 Favored 'Trans proline' 0 C--N 1.31 -1.488 0 C-N-CA 121.81 1.674 . . . . 0.0 111.774 178.938 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.705 ' NE2' ' H ' ' A' ' 48' ' ' ASP . 0.4 OUTLIER -65.54 -40.1 92.5 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 112.438 0.532 . . . . 0.0 112.438 -178.981 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 48' ' ' ASP . . . . . 0.705 ' H ' ' NE2' ' A' ' 47' ' ' GLN . 37.6 m-20 -74.21 8.79 1.93 Allowed 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 111.895 0.331 . . . . 0.0 111.895 -178.645 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 49' ' ' TRP . . . . . 0.48 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 62.3 t-105 -60.79 69.01 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 112.006 0.373 . . . . 0.0 112.006 -179.525 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' ASN . . . . . 0.579 HD22 ' C ' ' A' ' 50' ' ' ASN . 0.2 OUTLIER -92.96 80.07 4.61 Favored 'General case' 0 C--N 1.326 -0.43 0 C-N-CA 119.84 -0.744 . . . . 0.0 109.439 178.476 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -143.17 146.08 16.53 Favored Glycine 0 CA--C 1.524 0.596 0 N-CA-C 111.341 -0.703 . . . . 0.0 111.341 -179.301 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 53.9 t0 -84.42 113.95 51.92 Favored Pre-proline 0 CA--C 1.533 0.305 0 CA-C-N 115.96 -0.12 . . . . 0.0 110.705 179.817 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_exo -48.0 -22.33 3.41 Favored 'Trans proline' 0 N--CA 1.497 1.716 0 C-N-CA 122.517 2.144 . . . . 0.0 112.194 179.854 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 34.5 mm-40 -77.63 -24.11 49.6 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.132 -0.485 . . . . 0.0 112.044 -178.703 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.564 ' O ' ' CE1' ' A' ' 57' ' ' PHE . 39.1 mtp85 -95.15 151.64 38.91 Favored Pre-proline 0 N--CA 1.464 0.245 0 C-N-CA 120.573 -0.451 . . . . 0.0 110.436 -179.703 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 56' ' ' PRO . . . . . 0.433 ' O ' ' HG3' ' A' ' 24' ' ' GLN . 38.3 Cg_endo -65.59 161.09 40.09 Favored 'Trans proline' 0 N--CA 1.498 1.751 0 C-N-CA 123.156 2.571 . . . . 0.0 113.072 -178.855 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.564 ' CE1' ' O ' ' A' ' 55' ' ' ARG . 42.7 m-85 -131.59 156.29 46.04 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.344 -0.843 . . . . 0.0 109.572 179.587 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.508 ' O ' HD12 ' A' ' 23' ' ' LEU . 29.2 mt-10 -120.35 133.95 55.35 Favored 'General case' 0 N--CA 1.469 0.475 0 N-CA-C 108.913 -0.773 . . . . 0.0 108.913 178.043 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 59' ' ' ALA . . . . . 0.687 ' HB2' HD11 ' A' ' 73' ' ' ILE . . . -114.36 136.28 53.16 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.149 0.5 . . . . 0.0 111.998 -178.332 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.663 ' HG3' HD11 ' A' ' 23' ' ' LEU . 12.1 mmt180 -123.12 127.86 49.29 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 108.352 -0.981 . . . . 0.0 108.352 177.644 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.568 HD12 ' C ' ' A' ' 60' ' ' ARG . 10.7 mp -108.16 147.14 31.7 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 120.33 -0.548 . . . . 0.0 110.683 -179.316 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 62' ' ' TYR . . . . . 0.513 ' N ' ' CD1' ' A' ' 62' ' ' TYR . 4.2 m-85 -130.6 111.1 11.91 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.353 179.77 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 1.8 tt -106.57 -79.33 0.57 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.852 -0.613 . . . . 0.0 109.938 179.781 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.451 ' H ' ' HB ' ' A' ' 67' ' ' VAL . . . -80.99 -177.33 51.58 Favored Glycine 0 CA--C 1.52 0.404 0 N-CA-C 109.372 -1.491 . . . . 0.0 109.372 178.643 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 12.1 mt -76.07 -32.62 59.35 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 119.725 -0.79 . . . . 0.0 110.452 -179.441 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -104.16 8.91 36.38 Favored 'General case' 0 C--N 1.332 -0.185 0 C-N-CA 122.656 0.382 . . . . 0.0 111.222 -179.825 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' VAL . . . . . 0.451 ' HB ' ' H ' ' A' ' 64' ' ' GLY . 37.6 t -104.8 96.29 4.48 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.294 0 CA-C-O 121.37 0.605 . . . . 0.0 111.654 -179.072 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.503 HD12 ' N ' ' A' ' 69' ' ' ILE . 3.1 tp -116.06 117.52 30.33 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 107.95 -1.13 . . . . 0.0 107.95 178.659 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.503 ' N ' HD12 ' A' ' 68' ' ' LEU . 20.9 mm -111.8 146.3 16.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.639 -178.29 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.426 ' C ' ' HG2' ' A' ' 71' ' ' MET . 0.0 OUTLIER -128.36 130.49 47.82 Favored 'General case' 0 C--O 1.238 0.481 0 CA-C-O 121.25 0.548 . . . . 0.0 111.134 178.817 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 71' ' ' MET . . . . . 0.802 ' SD ' HD12 ' A' ' 90' ' ' ILE . 1.2 mtm -140.66 148.2 40.46 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.494 -0.775 . . . . 0.0 110.002 179.629 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 72' ' ' GLU . . . . . 0.457 ' OE2' ' O ' ' A' ' 57' ' ' PHE . 10.6 tp10 -100.74 128.47 46.77 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 107.678 -1.23 . . . . 0.0 107.678 178.666 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.687 HD11 ' HB2' ' A' ' 59' ' ' ALA . 9.2 pt -138.83 157.23 29.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 C-N-CA 119.601 -0.84 . . . . 0.0 112.965 -177.644 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -121.82 150.99 41.11 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 114.787 -1.097 . . . . 0.0 109.613 178.765 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.526 HD12 ' CE1' ' A' ' 85' ' ' PHE . 7.3 tp -66.48 123.46 20.08 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.425 0.631 . . . . 0.0 110.457 -179.666 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -98.18 -43.63 6.92 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 114.959 -1.019 . . . . 0.0 111.115 178.168 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' TRP . . . . . 0.589 ' NE1' ' HA3' ' A' ' 84' ' ' GLY . 68.7 p-90 -167.56 171.21 10.52 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.436 -179.124 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -151.09 123.87 8.58 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 116.541 -0.3 . . . . 0.0 110.305 178.776 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 8.1 ttt85 -152.33 133.6 14.38 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 112.821 0.674 . . . . 0.0 112.821 179.494 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' ASP . . . . . 0.414 ' O ' ' OD1' ' A' ' 80' ' ' ASP . 8.3 t70 56.4 47.41 19.02 Favored 'General case' 0 N--CA 1.464 0.26 0 N-CA-C 113.528 0.936 . . . . 0.0 113.528 176.506 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 69.43 12.72 66.93 Favored Glycine 0 CA--C 1.523 0.558 0 C-N-CA 120.305 -0.95 . . . . 0.0 111.931 178.188 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 49.5 mt -117.65 139.67 50.7 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 108.739 -0.837 . . . . 0.0 108.739 178.665 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 44.9 mt -122.72 135.06 54.46 Favored 'General case' 0 CA--C 1.513 -0.455 0 C-N-CA 120.359 -0.536 . . . . 0.0 111.179 -179.311 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 84' ' ' GLY . . . . . 0.589 ' HA3' ' NE1' ' A' ' 77' ' ' TRP . . . -97.81 153.63 20.14 Favored Glycine 0 N--CA 1.448 -0.558 0 N-CA-C 109.474 -1.451 . . . . 0.0 109.474 178.868 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 85' ' ' PHE . . . . . 0.537 ' CG ' HD12 ' A' ' 73' ' ' ILE . 27.8 m-85 -145.44 132.16 19.99 Favored 'General case' 0 C--N 1.314 -0.966 0 C-N-CA 120.788 -0.365 . . . . 0.0 110.668 -179.183 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 55.9 tt0 -103.92 127.88 51.44 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 179.726 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 87' ' ' CYS . . . . . 0.519 ' HA ' HG22 ' A' ' 73' ' ' ILE . 0.5 OUTLIER -76.62 125.86 29.98 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.065 0.459 . . . . 0.0 111.626 -178.715 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -103.46 -29.26 11.29 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.236 179.701 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 89' ' ' HIS . . . . . 0.459 ' ND1' ' C ' ' A' ' 89' ' ' HIS . 0.0 OUTLIER -160.35 141.2 11.97 Favored 'General case' 0 C--O 1.223 -0.318 0 CA-C-O 120.947 0.403 . . . . 0.0 110.462 179.542 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.802 HD12 ' SD ' ' A' ' 71' ' ' MET . 7.5 tt -146.01 141.06 21.6 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.131 -179.619 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -56.75 138.82 52.42 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 115.194 -0.912 . . . . 0.0 111.864 -178.321 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 1.8 tt -54.09 -41.46 68.28 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 115.078 -0.965 . . . . 0.0 110.304 -179.849 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -67.88 -36.1 79.67 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 179.321 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 3.9 m -68.62 -37.39 79.72 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.869 179.355 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 95' ' ' ILE . . . . . 0.405 ' CG1' HG23 ' A' ' 90' ' ' ILE . 54.7 mt -58.9 -38.75 75.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.721 -179.757 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -70.67 -41.21 72.38 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 120.332 -0.547 . . . . 0.0 111.502 -178.385 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 58.5 m-70 . . . . . 0 C--N 1.324 -0.507 0 C-N-CA 119.272 -0.971 . . . . 0.0 109.216 179.875 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.806 ' N ' HD12 ' A' ' 14' ' ' ILE . 1.8 mp . . . . . 0 CA--C 1.52 -0.208 0 N-CA-C 109.944 -0.391 . . . . 0.0 109.944 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -93.35 120.4 33.6 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.358 0.599 . . . . 0.0 111.435 -179.493 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -149.7 156.19 41.46 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.029 -0.987 . . . . 0.0 108.509 178.01 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -95.38 148.04 22.87 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 120.271 -0.571 . . . . 0.0 110.646 -178.888 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.502 ' O ' HD12 ' A' ' 32' ' ' LEU . . . 178.73 178.69 0.42 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.695 -0.684 . . . . 0.0 109.852 179.565 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 63.1 t0 -96.63 133.78 40.7 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.76 179.946 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.573 ' O ' ' O ' ' A' ' 31' ' ' VAL . 13.0 p -134.11 154.03 51.45 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.013 0.435 . . . . 0.0 110.164 178.818 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -135.36 145.99 47.93 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 179.519 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' ILE . . . . . 0.489 ' CD1' HD11 ' A' ' 73' ' ' ILE . 1.1 mm -124.83 136.28 61.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-O 121.278 0.561 . . . . 0.0 110.865 -179.092 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.475 HD13 ' NE ' ' A' ' 60' ' ' ARG . 0.3 OUTLIER -123.0 124.1 42.38 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.85 -179.615 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.523 ' O ' ' OE1' ' A' ' 24' ' ' GLN . 1.7 tm0? -130.92 102.2 5.95 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.418 -0.81 . . . . 0.0 109.459 178.774 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 79.04 -128.03 8.34 Favored Glycine 0 CA--C 1.525 0.659 0 N-CA-C 110.016 -1.234 . . . . 0.0 110.016 -178.705 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -99.75 12.07 37.6 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.732 0.301 . . . . 0.0 110.373 179.567 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.505 ' HB3' ' CZ2' ' A' ' 29' ' ' TRP . 0.0 OUTLIER -112.68 133.56 54.64 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.25 -0.432 . . . . 0.0 112.04 -178.815 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.44 ' HG2' ' N ' ' A' ' 29' ' ' TRP . 2.5 ttt85 -126.98 147.45 50.12 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.967 -0.56 . . . . 0.0 109.896 179.146 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.55 ' NE1' ' O ' ' A' ' 48' ' ' ASP . 6.6 m-90 -146.13 155.64 42.88 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.538 -0.755 . . . . 0.0 110.541 -179.214 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -100.19 137.49 38.55 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 179.144 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.573 ' O ' ' O ' ' A' ' 20' ' ' SER . 16.7 m -146.14 156.65 12.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-O 121.2 0.524 . . . . 0.0 111.077 -179.429 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.502 HD12 ' O ' ' A' ' 18' ' ' ALA . 10.2 tp -95.67 129.95 42.71 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 108.042 -1.096 . . . . 0.0 108.042 178.421 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.479 ' N ' HD12 ' A' ' 32' ' ' LEU . 1.3 tt -92.35 124.89 36.74 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.334 0.587 . . . . 0.0 109.99 -179.89 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 72.6 m-70 -90.29 -27.86 19.16 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.287 -0.87 . . . . 0.0 111.864 -178.429 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -172.91 161.91 4.62 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 119.531 -0.867 . . . . 0.0 111.331 177.732 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' VAL . . . . . 0.533 HG22 ' H ' ' A' ' 37' ' ' SER . 4.6 p -144.95 168.76 8.8 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.161 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.121 -179.186 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' SER . . . . . 0.533 ' H ' HG22 ' A' ' 36' ' ' VAL . 26.4 t -141.97 168.32 20.02 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 107.919 -1.141 . . . . 0.0 107.919 178.73 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 22.4 tp -64.92 -1.61 2.12 Favored 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 119.64 -0.824 . . . . 0.0 110.281 -179.495 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 3.2 p-80 -161.1 41.24 0.15 Allowed 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 120.569 -0.452 . . . . 0.0 111.857 179.655 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -178.76 155.96 17.65 Favored Glycine 0 CA--C 1.528 0.863 0 N-CA-C 111.255 -0.738 . . . . 0.0 111.255 179.635 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.461 ' CG2' HG21 ' A' ' 73' ' ' ILE . 0.1 OUTLIER -147.29 148.72 16.26 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.321 0 CA-C-O 121.332 0.587 . . . . 0.0 111.991 -178.995 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.465 HD23 ' N ' ' A' ' 43' ' ' VAL . 1.0 OUTLIER -121.76 133.53 54.92 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 114.941 -1.027 . . . . 0.0 108.498 178.735 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.465 ' N ' HD23 ' A' ' 42' ' ' LEU . 32.2 m -138.76 175.19 8.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-O 121.278 0.561 . . . . 0.0 111.891 -179.036 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -97.58 144.18 17.15 Favored Glycine 0 CA--C 1.527 0.842 0 N-CA-C 109.161 -1.575 . . . . 0.0 109.161 177.986 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' GLN . . . . . 0.495 ' O ' ' CD ' ' A' ' 45' ' ' GLN . 0.0 OUTLIER -87.34 118.63 70.17 Favored Pre-proline 0 CA--C 1.534 0.342 0 CA-C-N 118.159 0.98 . . . . 0.0 111.941 -178.339 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 95.6 Cg_endo -86.45 162.19 9.61 Favored 'Trans proline' 0 C--N 1.307 -1.608 0 C-N-CA 121.586 1.524 . . . . 0.0 111.196 178.649 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 4.0 mm100 -65.45 -40.23 92.98 Favored 'General case' 0 CA--C 1.533 0.322 0 N-CA-C 112.347 0.499 . . . . 0.0 112.347 -178.959 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' ASP . . . . . 0.55 ' O ' ' NE1' ' A' ' 29' ' ' TRP . 7.7 m-20 -71.78 8.83 1.04 Allowed 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.059 0.392 . . . . 0.0 112.059 -178.677 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 49' ' ' TRP . . . . . 0.471 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 64.0 t-105 -60.28 67.77 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 112.054 0.39 . . . . 0.0 112.054 -179.425 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' ASN . . . . . 0.521 ' N ' ' O ' ' A' ' 48' ' ' ASP . 10.8 t30 -93.29 78.56 4.48 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 120.195 -0.602 . . . . 0.0 109.394 178.395 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -144.6 145.41 14.84 Favored Glycine 0 CA--C 1.527 0.822 0 C-N-CA 121.165 -0.541 . . . . 0.0 111.807 -179.326 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 45.7 t0 -78.02 122.41 85.39 Favored Pre-proline 0 CA--C 1.536 0.419 0 CA-C-N 115.505 -0.348 . . . . 0.0 110.824 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 20.6 Cg_endo -60.96 -22.3 74.05 Favored 'Trans proline' 0 N--CA 1.498 1.769 0 C-N-CA 122.805 2.336 . . . . 0.0 112.079 -179.576 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 32.1 mt-30 -78.72 -23.53 45.45 Favored 'General case' 0 C--N 1.324 -0.54 0 C-N-CA 120.633 -0.427 . . . . 0.0 111.374 -179.264 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.567 ' O ' ' CE1' ' A' ' 57' ' ' PHE . 34.3 mtp85 -93.85 147.31 33.3 Favored Pre-proline 0 C--N 1.332 -0.186 0 C-N-CA 120.876 -0.33 . . . . 0.0 110.492 -179.741 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -60.71 160.96 22.8 Favored 'Trans proline' 0 N--CA 1.496 1.67 0 C-N-CA 123.041 2.494 . . . . 0.0 113.399 -178.817 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.567 ' CE1' ' O ' ' A' ' 55' ' ' ARG . 39.1 m-85 -130.44 157.14 43.44 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 115.162 -0.927 . . . . 0.0 109.117 179.414 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -124.02 137.62 54.57 Favored 'General case' 0 N--CA 1.469 0.523 0 N-CA-C 109.486 -0.561 . . . . 0.0 109.486 178.683 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -118.55 136.7 53.7 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 112.41 0.522 . . . . 0.0 112.41 -178.093 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.475 ' NE ' HD13 ' A' ' 23' ' ' LEU . 0.6 OUTLIER -121.55 127.43 50.95 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 108.075 -1.083 . . . . 0.0 108.075 176.631 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.494 HD11 ' SD ' ' A' ' 71' ' ' MET . 12.6 mt -110.11 151.18 27.55 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.93 0.395 . . . . 0.0 110.977 -178.63 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 55.6 m-85 -132.31 108.58 9.3 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.528 179.938 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.555 HD23 ' C ' ' A' ' 63' ' ' LEU . 3.9 tt -104.17 -82.83 0.5 Allowed 'General case' 0 C--N 1.333 -0.121 0 CA-C-N 115.65 -0.705 . . . . 0.0 109.359 179.238 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.453 ' H ' ' HB ' ' A' ' 67' ' ' VAL . . . -77.59 176.11 53.85 Favored Glycine 0 CA--C 1.521 0.418 0 N-CA-C 109.094 -1.602 . . . . 0.0 109.094 178.279 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.718 ' C ' HD13 ' A' ' 65' ' ' LEU . 3.1 tm? -72.2 -35.91 69.06 Favored 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 119.852 -0.739 . . . . 0.0 109.768 -179.693 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 66' ' ' ASP . . . . . 0.478 ' O ' ' OD1' ' A' ' 66' ' ' ASP . 15.2 t0 -98.55 9.51 43.05 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.15 179.608 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 67' ' ' VAL . . . . . 0.539 ' O ' HG12 ' A' ' 67' ' ' VAL . 15.0 t -107.1 96.47 4.66 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.296 0 CA-C-O 121.453 0.644 . . . . 0.0 112.069 -178.719 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -112.53 118.19 34.44 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 108.173 -1.047 . . . . 0.0 108.173 178.208 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.792 HG23 ' OG ' ' A' ' 94' ' ' SER . 3.3 mt -113.37 144.21 21.48 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.233 0 CA-C-O 121.065 0.46 . . . . 0.0 111.373 -178.694 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.43 ' HD3' ' N ' ' A' ' 70' ' ' ARG . 0.0 OUTLIER -128.14 131.53 48.96 Favored 'General case' 0 C--O 1.239 0.508 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.868 179.407 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 71' ' ' MET . . . . . 0.494 ' SD ' HD11 ' A' ' 61' ' ' LEU . 0.0 OUTLIER -143.26 149.74 38.31 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.11 -179.628 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -104.88 127.24 52.63 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 107.945 -1.131 . . . . 0.0 107.945 178.307 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.656 HD12 ' CG ' ' A' ' 85' ' ' PHE . 14.0 pt -134.9 157.91 41.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 N-CA-C 112.888 0.699 . . . . 0.0 112.888 -177.507 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 9.2 p -122.69 156.06 35.14 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.045 -0.98 . . . . 0.0 109.911 179.032 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.447 HD12 ' HA ' ' A' ' 75' ' ' LEU . 7.2 tp -65.42 119.05 10.3 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.885 0.374 . . . . 0.0 111.054 -179.447 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -97.63 -41.98 7.87 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.554 177.614 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' TRP . . . . . 0.597 ' NE1' ' HA3' ' A' ' 84' ' ' GLY . 67.7 p-90 -171.01 170.02 6.39 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 115.828 -0.624 . . . . 0.0 109.894 -179.741 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -151.32 124.02 8.52 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 110.017 -0.364 . . . . 0.0 110.017 178.84 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' ARG . . . . . 0.448 ' NH1' ' OD2' ' A' ' 80' ' ' ASP . 1.0 OUTLIER -152.15 133.64 14.58 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 119.833 -0.747 . . . . 0.0 112.91 179.67 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 80' ' ' ASP . . . . . 0.448 ' OD2' ' NH1' ' A' ' 79' ' ' ARG . 61.5 m-20 56.75 47.43 18.16 Favored 'General case' 0 N--CA 1.462 0.168 0 N-CA-C 114.131 1.16 . . . . 0.0 114.131 176.357 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 84.97 -28.35 4.59 Favored Glycine 0 CA--C 1.524 0.649 0 C-N-CA 120.425 -0.893 . . . . 0.0 113.311 177.043 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 4.5 mt -89.84 158.03 17.65 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 117.705 0.752 . . . . 0.0 110.567 -178.915 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 58.4 mt -129.95 135.59 48.49 Favored 'General case' 0 CA--C 1.517 -0.301 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.443 -179.13 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 84' ' ' GLY . . . . . 0.597 ' HA3' ' NE1' ' A' ' 77' ' ' TRP . . . -96.86 151.77 19.93 Favored Glycine 0 N--CA 1.451 -0.323 0 N-CA-C 109.517 -1.433 . . . . 0.0 109.517 178.522 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 85' ' ' PHE . . . . . 0.656 ' CG ' HD12 ' A' ' 73' ' ' ILE . 25.2 m-85 -145.56 132.32 20.03 Favored 'General case' 0 C--N 1.318 -0.804 0 C-N-CA 120.711 -0.396 . . . . 0.0 110.884 -179.205 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.464 ' O ' ' NE2' ' A' ' 88' ' ' GLN . 34.3 tt0 -104.04 126.58 51.27 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 179.614 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 87' ' ' CYS . . . . . 0.573 ' HA ' HG22 ' A' ' 73' ' ' ILE . 39.1 t -69.23 122.2 18.37 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.005 0.431 . . . . 0.0 112.083 -178.486 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 88' ' ' GLN . . . . . 0.464 ' NE2' ' O ' ' A' ' 86' ' ' GLU . 51.6 mm-40 -95.28 -33.31 12.61 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.14 179.113 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -162.11 141.92 9.88 Favored 'General case' 0 C--O 1.223 -0.313 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.067 179.974 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.617 HD11 ' OG ' ' A' ' 94' ' ' SER . 10.5 tt -145.05 141.17 23.01 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-O 121.237 0.541 . . . . 0.0 110.049 -179.467 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -59.44 141.52 54.48 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 115.319 -0.855 . . . . 0.0 112.382 -177.987 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.508 ' HA ' HD12 ' A' ' 95' ' ' ILE . 14.6 tp -54.21 -41.71 68.94 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 114.963 -1.017 . . . . 0.0 110.669 -179.549 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -65.49 -40.13 92.74 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 179.339 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 94' ' ' SER . . . . . 0.792 ' OG ' HG23 ' A' ' 69' ' ' ILE . 2.3 t -69.54 -35.01 75.06 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.149 179.392 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 95' ' ' ILE . . . . . 0.508 HD12 ' HA ' ' A' ' 92' ' ' LEU . 36.1 mt -58.37 -38.35 68.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.802 -0.636 . . . . 0.0 109.821 -179.906 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -70.75 -37.98 73.46 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 120.383 -0.527 . . . . 0.0 111.051 -179.202 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 61.9 m-70 . . . . . 0 C--N 1.326 -0.426 0 C-N-CA 119.381 -0.927 . . . . 0.0 109.112 179.772 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.644 ' N ' HD12 ' A' ' 14' ' ' ILE . 1.4 mp . . . . . 0 CA--C 1.52 -0.178 0 CA-C-O 120.656 0.265 . . . . 0.0 110.455 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -95.46 119.72 34.46 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.459 0.647 . . . . 0.0 111.55 -179.883 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -150.02 155.12 39.35 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 114.904 -1.044 . . . . 0.0 108.293 177.891 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' ASP . . . . . 0.53 ' OD1' ' N ' ' A' ' 17' ' ' ASP . 17.9 p-10 -95.6 146.22 24.64 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 120.09 -0.644 . . . . 0.0 111.005 -178.626 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -178.65 174.9 1.14 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.244 179.588 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 3.5 t0 -96.07 133.91 39.75 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.854 -179.669 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.539 ' O ' ' O ' ' A' ' 31' ' ' VAL . 27.7 p -133.71 152.51 51.9 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.253 0.549 . . . . 0.0 110.358 178.729 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.482 ' OE1' ' NH2' ' A' ' 28' ' ' ARG . 6.7 mm-40 -131.34 151.96 51.04 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 108.976 -0.75 . . . . 0.0 108.976 179.533 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' ILE . . . . . 0.428 ' HA ' ' O ' ' A' ' 58' ' ' GLU . 22.6 mt -134.44 136.25 53.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 C-N-CA 120.053 -0.659 . . . . 0.0 111.304 -179.376 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -124.16 123.27 39.93 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.473 -0.785 . . . . 0.0 111.402 -179.142 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.685 ' NE2' ' CZ ' ' A' ' 57' ' ' PHE . 12.0 tt0 -128.12 102.07 6.56 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.538 -0.755 . . . . 0.0 109.811 178.61 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 80.97 -125.8 7.06 Favored Glycine 0 CA--C 1.522 0.528 0 N-CA-C 109.974 -1.25 . . . . 0.0 109.974 -178.894 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -100.55 12.19 37.86 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.954 0.407 . . . . 0.0 110.014 179.489 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.595 ' HB3' ' CZ2' ' A' ' 29' ' ' TRP . 24.1 mtt85 -114.27 135.84 53.62 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 112.968 0.729 . . . . 0.0 112.968 -178.062 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.482 ' NH2' ' OE1' ' A' ' 21' ' ' GLU . 72.0 ttt-85 -128.69 151.38 49.59 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.017 178.77 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.595 ' CZ2' ' HB3' ' A' ' 27' ' ' ARG . 6.5 m-90 -149.25 156.56 42.31 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.59 -179.249 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -100.83 140.07 35.64 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.09 -0.504 . . . . 0.0 109.676 179.321 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.539 ' O ' ' O ' ' A' ' 20' ' ' SER . 12.5 m -149.92 158.45 5.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-O 121.324 0.583 . . . . 0.0 111.19 -179.267 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 1.049 ' H ' HD23 ' A' ' 32' ' ' LEU . 1.0 OUTLIER -99.02 129.95 45.33 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 108.577 -0.897 . . . . 0.0 108.577 178.556 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.2 tt -95.18 125.51 39.87 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 120.306 -0.558 . . . . 0.0 109.787 -179.62 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 20.3 m-70 -90.62 -26.17 19.77 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.402 -0.817 . . . . 0.0 111.714 -178.455 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -172.16 161.31 5.42 Favored 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 119.544 -0.862 . . . . 0.0 111.271 177.403 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' VAL . . . . . 0.545 HG22 ' N ' ' A' ' 37' ' ' SER . 8.4 p -145.17 168.59 8.59 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.823 -178.792 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' SER . . . . . 0.545 ' N ' HG22 ' A' ' 36' ' ' VAL . 6.4 t -141.77 169.66 17.17 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 108.045 -1.094 . . . . 0.0 108.045 178.801 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.476 ' O ' HD23 ' A' ' 38' ' ' LEU . 5.7 tt -67.69 -1.97 6.13 Favored 'General case' 0 C--N 1.323 -0.556 0 C-N-CA 119.872 -0.731 . . . . 0.0 110.69 -179.325 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' HIS . . . . . 0.436 ' O ' ' CG ' ' A' ' 39' ' ' HIS . 53.1 t-80 -156.98 35.42 0.29 Allowed 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 120.777 -0.369 . . . . 0.0 111.501 -179.756 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -175.96 158.98 26.17 Favored Glycine 0 CA--C 1.527 0.787 0 N-CA-C 111.241 -0.744 . . . . 0.0 111.241 179.811 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -149.36 149.58 14.65 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.388 0 CA-C-O 121.104 0.478 . . . . 0.0 111.532 -178.963 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.803 HD23 ' N ' ' A' ' 43' ' ' VAL . 2.7 tt -122.09 141.86 50.96 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 115.527 -0.761 . . . . 0.0 109.105 178.519 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.803 ' N ' HD23 ' A' ' 42' ' ' LEU . 20.0 m -145.26 174.98 2.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-O 121.263 0.554 . . . . 0.0 111.684 -179.562 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -98.72 145.63 17.8 Favored Glycine 0 CA--C 1.528 0.846 0 N-CA-C 109.808 -1.317 . . . . 0.0 109.808 178.811 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 47.5 tt0 -87.22 113.27 53.0 Favored Pre-proline 0 N--CA 1.463 0.22 0 CA-C-N 117.611 0.706 . . . . 0.0 111.699 -178.654 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 96.9 Cg_endo -83.96 161.35 13.82 Favored 'Trans proline' 0 C--N 1.306 -1.682 0 C-N-CA 121.56 1.507 . . . . 0.0 111.372 179.031 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.612 ' CD ' ' H ' ' A' ' 47' ' ' GLN . 0.0 OUTLIER -65.12 -26.24 68.11 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 112.388 0.514 . . . . 0.0 112.388 -178.797 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 48' ' ' ASP . . . . . 0.534 ' O ' ' N ' ' A' ' 50' ' ' ASN . 1.3 p30 -86.65 8.42 22.45 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 112.085 0.402 . . . . 0.0 112.085 -178.619 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 49' ' ' TRP . . . . . 0.435 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 58.9 t-105 -60.52 68.56 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 111.786 0.291 . . . . 0.0 111.786 -179.69 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 50' ' ' ASN . . . . . 0.534 ' N ' ' O ' ' A' ' 48' ' ' ASP . 0.3 OUTLIER -93.15 78.77 4.54 Favored 'General case' 0 C--N 1.324 -0.509 0 C-N-CA 120.129 -0.628 . . . . 0.0 109.763 178.607 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -145.02 160.17 27.99 Favored Glycine 0 CA--C 1.525 0.708 0 N-CA-C 111.047 -0.821 . . . . 0.0 111.047 -179.611 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 30.1 t0 -95.31 110.89 52.98 Favored Pre-proline 0 CA--C 1.533 0.296 0 C-N-CA 121.267 -0.173 . . . . 0.0 110.924 -179.646 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_exo -47.79 -22.35 3.13 Favored 'Trans proline' 0 N--CA 1.493 1.485 0 C-N-CA 122.362 2.041 . . . . 0.0 112.357 179.614 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 83.7 mt-30 -76.77 -23.85 52.93 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.382 -179.411 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.521 ' O ' ' CE1' ' A' ' 57' ' ' PHE . 15.9 mtp180 -95.46 151.88 38.89 Favored Pre-proline 0 CA--C 1.531 0.227 0 N-CA-C 110.08 -0.341 . . . . 0.0 110.08 179.987 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 56' ' ' PRO . . . . . 0.57 ' O ' ' NE2' ' A' ' 24' ' ' GLN . 35.4 Cg_endo -64.85 160.87 38.8 Favored 'Trans proline' 0 N--CA 1.495 1.579 0 C-N-CA 122.852 2.368 . . . . 0.0 113.331 -178.497 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.685 ' CZ ' ' NE2' ' A' ' 24' ' ' GLN . 57.8 m-85 -130.71 154.66 47.72 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 114.997 -1.001 . . . . 0.0 109.192 179.486 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.428 ' O ' ' HA ' ' A' ' 22' ' ' ILE . 16.5 mt-10 -119.31 136.01 54.44 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 108.863 -0.792 . . . . 0.0 108.863 178.667 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 59' ' ' ALA . . . . . 0.533 ' C ' ' HE ' ' A' ' 60' ' ' ARG . . . -120.47 139.43 52.88 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.281 0.563 . . . . 0.0 112.507 -177.871 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.533 ' HE ' ' C ' ' A' ' 59' ' ' ALA . 2.4 mmp_? -123.96 127.67 48.29 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 108.418 -0.956 . . . . 0.0 108.418 177.304 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.422 HD12 ' C ' ' A' ' 60' ' ' ARG . 9.6 mp -105.78 150.36 25.61 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 120.701 -0.4 . . . . 0.0 110.386 -179.234 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 62' ' ' TYR . . . . . 0.446 ' N ' ' CD1' ' A' ' 62' ' ' TYR . 18.3 m-85 -133.9 108.99 8.75 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.46 179.643 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.54 HD23 ' C ' ' A' ' 63' ' ' LEU . 2.4 tt -104.97 -84.7 0.49 Allowed 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.582 -0.736 . . . . 0.0 109.207 179.382 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.436 ' H ' ' HB ' ' A' ' 67' ' ' VAL . . . -75.72 178.11 48.69 Favored Glycine 0 CA--C 1.52 0.384 0 N-CA-C 109.23 -1.548 . . . . 0.0 109.23 178.508 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 11.6 mt -73.34 -33.8 65.31 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 119.949 -0.7 . . . . 0.0 110.31 -179.588 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -100.87 9.31 42.48 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.822 179.913 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' VAL . . . . . 0.579 ' O ' HG12 ' A' ' 67' ' ' VAL . 8.7 t -104.94 94.97 3.43 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-O 121.334 0.588 . . . . 0.0 111.901 -178.824 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 6.1 tp -112.37 117.46 32.51 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 177.972 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.716 HG23 ' OG ' ' A' ' 94' ' ' SER . 3.4 mt -112.63 144.78 19.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 120.946 0.403 . . . . 0.0 111.148 -178.942 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 5.9 mtt85 -127.98 131.6 49.24 Favored 'General case' 0 C--O 1.239 0.506 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.75 179.344 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -142.95 149.03 37.85 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.211 -179.822 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 17.6 tp10 -100.44 134.2 43.74 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 107.635 -1.246 . . . . 0.0 107.635 178.123 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.59 HD12 ' CB ' ' A' ' 85' ' ' PHE . 4.5 pt -144.1 157.34 15.63 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.157 0 C-N-CA 119.084 -1.046 . . . . 0.0 113.138 -177.707 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 29.7 m -122.06 152.86 39.36 Favored 'General case' 0 N--CA 1.463 0.225 0 CA-C-N 115.012 -0.995 . . . . 0.0 109.965 178.877 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.589 HD22 ' CE1' ' A' ' 85' ' ' PHE . 0.2 OUTLIER -65.31 120.31 12.55 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-O 120.964 0.411 . . . . 0.0 110.398 -179.197 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 76' ' ' ALA . . . . . 0.575 ' N ' HD13 ' A' ' 75' ' ' LEU . . . -97.31 -37.63 9.97 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.166 177.53 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 77' ' ' TRP . . . . . 0.728 ' NE1' ' HA3' ' A' ' 84' ' ' GLY . 69.6 p-90 -171.12 169.91 6.33 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.745 179.725 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -151.45 123.9 8.37 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.178 178.459 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 21.6 ttm-85 -152.36 131.44 12.66 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 120.308 -0.557 . . . . 0.0 112.35 179.441 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 19.5 t70 55.95 47.28 20.31 Favored 'General case' 0 N--CA 1.466 0.325 0 N-CA-C 113.634 0.976 . . . . 0.0 113.634 176.257 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 68.74 12.28 64.2 Favored Glycine 0 CA--C 1.523 0.549 0 C-N-CA 120.325 -0.941 . . . . 0.0 111.594 178.603 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 32.4 mt -114.36 139.93 49.07 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 178.156 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 27.6 mt -128.45 135.28 49.26 Favored 'General case' 0 CA--C 1.512 -0.515 0 C-N-CA 120.298 -0.561 . . . . 0.0 111.51 -178.805 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 84' ' ' GLY . . . . . 0.728 ' HA3' ' NE1' ' A' ' 77' ' ' TRP . . . -103.49 155.39 17.92 Favored Glycine 0 N--CA 1.446 -0.667 0 N-CA-C 109.179 -1.568 . . . . 0.0 109.179 178.436 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 85' ' ' PHE . . . . . 0.59 ' CB ' HD12 ' A' ' 73' ' ' ILE . 49.6 m-85 -145.75 136.79 24.66 Favored 'General case' 0 C--N 1.311 -1.093 0 C-N-CA 120.792 -0.363 . . . . 0.0 110.417 -179.535 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.444 ' O ' ' NE2' ' A' ' 88' ' ' GLN . 4.6 pt-20 -103.89 127.76 51.4 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 179.232 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 87' ' ' CYS . . . . . 0.433 ' O ' ' CE1' ' A' ' 39' ' ' HIS . 4.8 t -75.73 126.08 30.3 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.889 0.376 . . . . 0.0 111.985 -178.305 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 88' ' ' GLN . . . . . 0.444 ' NE2' ' O ' ' A' ' 86' ' ' GLU . 0.0 OUTLIER -102.1 -28.5 12.3 Favored 'General case' 0 N--CA 1.462 0.143 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.49 179.318 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 89' ' ' HIS . . . . . 0.554 ' ND1' ' N ' ' A' ' 90' ' ' ILE . 0.1 OUTLIER -161.0 141.26 11.1 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.958 0.409 . . . . 0.0 110.377 179.712 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.826 HD11 ' OG ' ' A' ' 94' ' ' SER . 7.9 tt -146.01 141.34 21.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.186 -179.422 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 91' ' ' ASP . . . . . 0.526 ' N ' ' OD1' ' A' ' 91' ' ' ASP . 0.3 OUTLIER -55.24 143.15 28.88 Favored 'General case' 0 N--CA 1.462 0.139 0 CA-C-N 115.381 -0.827 . . . . 0.0 111.98 -178.293 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.509 ' HA ' HD12 ' A' ' 95' ' ' ILE . 59.2 tp -54.08 -41.66 68.46 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.066 -0.97 . . . . 0.0 109.705 -179.579 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -67.88 -38.33 82.91 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.001 -0.545 . . . . 0.0 109.554 179.081 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 94' ' ' SER . . . . . 0.826 ' OG ' HD11 ' A' ' 90' ' ' ILE . 5.6 t -68.25 -35.14 77.45 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.946 179.368 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 95' ' ' ILE . . . . . 0.509 HD12 ' HA ' ' A' ' 92' ' ' LEU . 44.2 mt -58.74 -38.26 70.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.786 -0.643 . . . . 0.0 109.702 179.507 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -71.42 -42.11 68.7 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.947 -179.728 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 61.3 m-70 . . . . . 0 C--N 1.325 -0.475 0 C-N-CA 119.745 -0.782 . . . . 0.0 109.718 -179.996 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 41.8 mm . . . . . 0 CA--C 1.521 -0.169 0 CA-C-O 120.594 0.235 . . . . 0.0 110.491 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -93.83 119.96 33.46 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.274 0.559 . . . . 0.0 110.95 179.834 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 5.0 p90 -149.99 158.08 43.8 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 108.522 -0.918 . . . . 0.0 108.522 178.07 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 17.8 p-10 -95.6 145.92 24.87 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 120.185 -0.606 . . . . 0.0 110.746 -179.126 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -178.94 177.08 0.86 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.99 -0.55 . . . . 0.0 109.81 179.52 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 37.3 t0 -96.39 133.27 41.01 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 120.763 -0.375 . . . . 0.0 110.783 -179.679 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.56 ' O ' ' O ' ' A' ' 31' ' ' VAL . 2.9 p -132.97 150.61 52.15 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.371 0.605 . . . . 0.0 110.106 178.734 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 28.9 mm-40 -129.44 135.74 49.05 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.453 -0.794 . . . . 0.0 108.962 179.82 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -117.59 136.13 55.76 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.438 0 C-N-CA 120.227 -0.589 . . . . 0.0 110.376 -179.66 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.506 ' H ' HD12 ' A' ' 23' ' ' LEU . 0.1 OUTLIER -125.38 123.2 38.81 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.518 -0.764 . . . . 0.0 111.08 -179.167 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.677 ' NE2' ' CZ ' ' A' ' 57' ' ' PHE . 12.1 tt0 -130.05 102.71 6.38 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.382 -0.826 . . . . 0.0 109.493 178.419 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 78.31 -127.93 8.44 Favored Glycine 0 CA--C 1.522 0.476 0 N-CA-C 109.672 -1.371 . . . . 0.0 109.672 -178.69 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.47 ' OE1' ' O ' ' A' ' 26' ' ' GLU . 2.5 pp20? -99.77 11.25 39.72 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.627 0.251 . . . . 0.0 110.387 179.468 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.562 ' HB3' ' CZ2' ' A' ' 29' ' ' TRP . 2.5 mpt_? -110.89 132.08 54.51 Favored 'General case' 0 CA--C 1.522 -0.134 0 CA-C-O 121.032 0.444 . . . . 0.0 111.872 -179.536 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.597 ' NH2' ' NH2' ' A' ' 60' ' ' ARG . 5.9 ttt180 -126.88 146.49 50.27 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.767 -0.651 . . . . 0.0 109.776 179.227 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.562 ' CZ2' ' HB3' ' A' ' 27' ' ' ARG . 6.5 m-90 -144.63 155.1 43.45 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.464 -179.097 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -100.24 128.62 46.27 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.785 -0.643 . . . . 0.0 109.934 179.734 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.56 ' O ' ' O ' ' A' ' 20' ' ' SER . 35.3 m -140.83 155.83 22.36 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-O 121.109 0.481 . . . . 0.0 111.202 -179.703 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.571 ' H ' HD23 ' A' ' 32' ' ' LEU . 0.3 OUTLIER -94.03 131.34 39.62 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 108.553 -0.906 . . . . 0.0 108.553 178.375 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.5 tt -89.91 127.22 35.97 Favored 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 120.298 -0.561 . . . . 0.0 109.852 -179.735 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' HIS . . . . . 0.417 ' NE2' HD12 ' A' ' 32' ' ' LEU . 74.0 m-70 -92.45 -27.32 17.54 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.501 -0.772 . . . . 0.0 111.581 -178.634 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 -175.16 162.32 2.99 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 119.693 -0.803 . . . . 0.0 111.536 177.599 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' VAL . . . . . 0.5 HG22 ' H ' ' A' ' 37' ' ' SER . 4.5 p -145.29 168.55 8.4 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.179 0 CA-C-N 115.503 -0.771 . . . . 0.0 111.094 -179.182 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 37' ' ' SER . . . . . 0.5 ' H ' HG22 ' A' ' 36' ' ' VAL . 20.1 t -142.08 169.71 17.07 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 107.738 -1.208 . . . . 0.0 107.738 178.474 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.611 HD23 ' H ' ' A' ' 38' ' ' LEU . 0.3 OUTLIER -66.31 -0.72 2.78 Favored 'General case' 0 C--N 1.322 -0.598 0 C-N-CA 119.552 -0.859 . . . . 0.0 110.874 -179.256 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 39' ' ' HIS . . . . . 0.448 ' CE1' ' O ' ' A' ' 87' ' ' CYS . 38.4 t-80 -158.9 38.16 0.22 Allowed 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 120.639 -0.424 . . . . 0.0 111.566 -179.828 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -177.46 158.16 23.33 Favored Glycine 0 CA--C 1.528 0.906 0 C-N-CA 120.606 -0.807 . . . . 0.0 111.422 179.871 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -148.49 148.95 15.56 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.374 0 CA-C-O 121.421 0.629 . . . . 0.0 111.768 -178.736 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -122.39 138.5 54.51 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 115.01 -0.996 . . . . 0.0 108.947 178.96 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 23.6 m -142.83 174.58 5.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-O 121.16 0.505 . . . . 0.0 111.491 -179.695 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -95.13 144.9 17.47 Favored Glycine 0 CA--C 1.529 0.923 0 N-CA-C 109.528 -1.429 . . . . 0.0 109.528 178.285 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' GLN . . . . . 0.557 ' NE2' ' O ' ' A' ' 46' ' ' PRO . 18.0 tm0? -87.58 115.5 63.07 Favored Pre-proline 0 N--CA 1.464 0.264 0 CA-C-N 118.121 0.96 . . . . 0.0 112.099 -178.523 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.557 ' O ' ' NE2' ' A' ' 45' ' ' GLN . 96.1 Cg_endo -85.97 161.96 10.31 Favored 'Trans proline' 0 C--N 1.308 -1.588 0 C-N-CA 121.562 1.508 . . . . 0.0 111.213 178.587 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.2 mt-30 -65.14 -40.36 94.29 Favored 'General case' 0 N--CA 1.466 0.37 0 N-CA-C 112.585 0.587 . . . . 0.0 112.585 -178.709 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' ASP . . . . . 0.572 ' O ' ' N ' ' A' ' 50' ' ' ASN . 6.4 m-20 -72.89 8.88 1.33 Allowed 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 112.035 0.383 . . . . 0.0 112.035 -178.479 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 49' ' ' TRP . . . . . 0.46 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 64.5 t-105 -58.97 69.06 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.729 -0.214 . . . . 0.0 111.531 -179.878 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 50' ' ' ASN . . . . . 0.572 ' N ' ' O ' ' A' ' 48' ' ' ASP . 15.8 t-20 -93.25 78.55 4.5 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 120.201 -0.6 . . . . 0.0 109.531 178.812 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -142.54 160.16 27.3 Favored Glycine 0 CA--C 1.52 0.401 0 N-CA-C 111.295 -0.722 . . . . 0.0 111.295 -179.557 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -95.02 121.97 61.21 Favored Pre-proline 0 C--N 1.325 -0.465 0 CA-C-N 115.367 -0.416 . . . . 0.0 110.662 -179.637 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 17.4 Cg_endo -60.15 -22.48 70.17 Favored 'Trans proline' 0 N--CA 1.494 1.519 0 C-N-CA 122.259 1.973 . . . . 0.0 111.564 -179.742 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 6.4 mm-40 -77.73 -21.68 51.52 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.472 179.927 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.511 ' O ' ' CE1' ' A' ' 57' ' ' PHE . 72.2 mtt-85 -97.65 149.86 36.17 Favored Pre-proline 0 CA--C 1.53 0.208 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.108 179.74 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 56' ' ' PRO . . . . . 0.53 ' O ' ' NE2' ' A' ' 24' ' ' GLN . 37.5 Cg_endo -65.56 160.93 40.74 Favored 'Trans proline' 0 N--CA 1.497 1.683 0 C-N-CA 123.116 2.544 . . . . 0.0 113.476 -179.093 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.677 ' CZ ' ' NE2' ' A' ' 24' ' ' GLN . 26.9 m-85 -129.58 156.61 43.91 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 114.905 -1.043 . . . . 0.0 108.599 179.076 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.403 ' O ' HD12 ' A' ' 23' ' ' LEU . 58.6 mt-10 -122.54 139.67 53.63 Favored 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 109.238 -0.652 . . . . 0.0 109.238 178.604 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -121.06 137.4 54.67 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.117 0.484 . . . . 0.0 111.74 -178.223 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.597 ' NH2' ' NH2' ' A' ' 28' ' ' ARG . 51.9 mtm-85 -123.19 127.84 49.2 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 177.524 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.487 HD11 ' SD ' ' A' ' 71' ' ' MET . 0.1 OUTLIER -107.9 151.1 26.23 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 120.493 -0.483 . . . . 0.0 111.066 -178.614 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 28.9 m-85 -134.0 109.67 9.15 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.17 179.527 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 1.6 tt -104.63 -82.7 0.51 Allowed 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 115.838 -0.619 . . . . 0.0 109.398 179.529 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.464 ' H ' ' HB ' ' A' ' 67' ' ' VAL . . . -77.76 179.27 51.3 Favored Glycine 0 CA--C 1.523 0.533 0 N-CA-C 109.416 -1.474 . . . . 0.0 109.416 178.568 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.812 ' N ' HD22 ' A' ' 65' ' ' LEU . 1.9 mm? -73.78 -31.89 63.52 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 119.925 -0.71 . . . . 0.0 110.129 -179.752 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.9 p30 -103.44 9.22 37.83 Favored 'General case' 0 C--N 1.332 -0.17 0 C-N-CA 122.775 0.43 . . . . 0.0 111.198 -179.927 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' VAL . . . . . 0.538 ' O ' HG12 ' A' ' 67' ' ' VAL . 8.7 t -105.07 96.37 4.54 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.37 0 CA-C-O 121.2 0.524 . . . . 0.0 111.807 -178.78 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.443 HD12 ' N ' ' A' ' 69' ' ' ILE . 1.8 tp -114.37 118.48 33.98 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 178.678 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.443 ' N ' HD12 ' A' ' 68' ' ' LEU . 2.9 mt -113.9 145.0 20.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.339 -0.392 . . . . 0.0 111.353 -178.791 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 8.4 ptm180 -128.41 131.06 48.48 Favored 'General case' 0 C--O 1.24 0.562 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.078 179.033 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' MET . . . . . 0.487 ' SD ' HD11 ' A' ' 61' ' ' LEU . 0.4 OUTLIER -139.59 147.98 41.88 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.607 -0.724 . . . . 0.0 109.953 179.451 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -112.57 118.46 35.16 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 107.661 -1.237 . . . . 0.0 107.661 178.077 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.702 HD12 ' CB ' ' A' ' 85' ' ' PHE . 3.3 pt -129.32 168.02 23.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 N-CA-C 113.466 0.913 . . . . 0.0 113.466 -176.146 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 58.7 m -121.94 150.74 41.58 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 114.961 -1.018 . . . . 0.0 109.807 178.837 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.537 HD12 ' CE1' ' A' ' 85' ' ' PHE . 14.3 tp -66.6 123.58 20.47 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 121.268 0.556 . . . . 0.0 110.175 -179.837 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -98.15 -45.1 6.34 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 115.448 -0.796 . . . . 0.0 111.306 178.533 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 77' ' ' TRP . . . . . 0.507 ' CE2' ' HA3' ' A' ' 84' ' ' GLY . 66.5 p-90 -167.82 167.41 13.05 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.224 -178.965 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -146.4 123.85 11.7 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 109.824 -0.435 . . . . 0.0 109.824 178.622 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 41.4 ttt180 -152.11 133.54 14.54 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 119.917 -0.713 . . . . 0.0 112.804 179.843 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 56.77 46.91 19.1 Favored 'General case' 0 N--CA 1.464 0.233 0 N-CA-C 114.034 1.124 . . . . 0.0 114.034 176.763 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 83.16 -26.82 4.21 Favored Glycine 0 CA--C 1.523 0.569 0 C-N-CA 120.417 -0.897 . . . . 0.0 113.01 177.166 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 4.7 mt -89.56 153.34 20.85 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 117.528 0.664 . . . . 0.0 110.514 -179.06 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 79.4 mt -126.88 135.62 51.21 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.995 -179.256 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 84' ' ' GLY . . . . . 0.507 ' HA3' ' CE2' ' A' ' 77' ' ' TRP . . . -106.07 149.14 16.61 Favored Glycine 0 N--CA 1.454 -0.123 0 N-CA-C 109.75 -1.34 . . . . 0.0 109.75 178.906 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 85' ' ' PHE . . . . . 0.702 ' CB ' HD12 ' A' ' 73' ' ' ILE . 78.7 m-85 -142.05 142.93 32.89 Favored 'General case' 0 C--N 1.32 -0.697 0 C-N-CA 120.824 -0.35 . . . . 0.0 110.626 -179.748 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 23.9 tt0 -103.73 128.59 51.08 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 179.246 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 87' ' ' CYS . . . . . 0.503 ' HA ' HG22 ' A' ' 73' ' ' ILE . 14.7 t -68.43 120.85 15.17 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.087 0.47 . . . . 0.0 111.84 -178.463 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 6.1 tp60 -95.52 -36.98 11.08 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.366 179.561 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 89' ' ' HIS . . . . . 0.569 ' ND1' ' N ' ' A' ' 90' ' ' ILE . 0.0 OUTLIER -161.74 141.92 10.43 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.185 179.981 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.569 ' N ' ' ND1' ' A' ' 89' ' ' HIS . 6.3 tt -145.22 140.87 22.74 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-O 121.239 0.543 . . . . 0.0 110.058 -179.251 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -55.44 143.62 28.41 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-N 115.244 -0.889 . . . . 0.0 112.109 -178.325 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 3.8 tt -54.49 -42.07 70.31 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.166 -0.925 . . . . 0.0 109.956 -179.686 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -68.89 -38.7 79.8 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.604 -0.517 . . . . 0.0 109.604 179.206 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 94' ' ' SER . . . . . 0.421 ' HB3' HG23 ' A' ' 69' ' ' ILE . 7.4 m -64.75 -36.2 83.52 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.779 -0.646 . . . . 0.0 109.59 179.14 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 24.1 mt -59.0 -38.36 73.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.648 -0.705 . . . . 0.0 109.998 179.677 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -71.25 -42.29 69.0 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 120.312 -0.555 . . . . 0.0 111.283 -179.189 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 62.0 m-70 . . . . . 0 C--N 1.325 -0.486 0 C-N-CA 119.638 -0.825 . . . . 0.0 109.49 -179.757 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 39.5 mm . . . . . 0 C--O 1.231 0.111 0 N-CA-C 110.02 -0.363 . . . . 0.0 110.02 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -95.07 120.04 34.6 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.513 0.673 . . . . 0.0 111.649 -179.351 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 2.2 p90 -149.99 158.05 43.77 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 108.146 -1.057 . . . . 0.0 108.146 177.659 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' ASP . . . . . 0.482 ' OD1' ' N ' ' A' ' 18' ' ' ALA . 23.7 t0 -95.62 146.18 24.68 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 120.049 -0.661 . . . . 0.0 111.085 -178.822 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.482 ' N ' ' OD1' ' A' ' 17' ' ' ASP . . . -179.16 175.79 0.93 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.06 179.392 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -96.17 134.11 39.65 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.688 -179.676 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.639 ' O ' ' O ' ' A' ' 31' ' ' VAL . 5.8 p -135.47 157.21 47.46 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.142 179.044 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.519 ' HB3' ' NH1' ' A' ' 28' ' ' ARG . 50.2 mt-10 -142.04 145.56 34.52 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 179.168 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 28.1 mt -123.01 136.39 59.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-O 121.168 0.508 . . . . 0.0 111.787 -178.235 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.493 ' H ' HD12 ' A' ' 23' ' ' LEU . 0.2 OUTLIER -119.58 123.38 43.79 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.562 -0.744 . . . . 0.0 110.603 179.919 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.425 ' O ' ' OE1' ' A' ' 24' ' ' GLN . 1.5 tm0? -130.51 101.91 5.92 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.404 -0.817 . . . . 0.0 109.671 178.929 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 80.33 -126.79 7.59 Favored Glycine 0 CA--C 1.524 0.624 0 N-CA-C 109.949 -1.26 . . . . 0.0 109.949 -178.715 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.3 pt-20 -100.66 11.96 38.42 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.872 0.367 . . . . 0.0 110.047 179.57 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.52 ' HB3' ' CZ2' ' A' ' 29' ' ' TRP . 38.4 mtt-85 -114.58 136.0 53.52 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 112.771 0.656 . . . . 0.0 112.771 -178.036 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.777 ' CG ' HH11 ' A' ' 28' ' ' ARG . 0.0 OUTLIER -128.11 149.64 50.32 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.261 179.1 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.539 ' NE1' ' O ' ' A' ' 48' ' ' ASP . 6.7 m-90 -146.74 155.03 42.08 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.454 -0.794 . . . . 0.0 110.297 -179.477 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 11.9 mt-10 -100.33 136.61 39.95 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.042 -0.526 . . . . 0.0 109.912 179.502 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.639 ' O ' ' O ' ' A' ' 20' ' ' SER . 17.1 m -147.38 156.93 9.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-O 121.25 0.547 . . . . 0.0 111.167 -179.552 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 1.072 ' H ' HD23 ' A' ' 32' ' ' LEU . 1.4 pt? -95.88 130.29 42.88 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 108.817 -0.808 . . . . 0.0 108.817 178.498 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.6 tt -91.7 126.0 36.63 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.267 0.556 . . . . 0.0 110.092 -179.527 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 74.5 m-70 -91.95 -27.45 17.87 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.276 -0.875 . . . . 0.0 111.803 -178.531 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -173.7 161.14 3.85 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 119.574 -0.85 . . . . 0.0 111.317 177.576 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' VAL . . . . . 0.525 HG22 ' N ' ' A' ' 37' ' ' SER . 5.6 p -144.57 168.84 9.51 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.118 0 CA-C-N 115.584 -0.735 . . . . 0.0 111.067 -179.09 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 37' ' ' SER . . . . . 0.525 ' N ' HG22 ' A' ' 36' ' ' VAL . 10.8 m -142.28 169.65 17.19 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 107.982 -1.118 . . . . 0.0 107.982 178.518 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.586 ' H ' HD12 ' A' ' 38' ' ' LEU . 2.0 mp -65.57 -1.21 2.45 Favored 'General case' 0 C--N 1.324 -0.517 0 C-N-CA 119.583 -0.847 . . . . 0.0 110.305 -179.803 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 39' ' ' HIS . . . . . 0.414 ' O ' ' CG ' ' A' ' 39' ' ' HIS . 14.4 p80 -163.11 41.25 0.1 Allowed 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 120.748 -0.381 . . . . 0.0 111.469 179.813 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -176.07 152.24 12.66 Favored Glycine 0 CA--C 1.525 0.661 0 N-CA-C 110.997 -0.841 . . . . 0.0 110.997 179.835 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -147.31 148.67 16.31 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.208 0 CA-C-O 121.495 0.664 . . . . 0.0 111.647 -179.135 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -121.76 140.33 52.47 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 114.836 -1.075 . . . . 0.0 108.719 178.977 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.2 m -144.11 175.13 3.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-O 121.328 0.585 . . . . 0.0 111.752 -179.441 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -97.15 144.57 17.41 Favored Glycine 0 CA--C 1.529 0.938 0 N-CA-C 109.247 -1.541 . . . . 0.0 109.247 178.01 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' GLN . . . . . 0.409 ' O ' ' OE1' ' A' ' 45' ' ' GLN . 1.8 tm0? -87.42 115.6 63.33 Favored Pre-proline 0 N--CA 1.464 0.274 0 CA-C-N 118.127 0.963 . . . . 0.0 111.75 -178.431 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 79.4 Cg_endo -86.07 162.22 10.16 Favored 'Trans proline' 0 C--N 1.307 -1.65 0 C-N-CA 121.765 1.643 . . . . 0.0 111.462 178.931 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.498 ' OE1' ' N ' ' A' ' 47' ' ' GLN . 25.9 mp0 -65.28 -40.24 93.64 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 112.153 0.427 . . . . 0.0 112.153 -179.0 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 48' ' ' ASP . . . . . 0.539 ' O ' ' NE1' ' A' ' 29' ' ' TRP . 16.4 m-20 -72.56 8.41 1.44 Allowed 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.05 0.389 . . . . 0.0 112.05 -178.538 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 49' ' ' TRP . . . . . 0.448 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 60.7 t-105 -61.45 68.43 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 111.696 0.258 . . . . 0.0 111.696 -179.657 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 50' ' ' ASN . . . . . 0.52 ' N ' ' O ' ' A' ' 48' ' ' ASP . 0.5 OUTLIER -93.28 78.98 4.47 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 120.023 -0.671 . . . . 0.0 109.682 178.688 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -141.77 158.22 26.57 Favored Glycine 0 CA--C 1.525 0.696 0 N-CA-C 111.369 -0.692 . . . . 0.0 111.369 -179.501 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 33.7 t0 -93.99 111.49 53.26 Favored Pre-proline 0 CA--C 1.533 0.311 0 CA-C-N 115.744 -0.228 . . . . 0.0 110.774 -179.89 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 76.7 Cg_exo -47.24 -22.28 2.31 Favored 'Trans proline' 0 N--CA 1.496 1.63 0 C-N-CA 122.597 2.198 . . . . 0.0 112.413 179.858 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 37.3 mt-30 -79.13 -24.01 43.64 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.82 -178.581 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.55 ' O ' ' CE1' ' A' ' 57' ' ' PHE . 3.0 mpt_? -94.82 151.4 38.99 Favored Pre-proline 0 C--N 1.33 -0.257 0 C-N-CA 120.581 -0.448 . . . . 0.0 109.962 179.69 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 35.3 Cg_endo -64.3 160.86 36.83 Favored 'Trans proline' 0 N--CA 1.495 1.6 0 C-N-CA 122.816 2.344 . . . . 0.0 113.285 -178.77 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.55 ' CE1' ' O ' ' A' ' 55' ' ' ARG . 44.5 m-85 -130.5 155.68 46.06 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 114.991 -1.004 . . . . 0.0 109.005 179.419 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -121.61 134.46 55.0 Favored 'General case' 0 C--O 1.22 -0.452 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 178.728 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' ALA . . . . . 0.555 ' HB2' HD13 ' A' ' 73' ' ' ILE . . . -115.86 135.66 53.79 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.113 0.483 . . . . 0.0 112.108 -178.454 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.46 ' NE ' HD13 ' A' ' 23' ' ' LEU . 2.4 mpt_? -121.35 127.72 51.54 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 177.361 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 10.6 mt -108.93 137.15 47.3 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.914 0.387 . . . . 0.0 110.636 -179.061 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' TYR . . . . . 0.613 ' N ' ' CD1' ' A' ' 62' ' ' TYR . 1.0 OUTLIER -120.34 110.21 16.28 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.348 179.785 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.528 HD23 ' C ' ' A' ' 63' ' ' LEU . 2.2 tt -104.54 -84.55 0.48 Allowed 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.413 179.401 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.45 ' H ' ' HB ' ' A' ' 67' ' ' VAL . . . -76.52 -176.89 43.17 Favored Glycine 0 CA--C 1.521 0.455 0 N-CA-C 109.503 -1.439 . . . . 0.0 109.503 178.62 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 3.2 mt -76.11 -32.22 59.07 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.015 -0.674 . . . . 0.0 110.319 -179.703 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' ASP . . . . . 0.446 ' N ' ' OD1' ' A' ' 66' ' ' ASP . 1.3 m-20 -104.06 8.8 36.58 Favored 'General case' 0 C--N 1.332 -0.191 0 C-N-CA 122.759 0.424 . . . . 0.0 111.105 -179.913 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 67' ' ' VAL . . . . . 0.55 ' O ' HG12 ' A' ' 67' ' ' VAL . 9.3 t -103.34 95.05 3.54 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.296 0 CA-C-O 121.529 0.681 . . . . 0.0 111.8 -178.759 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -112.15 117.74 33.43 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 114.753 -1.112 . . . . 0.0 108.259 178.208 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.534 HG23 ' CB ' ' A' ' 94' ' ' SER . 6.0 mt -113.9 143.62 23.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.887 0.375 . . . . 0.0 110.562 -179.043 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 11.6 mtm180 -128.26 131.26 48.76 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.914 179.191 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 2.2 mtp -140.39 148.88 41.92 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.917 -0.583 . . . . 0.0 109.945 179.651 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' GLU . . . . . 0.417 ' HB2' ' CD2' ' A' ' 89' ' ' HIS . 12.0 tm-20 -102.39 134.71 45.26 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 107.48 -1.304 . . . . 0.0 107.48 178.247 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.555 HD13 ' HB2' ' A' ' 59' ' ' ALA . 5.3 pt -143.97 157.46 15.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 N-CA-C 113.472 0.916 . . . . 0.0 113.472 -177.352 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -121.18 150.17 41.71 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 114.759 -1.109 . . . . 0.0 109.444 178.604 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.572 HD12 ' CE1' ' A' ' 85' ' ' PHE . 8.7 tp -66.71 123.76 21.01 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.265 0.555 . . . . 0.0 110.242 -179.638 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -98.0 -43.99 6.84 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 115.05 -0.977 . . . . 0.0 111.011 178.138 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 77' ' ' TRP . . . . . 0.586 ' NE1' ' HA3' ' A' ' 84' ' ' GLY . 68.0 p-90 -168.63 168.06 11.06 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.047 -179.13 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -146.45 123.72 11.57 Favored 'General case' 0 N--CA 1.464 0.257 0 N-CA-C 109.804 -0.443 . . . . 0.0 109.804 178.291 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 6.7 ttt-85 -152.26 133.93 14.69 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 119.922 -0.711 . . . . 0.0 112.906 179.979 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 56.64 47.16 18.95 Favored 'General case' 0 N--CA 1.465 0.285 0 N-CA-C 113.649 0.981 . . . . 0.0 113.649 176.752 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 81.78 -26.49 3.66 Favored Glycine 0 CA--C 1.522 0.529 0 C-N-CA 120.506 -0.854 . . . . 0.0 113.104 177.386 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 4.7 mt -89.6 153.79 20.48 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 117.685 0.742 . . . . 0.0 110.447 -179.289 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 43.5 mt -126.27 135.5 51.62 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.981 -179.395 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 84' ' ' GLY . . . . . 0.586 ' HA3' ' NE1' ' A' ' 77' ' ' TRP . . . -98.83 152.61 19.72 Favored Glycine 0 N--CA 1.451 -0.31 0 N-CA-C 109.949 -1.26 . . . . 0.0 109.949 178.963 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 85' ' ' PHE . . . . . 0.572 ' CE1' HD12 ' A' ' 75' ' ' LEU . 40.7 m-85 -145.51 136.69 24.85 Favored 'General case' 0 C--N 1.319 -0.753 0 C-N-CA 120.673 -0.411 . . . . 0.0 111.017 -179.227 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.458 ' O ' ' NE2' ' A' ' 88' ' ' GLN . 31.5 tt0 -103.66 127.61 51.08 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 179.231 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 3.7 t -73.76 124.81 26.76 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.062 0.458 . . . . 0.0 112.042 -178.445 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 88' ' ' GLN . . . . . 0.458 ' NE2' ' O ' ' A' ' 86' ' ' GLU . 39.1 mm-40 -99.41 -32.12 11.31 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.692 -0.685 . . . . 0.0 110.228 179.277 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 89' ' ' HIS . . . . . 0.57 ' C ' ' ND1' ' A' ' 89' ' ' HIS . 0.0 OUTLIER -161.75 141.8 10.35 Favored 'General case' 0 C--O 1.225 -0.222 0 CA-C-O 121.033 0.444 . . . . 0.0 110.151 179.433 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.452 HG23 ' CG1' ' A' ' 95' ' ' ILE . 5.7 tt -145.66 141.29 22.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-O 121.436 0.636 . . . . 0.0 110.151 -179.577 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 91' ' ' ASP . . . . . 0.509 ' N ' ' OD1' ' A' ' 91' ' ' ASP . 0.0 OUTLIER -54.07 140.28 32.27 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 114.873 -1.058 . . . . 0.0 112.125 -178.39 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 16.6 tp -54.18 -41.87 69.04 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.043 -0.98 . . . . 0.0 110.01 -179.78 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -69.67 -40.2 76.55 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 179.252 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 94' ' ' SER . . . . . 0.534 ' CB ' HG23 ' A' ' 69' ' ' ILE . 4.0 m -64.48 -35.87 82.35 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.956 179.459 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 95' ' ' ILE . . . . . 0.452 ' CG1' HG23 ' A' ' 90' ' ' ILE . 30.4 mt -58.51 -37.41 64.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 115.888 -0.597 . . . . 0.0 109.786 179.487 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -70.74 -41.86 71.27 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.148 -179.121 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 64.3 m-70 . . . . . 0 C--N 1.327 -0.406 0 C-N-CA 119.41 -0.916 . . . . 0.0 109.365 179.941 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.626 ' N ' HD12 ' A' ' 14' ' ' ILE . 1.3 mp . . . . . 0 CA--C 1.519 -0.224 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -95.65 120.06 35.23 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.486 0.66 . . . . 0.0 112.134 -179.039 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 6.4 p90 -149.85 158.6 44.32 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 107.968 -1.123 . . . . 0.0 107.968 177.183 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -95.33 146.32 24.46 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 120.138 -0.625 . . . . 0.0 110.943 -178.809 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -178.92 176.37 0.92 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.863 179.427 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -96.62 133.82 40.63 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.831 -179.829 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.572 ' O ' ' O ' ' A' ' 31' ' ' VAL . 13.0 t -133.74 152.92 52.01 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 121.103 0.478 . . . . 0.0 110.255 178.617 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 91.0 mt-10 -132.32 151.8 51.68 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 179.497 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' ILE . . . . . 0.406 ' HA ' ' O ' ' A' ' 58' ' ' GLU . 79.5 mt -132.71 136.38 55.92 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.468 0 C-N-CA 120.066 -0.654 . . . . 0.0 111.427 -179.568 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.522 HD13 ' NE ' ' A' ' 60' ' ' ARG . 0.2 OUTLIER -123.45 123.35 40.46 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.33 -0.85 . . . . 0.0 111.054 -179.398 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.698 ' NE2' ' CE2' ' A' ' 57' ' ' PHE . 9.5 tt0 -129.58 102.05 6.2 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.428 -0.805 . . . . 0.0 109.614 178.472 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 80.3 -127.22 7.82 Favored Glycine 0 CA--C 1.523 0.561 0 N-CA-C 109.847 -1.301 . . . . 0.0 109.847 -178.781 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.434 ' OE1' ' O ' ' A' ' 26' ' ' GLU . 2.9 pp20? -100.04 12.2 37.48 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.969 0.414 . . . . 0.0 110.095 179.434 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.521 ' HB3' ' CZ2' ' A' ' 29' ' ' TRP . 27.5 mtt-85 -113.77 135.25 54.16 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.883 -0.599 . . . . 0.0 112.605 -178.401 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.435 ' HG3' ' N ' ' A' ' 29' ' ' TRP . 11.1 ttt-85 -129.01 150.48 50.4 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.169 179.132 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.521 ' CZ2' ' HB3' ' A' ' 27' ' ' ARG . 6.7 m-90 -147.94 156.18 42.39 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.518 -179.365 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 12.4 mt-10 -99.9 138.09 37.45 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 178.978 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.572 ' O ' ' O ' ' A' ' 20' ' ' SER . 11.0 m -147.77 157.37 9.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-O 121.255 0.55 . . . . 0.0 111.214 -179.255 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 1.009 ' H ' HD23 ' A' ' 32' ' ' LEU . 0.6 OUTLIER -98.01 130.61 44.83 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 108.428 -0.953 . . . . 0.0 108.428 178.499 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.6 tt -94.35 125.05 38.75 Favored 'General case' 0 C--N 1.324 -0.524 0 C-N-CA 120.385 -0.526 . . . . 0.0 109.786 -179.679 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 16.1 m-70 -90.7 -27.16 19.17 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.469 -0.787 . . . . 0.0 111.764 -178.341 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 -172.62 160.81 4.75 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 119.566 -0.854 . . . . 0.0 111.084 177.498 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' VAL . . . . . 0.54 HG22 ' H ' ' A' ' 37' ' ' SER . 4.8 p -145.33 169.34 7.45 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.004 -178.965 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 37' ' ' SER . . . . . 0.54 ' H ' HG22 ' A' ' 36' ' ' VAL . 24.9 t -141.64 167.84 21.19 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 107.883 -1.154 . . . . 0.0 107.883 178.262 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.634 HD23 ' H ' ' A' ' 38' ' ' LEU . 0.1 OUTLIER -64.77 -1.57 2.01 Favored 'General case' 0 C--N 1.321 -0.669 0 C-N-CA 119.95 -0.7 . . . . 0.0 110.562 -179.259 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 39' ' ' HIS . . . . . 0.553 ' NE2' ' O ' ' A' ' 87' ' ' CYS . 19.9 t60 -159.14 41.68 0.23 Allowed 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 120.786 -0.366 . . . . 0.0 111.397 -179.523 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 177.77 158.69 21.26 Favored Glycine 0 CA--C 1.527 0.798 0 N-CA-C 111.165 -0.774 . . . . 0.0 111.165 179.697 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.409 HG21 HG21 ' A' ' 73' ' ' ILE . 0.1 OUTLIER -148.56 148.95 15.53 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.321 0 CA-C-O 121.342 0.591 . . . . 0.0 111.584 -178.856 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.615 HD23 ' N ' ' A' ' 43' ' ' VAL . 1.6 tt -121.59 136.19 54.96 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 115.177 -0.92 . . . . 0.0 108.706 178.729 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.615 ' N ' HD23 ' A' ' 42' ' ' LEU . 24.0 m -141.33 174.84 6.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-O 121.294 0.568 . . . . 0.0 111.964 -179.295 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -98.19 144.81 17.47 Favored Glycine 0 CA--C 1.529 0.912 0 N-CA-C 109.215 -1.554 . . . . 0.0 109.215 178.049 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' GLN . . . . . 0.578 ' O ' ' CD ' ' A' ' 45' ' ' GLN . 3.8 pp0? -88.03 116.72 67.05 Favored Pre-proline 0 CA--C 1.535 0.37 0 CA-C-N 118.078 0.939 . . . . 0.0 111.723 -178.349 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -84.82 162.57 12.09 Favored 'Trans proline' 0 C--N 1.305 -1.73 0 C-N-CA 121.384 1.389 . . . . 0.0 110.91 178.595 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -64.52 -40.18 95.16 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.698 0.285 . . . . 0.0 111.539 -178.965 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' ASP . . . . . 0.521 ' O ' ' NE1' ' A' ' 29' ' ' TRP . 1.0 OUTLIER -70.45 8.64 0.77 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.821 -179.058 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 49' ' ' TRP . . . . . 0.461 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 60.7 t-105 -63.3 67.72 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 120.742 -0.383 . . . . 0.0 111.725 -179.39 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 50' ' ' ASN . . . . . 0.502 ' N ' ' O ' ' A' ' 48' ' ' ASP . 44.2 t-20 -93.08 78.84 4.58 Favored 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 120.332 -0.547 . . . . 0.0 109.932 178.857 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -141.21 160.16 26.76 Favored Glycine 0 CA--C 1.525 0.696 0 N-CA-C 111.462 -0.655 . . . . 0.0 111.462 -179.528 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' ASP . . . . . 0.436 ' OD1' ' OE1' ' A' ' 54' ' ' GLN . 25.7 t0 -95.46 110.73 52.39 Favored Pre-proline 0 CA--C 1.533 0.326 0 CA-C-N 115.79 -0.205 . . . . 0.0 110.739 -179.873 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 71.4 Cg_exo -46.66 -22.66 1.92 Allowed 'Trans proline' 0 N--CA 1.496 1.671 0 C-N-CA 122.626 2.217 . . . . 0.0 112.751 -179.811 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' GLN . . . . . 0.436 ' OE1' ' OD1' ' A' ' 52' ' ' ASP . 11.0 mp0 -80.29 -23.91 40.39 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 120.541 -0.464 . . . . 0.0 111.818 -178.968 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.539 ' O ' ' CE1' ' A' ' 57' ' ' PHE . 18.2 mtt-85 -92.72 151.03 40.63 Favored Pre-proline 0 C--N 1.331 -0.224 0 C-N-CA 120.354 -0.538 . . . . 0.0 109.736 179.563 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 56' ' ' PRO . . . . . 0.561 ' O ' ' NE2' ' A' ' 24' ' ' GLN . 35.7 Cg_endo -64.76 160.88 38.45 Favored 'Trans proline' 0 C--N 1.308 -1.594 0 C-N-CA 122.723 2.282 . . . . 0.0 113.187 -178.735 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.698 ' CE2' ' NE2' ' A' ' 24' ' ' GLN . 42.9 m-85 -130.34 154.4 47.7 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 114.889 -1.051 . . . . 0.0 108.897 179.178 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.406 ' O ' ' HA ' ' A' ' 22' ' ' ILE . 83.4 mt-10 -120.6 134.96 55.23 Favored 'General case' 0 N--CA 1.467 0.392 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 178.469 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 59' ' ' ALA . . . . . 0.486 ' HB2' ' CD1' ' A' ' 73' ' ' ILE . . . -117.0 137.28 52.33 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.212 0.529 . . . . 0.0 112.296 -178.187 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.522 ' NE ' HD13 ' A' ' 23' ' ' LEU . 0.9 OUTLIER -122.72 127.66 49.52 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.214 -0.903 . . . . 0.0 108.681 177.254 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 7.8 mt -110.66 139.01 46.32 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 120.73 -0.388 . . . . 0.0 110.419 -179.348 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' TYR . . . . . 0.5 ' N ' ' CD1' ' A' ' 62' ' ' TYR . 6.7 m-85 -120.27 111.24 17.54 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.935 -179.871 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.572 HD23 ' C ' ' A' ' 63' ' ' LEU . 5.8 tt -105.09 -83.51 0.51 Allowed 'General case' 0 N--CA 1.462 0.15 0 CA-C-N 115.849 -0.614 . . . . 0.0 109.492 179.14 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.453 ' H ' ' HB ' ' A' ' 67' ' ' VAL . . . -77.81 178.85 51.81 Favored Glycine 0 CA--C 1.523 0.542 0 N-CA-C 109.523 -1.431 . . . . 0.0 109.523 178.786 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.532 HD23 ' O ' ' A' ' 65' ' ' LEU . 0.9 OUTLIER -73.81 -33.23 64.09 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 119.898 -0.721 . . . . 0.0 110.119 -179.627 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 39.3 t0 -102.88 8.65 39.15 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.097 179.881 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' VAL . . . . . 0.566 ' O ' HG12 ' A' ' 67' ' ' VAL . 7.7 t -104.75 96.27 4.46 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.284 0 CA-C-O 121.308 0.575 . . . . 0.0 111.927 -178.812 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 6.0 tp -113.01 117.17 31.28 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 108.172 -1.048 . . . . 0.0 108.172 178.1 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.495 HG23 ' CB ' ' A' ' 94' ' ' SER . 3.3 mt -111.91 143.69 21.2 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-O 120.818 0.342 . . . . 0.0 110.498 -179.061 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.412 ' C ' ' HG2' ' A' ' 71' ' ' MET . 24.7 mtm-85 -128.35 130.46 47.79 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.878 179.257 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 71' ' ' MET . . . . . 0.807 ' SD ' HD12 ' A' ' 90' ' ' ILE . 0.9 OUTLIER -139.48 148.78 43.16 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.858 -0.61 . . . . 0.0 109.741 179.575 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 72.1 tt0 -102.28 129.48 48.71 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 107.798 -1.186 . . . . 0.0 107.798 178.448 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.486 ' CD1' ' HB2' ' A' ' 59' ' ' ALA . 13.8 pt -138.16 157.54 31.79 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 C-N-CA 119.637 -0.825 . . . . 0.0 113.138 -177.491 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 74' ' ' SER . . . . . 0.587 ' N ' ' OE1' ' A' ' 88' ' ' GLN . 95.6 p -121.44 151.23 40.45 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 114.74 -1.118 . . . . 0.0 109.61 178.521 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.48 ' CD1' ' CZ ' ' A' ' 85' ' ' PHE . 8.0 tp -66.53 123.05 18.98 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.105 0.479 . . . . 0.0 110.431 -179.449 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -98.1 -44.38 6.64 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.964 178.042 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 77' ' ' TRP . . . . . 0.709 ' NE1' ' HA3' ' A' ' 84' ' ' GLY . 69.3 p-90 -164.95 170.55 15.11 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.185 -179.454 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -151.34 124.43 8.72 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 121.155 -0.218 . . . . 0.0 110.732 179.117 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 79' ' ' ARG . . . . . 0.5 HH11 ' CG ' ' A' ' 79' ' ' ARG . 0.0 OUTLIER -151.95 131.68 13.19 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 112.933 0.716 . . . . 0.0 112.933 179.245 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 54.26 47.06 23.91 Favored 'General case' 0 N--CA 1.468 0.425 0 N-CA-C 113.791 1.034 . . . . 0.0 113.791 176.069 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 72.15 13.06 76.36 Favored Glycine 0 CA--C 1.522 0.503 0 C-N-CA 120.18 -1.01 . . . . 0.0 111.739 178.338 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 48.8 mt -116.91 138.06 51.79 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 178.818 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.488 HD11 ' CB ' ' A' ' 45' ' ' GLN . 29.7 mt -125.78 135.02 51.55 Favored 'General case' 0 CA--C 1.513 -0.456 0 C-N-CA 120.382 -0.527 . . . . 0.0 111.491 -178.98 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 84' ' ' GLY . . . . . 0.709 ' HA3' ' NE1' ' A' ' 77' ' ' TRP . . . -98.4 153.95 20.02 Favored Glycine 0 N--CA 1.447 -0.629 0 N-CA-C 109.334 -1.506 . . . . 0.0 109.334 178.381 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 85' ' ' PHE . . . . . 0.484 ' CG ' HD12 ' A' ' 73' ' ' ILE . 28.8 m-85 -145.39 131.94 19.82 Favored 'General case' 0 C--N 1.312 -1.045 0 C-N-CA 120.794 -0.362 . . . . 0.0 110.568 -179.274 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.501 ' O ' ' NE2' ' A' ' 88' ' ' GLN . 20.3 pt-20 -103.6 128.77 50.82 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 179.692 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 87' ' ' CYS . . . . . 0.553 ' O ' ' NE2' ' A' ' 39' ' ' HIS . 5.2 t -75.71 124.52 27.4 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 112.234 0.457 . . . . 0.0 112.234 -178.028 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 88' ' ' GLN . . . . . 0.695 HE21 ' CA ' ' A' ' 88' ' ' GLN . 0.0 OUTLIER -102.12 -30.42 11.16 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.088 179.124 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 89' ' ' HIS . . . . . 0.609 ' ND1' ' N ' ' A' ' 90' ' ' ILE . 0.0 OUTLIER -158.77 140.47 13.53 Favored 'General case' 0 C--O 1.225 -0.198 0 CA-C-O 120.989 0.424 . . . . 0.0 110.202 179.298 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.807 HD12 ' SD ' ' A' ' 71' ' ' MET . 6.2 tt -146.18 140.73 21.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.043 -179.384 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 91' ' ' ASP . . . . . 0.529 ' O ' ' OG ' ' A' ' 94' ' ' SER . 0.1 OUTLIER -53.94 142.27 25.14 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 115.308 -0.86 . . . . 0.0 111.993 -178.534 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 8.0 tp -54.37 -42.3 70.17 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.238 -0.892 . . . . 0.0 110.168 -179.831 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 3.6 p30 -69.03 -42.08 76.83 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.02 179.499 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 94' ' ' SER . . . . . 0.529 ' OG ' ' O ' ' A' ' 91' ' ' ASP . 2.0 p -60.26 -37.74 81.37 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.975 179.606 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 63.5 mt -58.77 -38.12 70.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.128 179.53 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -70.42 -40.44 73.84 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 120.292 -0.563 . . . . 0.0 110.988 -178.87 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 68.1 m-70 . . . . . 0 C--N 1.327 -0.384 0 C-N-CA 119.978 -0.689 . . . . 0.0 109.847 179.923 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.523 ' N ' HD12 ' A' ' 14' ' ' ILE . 1.7 mp . . . . . 0 CA--C 1.521 -0.17 0 N-CA-C 110.093 -0.336 . . . . 0.0 110.093 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -95.14 119.76 34.2 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.307 0.575 . . . . 0.0 111.039 -179.755 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -149.66 149.26 30.36 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.109 -0.95 . . . . 0.0 108.442 178.631 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -95.54 149.28 21.6 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 120.116 -0.634 . . . . 0.0 111.335 -178.19 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.515 ' O ' HD12 ' A' ' 32' ' ' LEU . . . 179.06 177.96 0.49 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.466 -0.788 . . . . 0.0 109.891 179.802 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -96.22 133.94 39.93 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.622 179.95 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.58 ' O ' ' O ' ' A' ' 31' ' ' VAL . 20.5 p -134.03 154.34 51.21 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.992 0.425 . . . . 0.0 110.209 178.688 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 16.3 mt-10 -136.24 146.6 46.92 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 108.798 -0.816 . . . . 0.0 108.798 179.409 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' ILE . . . . . 0.439 ' HA ' ' O ' ' A' ' 58' ' ' GLU . 39.8 mt -125.75 136.24 61.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 C-N-CA 120.037 -0.665 . . . . 0.0 111.329 -178.982 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.476 ' H ' HD12 ' A' ' 23' ' ' LEU . 0.1 OUTLIER -120.67 123.75 43.52 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.329 -0.85 . . . . 0.0 110.846 -179.497 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.628 ' O ' ' NE2' ' A' ' 24' ' ' GLN . 0.0 OUTLIER -131.49 102.2 5.84 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.513 -0.767 . . . . 0.0 109.606 178.811 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 78.97 -128.15 8.42 Favored Glycine 0 CA--C 1.525 0.664 0 N-CA-C 109.912 -1.275 . . . . 0.0 109.912 -178.711 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -99.14 12.32 36.47 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.865 0.364 . . . . 0.0 110.144 179.417 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.562 ' HB3' ' CZ2' ' A' ' 29' ' ' TRP . 18.6 mtt180 -113.41 135.43 53.87 Favored 'General case' 0 C--N 1.332 -0.177 0 N-CA-C 112.439 0.533 . . . . 0.0 112.439 -178.514 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.432 ' HG2' ' N ' ' A' ' 29' ' ' TRP . 7.0 ttt85 -128.86 148.25 50.88 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.184 179.282 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.562 ' CZ2' ' HB3' ' A' ' 27' ' ' ARG . 6.9 m-90 -146.65 155.82 42.73 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.628 -179.087 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 21.5 mt-10 -100.06 137.28 38.72 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 179.124 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.58 ' O ' ' O ' ' A' ' 20' ' ' SER . 17.3 m -146.88 157.69 10.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 121.31 0.576 . . . . 0.0 111.437 -179.361 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.515 HD12 ' O ' ' A' ' 18' ' ' ALA . 10.7 tp -96.55 128.88 43.89 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 178.576 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.445 ' N ' HD12 ' A' ' 32' ' ' LEU . 2.0 tt -93.37 124.99 37.74 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.232 0.539 . . . . 0.0 109.758 179.789 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 66.3 m-70 -91.24 -24.67 19.81 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.535 -0.757 . . . . 0.0 111.776 -178.434 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -174.59 163.61 3.58 Favored 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 119.579 -0.849 . . . . 0.0 111.635 177.516 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' VAL . . . . . 0.523 HG22 ' H ' ' A' ' 37' ' ' SER . 5.0 p -147.17 168.8 4.78 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.123 0 CA-C-N 115.434 -0.803 . . . . 0.0 111.275 -178.903 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 37' ' ' SER . . . . . 0.523 ' H ' HG22 ' A' ' 36' ' ' VAL . 5.8 t -142.34 170.45 15.68 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 107.867 -1.16 . . . . 0.0 107.867 178.473 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.638 HD23 ' H ' ' A' ' 38' ' ' LEU . 0.1 OUTLIER -67.44 -2.58 6.56 Favored 'General case' 0 C--N 1.323 -0.566 0 C-N-CA 119.617 -0.833 . . . . 0.0 110.333 -179.687 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 39' ' ' HIS . . . . . 0.55 ' CD2' ' O ' ' A' ' 87' ' ' CYS . 1.6 t60 -156.67 37.97 0.32 Allowed 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 120.634 -0.426 . . . . 0.0 111.578 -179.627 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -178.73 158.4 22.74 Favored Glycine 0 CA--C 1.529 0.941 0 C-N-CA 120.505 -0.855 . . . . 0.0 111.526 179.795 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -149.82 150.17 13.97 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.362 0 CA-C-O 121.353 0.597 . . . . 0.0 111.565 -179.006 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.617 HD23 ' N ' ' A' ' 43' ' ' VAL . 1.5 tt -122.24 141.28 51.65 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 115.06 -0.973 . . . . 0.0 108.783 178.815 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.617 ' N ' HD23 ' A' ' 42' ' ' LEU . 15.9 m -145.34 175.03 2.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-O 121.202 0.525 . . . . 0.0 111.88 -179.242 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -99.56 144.85 17.25 Favored Glycine 0 CA--C 1.53 1.004 0 N-CA-C 109.68 -1.368 . . . . 0.0 109.68 178.423 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' GLN . . . . . 0.409 ' O ' ' OE1' ' A' ' 45' ' ' GLN . 2.5 tm0? -86.77 116.79 67.26 Favored Pre-proline 0 N--CA 1.465 0.307 0 CA-C-N 117.85 0.825 . . . . 0.0 111.939 -178.505 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 76.3 Cg_endo -87.1 151.65 8.22 Favored 'Trans proline' 0 C--N 1.309 -1.526 0 C-N-CA 121.567 1.511 . . . . 0.0 111.32 178.527 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -56.44 -13.74 2.5 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 112.658 0.614 . . . . 0.0 112.658 -178.76 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' ASP . . . . . 0.53 ' O ' ' N ' ' A' ' 50' ' ' ASN . 81.9 m-20 -97.52 8.81 43.94 Favored 'General case' 0 N--CA 1.467 0.398 0 N-CA-C 112.324 0.49 . . . . 0.0 112.324 -178.432 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 49' ' ' TRP . . . . . 0.444 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 58.4 t-105 -60.55 67.67 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 112.119 0.415 . . . . 0.0 112.119 -179.358 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 50' ' ' ASN . . . . . 0.53 ' N ' ' O ' ' A' ' 48' ' ' ASP . 0.3 OUTLIER -93.53 78.64 4.35 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 178.042 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -142.81 162.99 27.38 Favored Glycine 0 CA--C 1.524 0.609 0 N-CA-C 111.538 -0.625 . . . . 0.0 111.538 -179.146 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' ASP . . . . . 0.516 ' OD2' ' NH1' ' A' ' 55' ' ' ARG . 15.8 t0 -95.95 122.05 59.38 Favored Pre-proline 0 CA--C 1.534 0.328 0 CA-C-N 115.608 -0.296 . . . . 0.0 110.423 180.0 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -60.82 -21.71 71.28 Favored 'Trans proline' 0 N--CA 1.495 1.611 0 C-N-CA 122.472 2.115 . . . . 0.0 112.183 -179.315 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 82.4 mt-30 -78.67 -24.06 45.34 Favored 'General case' 0 C--N 1.326 -0.448 0 C-N-CA 120.435 -0.506 . . . . 0.0 111.619 -179.19 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.542 ' O ' ' CE1' ' A' ' 57' ' ' PHE . 1.2 mpp_? -93.35 153.18 41.51 Favored Pre-proline 0 N--CA 1.464 0.239 0 C-N-CA 120.595 -0.442 . . . . 0.0 110.004 179.698 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_endo -65.4 160.73 41.21 Favored 'Trans proline' 0 C--N 1.308 -1.585 0 C-N-CA 122.737 2.291 . . . . 0.0 113.273 -178.899 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.542 ' CE1' ' O ' ' A' ' 55' ' ' ARG . 48.3 m-85 -130.87 155.24 47.07 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 114.891 -1.05 . . . . 0.0 109.117 179.633 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.439 ' O ' ' HA ' ' A' ' 22' ' ' ILE . 13.2 mm-40 -123.04 138.36 54.7 Favored 'General case' 0 N--CA 1.469 0.521 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 178.753 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 59' ' ' ALA . . . . . 0.449 ' HB2' HD13 ' A' ' 73' ' ' ILE . . . -119.63 137.4 53.9 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.231 0.539 . . . . 0.0 112.133 -178.296 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.891 ' HE ' ' HE ' ' A' ' 70' ' ' ARG . 40.0 mtt85 -124.17 128.2 48.88 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.27 -0.877 . . . . 0.0 108.788 177.729 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.405 HD23 ' N ' ' A' ' 61' ' ' LEU . 0.0 OUTLIER -113.33 146.46 39.4 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.021 0.439 . . . . 0.0 110.634 -179.25 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 62' ' ' TYR . . . . . 0.449 ' CD1' ' N ' ' A' ' 62' ' ' TYR . 24.0 m-85 -124.03 108.85 12.82 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.173 179.56 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.471 HD23 ' C ' ' A' ' 63' ' ' LEU . 1.8 tt -103.13 -86.5 0.44 Allowed 'General case' 0 C--N 1.333 -0.138 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 179.551 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.447 ' H ' ' HB ' ' A' ' 67' ' ' VAL . . . -74.3 174.06 50.36 Favored Glycine 0 CA--C 1.522 0.524 0 N-CA-C 109.147 -1.581 . . . . 0.0 109.147 178.367 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.569 HD12 ' N ' ' A' ' 65' ' ' LEU . 7.9 mp -71.31 -33.16 69.42 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 119.94 -0.704 . . . . 0.0 110.018 -179.788 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -102.52 9.55 39.44 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.902 179.912 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' VAL . . . . . 0.469 ' O ' HG12 ' A' ' 67' ' ' VAL . 24.2 t -107.59 98.81 7.45 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.324 0 CA-C-O 121.204 0.526 . . . . 0.0 112.02 -178.742 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.501 HD12 ' N ' ' A' ' 69' ' ' ILE . 4.4 tp -113.86 117.77 32.35 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.268 -0.878 . . . . 0.0 108.709 178.55 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.501 ' N ' HD12 ' A' ' 68' ' ' LEU . 3.1 mt -112.15 144.28 20.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.935 0.398 . . . . 0.0 111.208 -179.04 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.891 ' HE ' ' HE ' ' A' ' 60' ' ' ARG . 1.0 OUTLIER -128.34 131.3 48.6 Favored 'General case' 0 C--O 1.237 0.421 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.677 179.277 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 2.7 mtp -140.07 149.24 42.88 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.055 179.633 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' GLU . . . . . 0.413 ' OE1' ' OE2' ' A' ' 58' ' ' GLU . 23.9 tt0 -105.01 132.4 51.29 Favored 'General case' 0 CA--C 1.516 -0.33 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 177.995 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.613 HD12 ' CB ' ' A' ' 85' ' ' PHE . 1.5 pt -141.88 158.48 20.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 C-N-CA 119.521 -0.872 . . . . 0.0 113.266 -177.465 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -118.91 149.16 42.05 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 114.966 -1.015 . . . . 0.0 109.205 178.35 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.518 HD12 ' CE1' ' A' ' 85' ' ' PHE . 16.2 tp -65.76 123.11 18.89 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.236 0.541 . . . . 0.0 110.199 -179.022 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -98.26 -44.62 6.5 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 115.261 -0.882 . . . . 0.0 111.257 178.423 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 77' ' ' TRP . . . . . 0.613 ' NE1' ' HA3' ' A' ' 84' ' ' GLY . 68.8 p-90 -166.05 169.58 14.43 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.412 -179.152 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -148.68 123.66 10.03 Favored 'General case' 0 N--CA 1.465 0.28 0 N-CA-C 109.446 -0.575 . . . . 0.0 109.446 178.222 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 37.6 ttt180 -152.37 133.54 14.3 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 119.762 -0.775 . . . . 0.0 112.809 -179.975 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 36.2 t0 57.24 47.15 17.47 Favored 'General case' 0 N--CA 1.465 0.276 0 N-CA-C 114.055 1.132 . . . . 0.0 114.055 176.845 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 82.9 -26.71 4.13 Favored Glycine 0 CA--C 1.521 0.452 0 C-N-CA 120.388 -0.911 . . . . 0.0 113.048 177.271 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 5.2 mt -89.66 161.6 16.03 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 117.689 0.744 . . . . 0.0 110.842 -179.057 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 40.5 mt -134.78 135.98 42.23 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.198 -179.25 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 84' ' ' GLY . . . . . 0.613 ' HA3' ' NE1' ' A' ' 77' ' ' TRP . . . -102.33 153.91 18.51 Favored Glycine 0 N--CA 1.453 -0.203 0 N-CA-C 109.741 -1.343 . . . . 0.0 109.741 178.529 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 85' ' ' PHE . . . . . 0.613 ' CB ' HD12 ' A' ' 73' ' ' ILE . 54.6 m-85 -145.64 139.63 26.75 Favored 'General case' 0 C--N 1.318 -0.777 0 C-N-CA 120.828 -0.349 . . . . 0.0 110.71 -179.725 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 20.4 pt-20 -103.86 130.08 51.4 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.084 -0.71 . . . . 0.0 109.084 179.764 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 87' ' ' CYS . . . . . 0.55 ' O ' ' CD2' ' A' ' 39' ' ' HIS . 5.2 t -77.33 124.36 27.75 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.006 0.431 . . . . 0.0 111.581 -178.556 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -101.2 -29.67 11.97 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.206 179.685 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 89' ' ' HIS . . . . . 0.532 ' C ' ' ND1' ' A' ' 89' ' ' HIS . 0.0 OUTLIER -161.71 141.72 10.36 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.063 0.459 . . . . 0.0 110.273 179.471 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.451 HG23 ' CG1' ' A' ' 95' ' ' ILE . 6.6 tt -145.57 141.1 22.25 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-N 115.755 -0.657 . . . . 0.0 109.971 -179.547 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 91' ' ' ASP . . . . . 0.516 ' CG ' ' H ' ' A' ' 94' ' ' SER . 0.1 OUTLIER -53.69 141.05 27.5 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 115.164 -0.925 . . . . 0.0 111.747 -178.444 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.445 ' N ' ' OD1' ' A' ' 91' ' ' ASP . 3.1 tp -54.27 -42.53 70.1 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.122 -0.945 . . . . 0.0 110.593 -179.558 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 11.5 t0 -70.15 -36.83 75.01 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 179.476 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 94' ' ' SER . . . . . 0.516 ' H ' ' CG ' ' A' ' 91' ' ' ASP . 3.6 m -64.53 -37.85 88.98 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.661 -0.699 . . . . 0.0 109.784 179.162 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 95' ' ' ILE . . . . . 0.451 ' CG1' HG23 ' A' ' 90' ' ' ILE . 50.1 mt -58.74 -37.82 68.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.056 179.529 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -70.56 -41.06 72.93 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.717 -179.167 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 64.1 m-70 . . . . . 0 C--N 1.325 -0.469 0 C-N-CA 119.932 -0.707 . . . . 0.0 109.764 179.786 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 7.2 mm . . . . . 0 N--CA 1.456 -0.164 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -95.08 120.89 36.06 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.475 0.655 . . . . 0.0 111.992 -178.926 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 23.2 p90 -149.3 158.09 43.88 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 114.873 -1.058 . . . . 0.0 108.448 177.567 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -95.55 146.38 24.5 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 120.291 -0.564 . . . . 0.0 110.314 -179.591 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . 179.94 176.77 0.69 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.075 179.788 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -96.28 133.94 40.02 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.104 -179.686 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.47 ' O ' ' O ' ' A' ' 31' ' ' VAL . 11.4 p -132.94 150.32 52.17 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.081 -0.509 . . . . 0.0 109.941 178.338 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.559 ' OE1' ' NH2' ' A' ' 28' ' ' ARG . 8.3 mm-40 -132.51 138.2 47.45 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 179.59 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 43.0 mt -119.32 136.12 57.52 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 121.353 0.597 . . . . 0.0 110.987 -179.091 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.595 ' H ' HD12 ' A' ' 23' ' ' LEU . 0.1 OUTLIER -123.73 123.2 39.98 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.33 -0.85 . . . . 0.0 111.107 -179.135 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.582 HE21 ' C ' ' A' ' 24' ' ' GLN . 0.0 OUTLIER -128.65 101.57 6.2 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.328 -0.851 . . . . 0.0 109.687 178.918 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 80.99 -125.68 6.99 Favored Glycine 0 CA--C 1.525 0.662 0 N-CA-C 110.103 -1.199 . . . . 0.0 110.103 -178.664 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -101.17 11.63 39.07 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.86 0.362 . . . . 0.0 110.06 179.404 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.529 ' HB3' ' CZ2' ' A' ' 29' ' ' TRP . 36.1 mtt85 -113.5 134.65 54.56 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 112.652 0.612 . . . . 0.0 112.652 -178.146 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.559 ' NH2' ' OE1' ' A' ' 21' ' ' GLU . 70.0 ttt-85 -128.38 149.33 50.58 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.443 179.325 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.534 ' NE1' ' O ' ' A' ' 48' ' ' ASP . 7.8 m-90 -146.5 156.25 43.13 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.386 -0.825 . . . . 0.0 110.496 -179.382 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.531 ' H ' ' CD ' ' A' ' 30' ' ' GLU . 3.7 mp0 -100.77 138.85 37.27 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.975 -0.557 . . . . 0.0 109.621 179.35 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.47 ' O ' ' O ' ' A' ' 20' ' ' SER . 9.1 m -147.28 156.33 10.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-O 121.287 0.565 . . . . 0.0 110.962 -179.434 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 11.4 tp -97.04 129.92 44.42 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 108.123 -1.065 . . . . 0.0 108.123 178.631 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -92.08 124.09 35.92 Favored 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 120.29 -0.564 . . . . 0.0 110.072 -179.827 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 77.0 m-70 -90.67 -30.1 17.33 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.339 -0.846 . . . . 0.0 111.474 -178.803 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 0.401 ' OD1' ' C ' ' A' ' 35' ' ' ASP . 2.1 p30 -170.05 160.57 8.24 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 119.538 -0.865 . . . . 0.0 110.868 177.26 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 36' ' ' VAL . . . . . 0.537 HG22 ' H ' ' A' ' 37' ' ' SER . 3.4 p -144.75 169.17 8.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.055 -178.825 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 37' ' ' SER . . . . . 0.537 ' H ' HG22 ' A' ' 36' ' ' VAL . 13.1 t -140.89 168.34 20.03 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 108.497 -0.927 . . . . 0.0 108.497 179.083 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.426 ' N ' HD12 ' A' ' 38' ' ' LEU . 0.3 OUTLIER -66.99 -2.02 4.82 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 119.92 -0.712 . . . . 0.0 110.687 -179.572 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 39' ' ' HIS . . . . . 0.421 ' N ' HD12 ' A' ' 38' ' ' LEU . 0.1 OUTLIER -158.71 35.91 0.22 Allowed 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 120.695 -0.402 . . . . 0.0 111.185 179.889 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -174.48 157.38 24.87 Favored Glycine 0 CA--C 1.526 0.78 0 N-CA-C 110.947 -0.861 . . . . 0.0 110.947 179.681 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -146.39 148.18 17.29 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.267 0 CA-C-O 121.484 0.659 . . . . 0.0 111.661 -179.239 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.409 HD23 ' N ' ' A' ' 43' ' ' VAL . 0.8 OUTLIER -122.15 134.79 54.74 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 114.936 -1.029 . . . . 0.0 108.896 178.776 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.409 ' N ' HD23 ' A' ' 42' ' ' LEU . 22.0 m -139.37 174.95 8.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-O 121.227 0.537 . . . . 0.0 111.837 -179.311 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -96.77 143.33 16.67 Favored Glycine 0 CA--C 1.528 0.881 0 N-CA-C 109.331 -1.508 . . . . 0.0 109.331 178.071 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' GLN . . . . . 0.44 ' O ' ' OE1' ' A' ' 45' ' ' GLN . 2.1 tm0? -85.52 115.93 63.51 Favored Pre-proline 0 N--CA 1.465 0.275 0 CA-C-N 118.041 0.921 . . . . 0.0 111.678 -178.715 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 97.8 Cg_endo -86.27 161.5 9.86 Favored 'Trans proline' 0 C--N 1.308 -1.572 0 C-N-CA 121.543 1.495 . . . . 0.0 111.241 178.732 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 76.2 mt-30 -65.41 -40.21 93.1 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 112.591 0.589 . . . . 0.0 112.591 -178.789 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' ASP . . . . . 0.534 ' O ' ' NE1' ' A' ' 29' ' ' TRP . 1.8 m-20 -71.64 8.4 1.14 Allowed 'General case' 0 N--CA 1.465 0.286 0 N-CA-C 112.013 0.375 . . . . 0.0 112.013 -178.709 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 49' ' ' TRP . . . . . 0.455 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 61.7 t-105 -60.56 67.84 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 111.832 0.308 . . . . 0.0 111.832 -179.426 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 50' ' ' ASN . . . . . 0.547 HD22 ' C ' ' A' ' 50' ' ' ASN . 0.3 OUTLIER -93.46 78.89 4.37 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 120.155 -0.618 . . . . 0.0 109.816 178.698 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -141.24 160.3 26.79 Favored Glycine 0 CA--C 1.525 0.706 0 N-CA-C 111.223 -0.751 . . . . 0.0 111.223 -179.656 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 59.2 t0 -97.32 108.03 42.12 Favored Pre-proline 0 CA--C 1.531 0.242 0 N-CA-C 110.627 -0.138 . . . . 0.0 110.627 -179.842 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -47.52 -22.54 2.87 Favored 'Trans proline' 0 C--N 1.311 -1.439 0 C-N-CA 122.167 1.911 . . . . 0.0 112.341 179.973 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 25.1 mt-30 -74.85 -23.99 58.51 Favored 'General case' 0 C--N 1.324 -0.512 0 C-N-CA 120.51 -0.476 . . . . 0.0 111.233 -179.237 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.546 ' O ' ' CE1' ' A' ' 57' ' ' PHE . 0.0 OUTLIER -96.77 150.09 36.53 Favored Pre-proline 0 C--N 1.331 -0.237 0 N-CA-C 109.863 -0.421 . . . . 0.0 109.863 -179.948 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 25.5 Cg_endo -61.62 160.78 26.92 Favored 'Trans proline' 0 N--CA 1.495 1.615 0 C-N-CA 122.824 2.349 . . . . 0.0 113.298 -178.487 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.546 ' CE1' ' O ' ' A' ' 55' ' ' ARG . 52.5 m-85 -130.98 154.69 47.89 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.012 -0.994 . . . . 0.0 109.313 179.58 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -122.16 136.39 54.9 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 109.036 -0.728 . . . . 0.0 109.036 178.372 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' ALA . . . . . 0.627 ' HB2' HD13 ' A' ' 73' ' ' ILE . . . -118.1 138.27 52.38 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.225 0.536 . . . . 0.0 112.19 -178.099 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.477 ' HG3' HD11 ' A' ' 23' ' ' LEU . 20.0 mtm-85 -124.09 127.67 48.16 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 177.813 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 12.8 mt -109.76 151.02 27.48 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.002 0.43 . . . . 0.0 111.215 -178.741 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 38.2 m-85 -132.29 108.84 9.48 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.428 179.593 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.442 HD23 ' C ' ' A' ' 63' ' ' LEU . 1.1 tt -102.84 -84.59 0.46 Allowed 'General case' 0 C--N 1.332 -0.155 0 N-CA-C 108.941 -0.763 . . . . 0.0 108.941 179.089 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.451 ' H ' ' HB ' ' A' ' 67' ' ' VAL . . . -76.65 179.35 49.27 Favored Glycine 0 CA--C 1.523 0.548 0 N-CA-C 108.819 -1.712 . . . . 0.0 108.819 178.202 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.623 HD12 ' N ' ' A' ' 65' ' ' LEU . 7.5 mp -74.07 -32.3 63.22 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 119.708 -0.797 . . . . 0.0 110.251 -179.589 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 66' ' ' ASP . . . . . 0.401 ' O ' ' OD1' ' A' ' 66' ' ' ASP . 51.9 t0 -102.35 9.4 39.85 Favored 'General case' 0 C--N 1.332 -0.154 0 C-N-CA 122.735 0.414 . . . . 0.0 111.166 -179.865 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 67' ' ' VAL . . . . . 0.572 ' O ' HG12 ' A' ' 67' ' ' VAL . 8.6 t -104.36 94.36 3.12 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.238 0 CA-C-O 121.487 0.66 . . . . 0.0 111.533 -179.172 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 6.6 tp -109.74 117.44 33.9 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 114.863 -1.062 . . . . 0.0 108.214 178.542 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.49 HG23 ' CB ' ' A' ' 94' ' ' SER . 7.6 mt -115.79 143.79 24.92 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.373 0 CA-C-O 121.047 0.451 . . . . 0.0 111.228 -178.632 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.444 ' C ' ' HG2' ' A' ' 71' ' ' MET . 0.0 OUTLIER -128.2 130.84 48.63 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.056 179.197 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 71' ' ' MET . . . . . 0.776 ' SD ' HD12 ' A' ' 90' ' ' ILE . 0.0 OUTLIER -139.91 148.04 41.44 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.625 -0.716 . . . . 0.0 109.611 179.511 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -100.43 132.78 45.62 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 107.081 -1.452 . . . . 0.0 107.081 177.731 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.627 HD13 ' HB2' ' A' ' 59' ' ' ALA . 7.7 pt -141.69 157.44 21.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 C-N-CA 119.407 -0.917 . . . . 0.0 113.458 -176.813 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -122.78 155.97 35.45 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 114.925 -1.034 . . . . 0.0 109.877 178.736 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.512 HD13 ' N ' ' A' ' 76' ' ' ALA . 0.2 OUTLIER -65.1 119.42 10.78 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.521 -0.308 . . . . 0.0 110.632 -179.533 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 76' ' ' ALA . . . . . 0.512 ' N ' HD13 ' A' ' 75' ' ' LEU . . . -97.1 -40.27 8.91 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 177.344 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 77' ' ' TRP . . . . . 0.623 ' NE1' ' HA3' ' A' ' 84' ' ' GLY . 69.2 p-90 -171.68 169.78 5.85 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.143 179.674 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -150.53 123.52 8.75 Favored 'General case' 0 N--CA 1.463 0.184 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 178.239 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 24.4 ttt85 -152.44 133.79 14.42 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 119.934 -0.706 . . . . 0.0 112.75 -179.948 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 80' ' ' ASP . . . . . 0.424 ' O ' ' OD1' ' A' ' 80' ' ' ASP . 25.7 t0 57.07 47.46 17.36 Favored 'General case' 0 N--CA 1.463 0.196 0 N-CA-C 113.764 1.024 . . . . 0.0 113.764 176.747 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 83.17 -27.95 3.86 Favored Glycine 0 CA--C 1.522 0.53 0 C-N-CA 120.241 -0.981 . . . . 0.0 113.284 177.073 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 4.3 mt -89.61 159.24 17.26 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 117.83 0.815 . . . . 0.0 110.436 -178.88 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 39.8 mt -131.48 135.98 47.54 Favored 'General case' 0 CA--C 1.518 -0.288 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.541 -178.811 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 84' ' ' GLY . . . . . 0.623 ' HA3' ' NE1' ' A' ' 77' ' ' TRP . . . -100.11 153.08 19.38 Favored Glycine 0 N--CA 1.453 -0.233 0 N-CA-C 109.748 -1.341 . . . . 0.0 109.748 178.471 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 85' ' ' PHE . . . . . 0.451 ' CE1' HD22 ' A' ' 75' ' ' LEU . 33.6 m-85 -145.7 135.72 23.67 Favored 'General case' 0 C--N 1.318 -0.768 0 C-N-CA 120.734 -0.386 . . . . 0.0 110.612 -179.575 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.408 ' H ' ' HG2' ' A' ' 86' ' ' GLU . 10.3 pt-20 -104.18 127.31 51.77 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.06 -0.719 . . . . 0.0 109.06 179.363 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -74.27 125.35 28.24 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.173 0.511 . . . . 0.0 111.542 -178.638 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -102.5 -29.82 11.36 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.032 179.817 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 89' ' ' HIS . . . . . 0.636 ' ND1' ' N ' ' A' ' 90' ' ' ILE . 0.0 OUTLIER -158.38 140.23 13.81 Favored 'General case' 0 C--O 1.226 -0.163 0 N-CA-C 109.891 -0.411 . . . . 0.0 109.891 178.735 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.776 HD12 ' SD ' ' A' ' 71' ' ' MET . 7.0 tt -146.15 141.08 21.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-O 121.352 0.596 . . . . 0.0 109.988 -179.444 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 91' ' ' ASP . . . . . 0.494 ' CB ' ' OG ' ' A' ' 94' ' ' SER . 0.1 OUTLIER -53.75 142.03 24.84 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.287 -0.87 . . . . 0.0 112.05 -178.381 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 6.0 tp -54.43 -42.36 70.45 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.178 -0.919 . . . . 0.0 109.968 -179.993 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 93' ' ' ASP . . . . . 0.425 ' OD2' ' OD2' ' A' ' 91' ' ' ASP . 3.5 p30 -68.36 -42.49 79.13 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.145 -0.48 . . . . 0.0 109.97 179.636 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 94' ' ' SER . . . . . 0.494 ' OG ' ' CB ' ' A' ' 91' ' ' ASP . 1.9 p -62.31 -36.24 81.55 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.037 -0.529 . . . . 0.0 109.998 179.373 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 95' ' ' ILE . . . . . 0.487 ' CG1' HG23 ' A' ' 90' ' ' ILE . 36.7 mt -58.86 -37.97 70.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.157 179.664 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -70.24 -39.71 74.89 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.257 -0.577 . . . . 0.0 110.914 -178.758 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 60.4 m-70 . . . . . 0 C--N 1.326 -0.431 0 C-N-CA 119.515 -0.874 . . . . 0.0 109.108 179.753 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.66 ' N ' HD12 ' A' ' 14' ' ' ILE . 1.7 mp . . . . . 0 CA--C 1.518 -0.264 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -94.42 120.41 34.61 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.403 0.621 . . . . 0.0 111.676 -178.963 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 1.6 p90 -149.67 158.09 43.85 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 114.768 -1.105 . . . . 0.0 108.212 177.85 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 31.4 m-20 -95.37 146.42 24.4 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 120.14 -0.624 . . . . 0.0 110.432 -179.22 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -179.27 176.83 0.82 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.967 -0.56 . . . . 0.0 109.742 179.652 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -96.66 134.43 39.91 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.195 -179.666 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.595 ' O ' ' O ' ' A' ' 31' ' ' VAL . 16.9 p -133.43 153.98 51.16 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.01 0.434 . . . . 0.0 109.875 178.445 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.4 mt-10 -134.61 140.43 46.06 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 179.658 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 2.7 mm -118.93 135.66 58.63 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-O 121.489 0.661 . . . . 0.0 110.404 -179.639 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -127.23 123.06 35.68 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.04 -0.982 . . . . 0.0 110.482 -179.254 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.789 HE21 ' C ' ' A' ' 24' ' ' GLN . 0.0 OUTLIER -128.39 102.22 6.56 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.444 -0.798 . . . . 0.0 109.485 178.935 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 80.23 -124.22 6.39 Favored Glycine 0 CA--C 1.524 0.629 0 N-CA-C 110.204 -1.158 . . . . 0.0 110.204 -178.797 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -102.38 11.62 37.76 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.78 0.324 . . . . 0.0 110.288 179.915 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.591 ' HB3' ' CZ2' ' A' ' 29' ' ' TRP . 46.5 mtt180 -114.34 136.53 52.87 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 112.844 0.683 . . . . 0.0 112.844 -177.962 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.414 ' HG2' ' N ' ' A' ' 29' ' ' TRP . 27.7 ttt180 -129.05 149.55 50.82 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.104 0.478 . . . . 0.0 110.272 179.344 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.591 ' CZ2' ' HB3' ' A' ' 27' ' ' ARG . 5.6 m-90 -150.26 125.66 10.15 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.682 -178.859 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -75.06 143.29 43.53 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 119.853 -0.739 . . . . 0.0 109.692 -179.0 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.595 ' O ' ' O ' ' A' ' 20' ' ' SER . 6.1 m -148.4 158.94 7.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-O 121.262 0.553 . . . . 0.0 111.176 -179.019 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 1.11 ' H ' HD23 ' A' ' 32' ' ' LEU . 1.5 pt? -99.05 130.35 45.37 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 108.816 -0.809 . . . . 0.0 108.816 178.729 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -94.24 124.94 38.58 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.311 0.577 . . . . 0.0 109.544 -179.939 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 71.1 m-70 -89.49 -26.18 21.05 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.379 -0.828 . . . . 0.0 111.882 -178.241 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -174.03 162.98 3.92 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 119.739 -0.784 . . . . 0.0 111.326 177.842 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' VAL . . . . . 0.51 HG22 ' H ' ' A' ' 37' ' ' SER . 4.8 p -146.71 168.81 5.49 Favored 'Isoleucine or valine' 0 C--O 1.231 0.104 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.041 -179.097 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 37' ' ' SER . . . . . 0.51 ' H ' HG22 ' A' ' 36' ' ' VAL . 67.5 p -142.28 168.08 20.58 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 107.321 -1.363 . . . . 0.0 107.321 177.851 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -62.41 -0.81 0.63 Allowed 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 119.33 -0.948 . . . . 0.0 110.697 -179.239 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 39' ' ' HIS . . . . . 0.434 ' H ' ' C ' ' A' ' 37' ' ' SER . 0.0 OUTLIER -164.92 45.62 0.09 Allowed 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 120.628 -0.429 . . . . 0.0 111.425 179.978 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -179.17 150.98 9.81 Favored Glycine 0 CA--C 1.529 0.919 0 N-CA-C 110.812 -0.915 . . . . 0.0 110.812 179.75 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -146.36 148.14 17.35 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.267 0 CA-C-O 121.445 0.64 . . . . 0.0 111.903 -179.175 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -122.52 126.62 48.19 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 114.921 -1.036 . . . . 0.0 108.963 179.059 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 30.5 m -131.3 174.96 12.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 121.392 0.615 . . . . 0.0 111.742 -179.379 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -98.28 145.61 17.83 Favored Glycine 0 CA--C 1.528 0.883 0 N-CA-C 109.638 -1.385 . . . . 0.0 109.638 178.393 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 6.9 tt0 -87.41 113.98 56.58 Favored Pre-proline 0 N--CA 1.466 0.346 0 CA-C-N 117.886 0.843 . . . . 0.0 111.992 -178.486 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -84.58 161.37 12.57 Favored 'Trans proline' 0 C--N 1.308 -1.575 0 C-N-CA 121.663 1.575 . . . . 0.0 111.359 178.474 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 32.2 tt0 -65.43 -40.06 92.87 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 112.279 0.474 . . . . 0.0 112.279 -178.894 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' ASP . . . . . 0.524 ' O ' ' N ' ' A' ' 50' ' ' ASN . 57.7 t0 -73.18 8.39 1.68 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.528 -0.306 . . . . 0.0 111.62 -178.755 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 49' ' ' TRP . . . . . 0.465 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 62.6 t-105 -60.93 68.2 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.564 -0.289 . . . . 0.0 111.567 -179.667 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 50' ' ' ASN . . . . . 0.524 ' N ' ' O ' ' A' ' 48' ' ' ASP . 14.5 t30 -93.69 78.69 4.26 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 178.468 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -138.58 161.43 25.75 Favored Glycine 0 CA--C 1.524 0.602 0 C-N-CA 120.875 -0.679 . . . . 0.0 111.721 -179.429 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -96.14 120.39 62.81 Favored Pre-proline 0 CA--C 1.535 0.385 0 N-CA-C 109.836 -0.431 . . . . 0.0 109.836 179.774 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_endo -63.86 -22.29 68.99 Favored 'Trans proline' 0 N--CA 1.492 1.44 0 C-N-CA 122.172 1.914 . . . . 0.0 112.48 -179.368 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 42.5 mm-40 -75.95 -23.84 55.43 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 120.353 -0.539 . . . . 0.0 111.12 -179.492 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.518 ' O ' ' CE1' ' A' ' 57' ' ' PHE . 80.6 mtt180 -96.87 146.79 31.91 Favored Pre-proline 0 CA--C 1.532 0.258 0 C-N-CA 120.748 -0.381 . . . . 0.0 110.396 179.956 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_exo -57.87 160.97 13.77 Favored 'Trans proline' 0 N--CA 1.496 1.653 0 C-N-CA 122.665 2.244 . . . . 0.0 113.177 -179.332 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.518 ' CE1' ' O ' ' A' ' 55' ' ' ARG . 33.9 m-85 -129.62 154.88 46.66 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 114.973 -1.012 . . . . 0.0 108.766 179.049 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 28.3 mt-10 -122.25 137.93 54.67 Favored 'General case' 0 N--CA 1.465 0.279 0 N-CA-C 109.319 -0.623 . . . . 0.0 109.319 178.54 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -121.41 139.47 53.41 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.033 0.444 . . . . 0.0 112.167 -178.026 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.503 HH11 ' CG ' ' A' ' 60' ' ' ARG . 1.9 mtt-85 -123.12 127.31 48.52 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 177.03 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.49 ' N ' HD12 ' A' ' 61' ' ' LEU . 9.6 mp -106.52 151.07 25.47 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 120.777 -0.369 . . . . 0.0 110.255 -179.433 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 28.4 m-85 -134.11 110.0 9.31 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.735 179.963 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.518 HD23 ' C ' ' A' ' 63' ' ' LEU . 2.2 tt -104.37 -82.39 0.51 Allowed 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 115.698 -0.683 . . . . 0.0 109.346 179.513 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.455 ' H ' ' HB ' ' A' ' 67' ' ' VAL . . . -79.43 179.18 53.23 Favored Glycine 0 CA--C 1.523 0.535 0 N-CA-C 109.343 -1.503 . . . . 0.0 109.343 178.561 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 1.6 mt -73.58 -34.5 65.14 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 119.767 -0.773 . . . . 0.0 110.426 -179.463 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -99.96 9.23 43.27 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.954 179.908 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' VAL . . . . . 0.567 ' O ' HG12 ' A' ' 67' ' ' VAL . 9.6 t -106.35 96.04 4.29 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.228 0 CA-C-O 121.168 0.509 . . . . 0.0 111.96 -178.616 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.513 HD12 ' N ' ' A' ' 69' ' ' ILE . 1.2 tp -114.97 118.06 32.38 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 178.216 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.513 ' N ' HD12 ' A' ' 68' ' ' LEU . 3.1 mt -112.46 146.15 17.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-O 120.846 0.355 . . . . 0.0 111.791 -178.193 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.482 ' NH2' ' OD2' ' A' ' 91' ' ' ASP . 33.8 ptt180 -128.04 132.23 49.1 Favored 'General case' 0 C--O 1.237 0.444 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.053 179.254 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -143.95 150.18 37.94 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.341 -0.845 . . . . 0.0 110.26 -179.965 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -106.33 126.81 52.7 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 178.332 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.414 HG22 ' HA ' ' A' ' 87' ' ' CYS . 10.5 pt -134.75 158.97 41.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 C-N-CA 119.77 -0.772 . . . . 0.0 113.01 -177.521 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 74' ' ' SER . . . . . 0.403 ' CB ' ' OE1' ' A' ' 88' ' ' GLN . 0.5 OUTLIER -122.77 155.87 35.64 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 115.048 -0.978 . . . . 0.0 110.172 179.209 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.491 HD22 ' CZ ' ' A' ' 85' ' ' PHE . 0.1 OUTLIER -65.66 119.23 10.78 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.311 -179.902 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 76' ' ' ALA . . . . . 0.416 ' N ' HD13 ' A' ' 75' ' ' LEU . . . -96.98 -40.75 8.73 Favored 'General case' 0 C--N 1.331 -0.203 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 177.648 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 77' ' ' TRP . . . . . 0.585 ' NE1' ' HA3' ' A' ' 84' ' ' GLY . 68.1 p-90 -171.28 169.3 6.4 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.517 -0.765 . . . . 0.0 109.809 179.8 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -149.43 123.79 9.62 Favored 'General case' 0 N--CA 1.464 0.245 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 178.728 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 26.7 ttt180 -152.35 134.36 14.91 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 119.706 -0.798 . . . . 0.0 113.017 179.791 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 80' ' ' ASP . . . . . 0.515 ' O ' ' OD1' ' A' ' 80' ' ' ASP . 11.8 t0 57.07 47.51 17.27 Favored 'General case' 0 N--CA 1.463 0.18 0 N-CA-C 113.861 1.06 . . . . 0.0 113.861 176.702 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 82.54 -27.61 3.68 Favored Glycine 0 CA--C 1.523 0.548 0 C-N-CA 120.356 -0.926 . . . . 0.0 113.491 177.121 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 4.7 mt -89.62 157.19 18.13 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 117.756 0.778 . . . . 0.0 110.285 -179.156 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 26.3 mt -128.22 135.43 49.69 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.0 -179.077 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 84' ' ' GLY . . . . . 0.585 ' HA3' ' NE1' ' A' ' 77' ' ' TRP . . . -98.39 152.52 19.8 Favored Glycine 0 N--CA 1.45 -0.378 0 N-CA-C 109.65 -1.38 . . . . 0.0 109.65 178.734 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 85' ' ' PHE . . . . . 0.491 ' CZ ' HD22 ' A' ' 75' ' ' LEU . 22.4 m-85 -145.66 135.31 23.32 Favored 'General case' 0 C--N 1.317 -0.819 0 C-N-CA 120.642 -0.423 . . . . 0.0 110.913 -179.199 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -104.26 126.22 51.18 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 178.843 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 87' ' ' CYS . . . . . 0.414 ' HA ' HG22 ' A' ' 73' ' ' ILE . 2.2 t -69.13 122.39 18.68 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.956 0.407 . . . . 0.0 111.679 -178.451 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 88' ' ' GLN . . . . . 0.403 ' OE1' ' CB ' ' A' ' 74' ' ' SER . 6.5 mt-30 -96.17 -33.52 12.01 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.18 179.411 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 89' ' ' HIS . . . . . 0.5 ' C ' ' ND1' ' A' ' 89' ' ' HIS . 0.0 OUTLIER -162.99 142.54 8.89 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.394 -179.905 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.468 HG23 ' CG1' ' A' ' 95' ' ' ILE . 6.2 tt -145.21 141.08 22.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-N 115.856 -0.611 . . . . 0.0 109.695 -179.844 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 91' ' ' ASP . . . . . 0.483 ' OD1' ' N ' ' A' ' 93' ' ' ASP . 7.0 t70 -56.6 145.72 27.52 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 115.54 -0.755 . . . . 0.0 111.807 -178.109 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.435 ' N ' ' OD1' ' A' ' 91' ' ' ASP . 48.5 tp -54.24 -42.21 69.63 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 115.272 -0.877 . . . . 0.0 110.446 -179.144 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 93' ' ' ASP . . . . . 0.483 ' N ' ' OD1' ' A' ' 91' ' ' ASP . 1.3 m-20 -70.16 -33.07 71.32 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 179.523 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 94' ' ' SER . . . . . 0.421 ' HB3' HD11 ' A' ' 90' ' ' ILE . 13.3 m -69.06 -37.81 78.73 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.838 -0.619 . . . . 0.0 109.84 179.309 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 95' ' ' ILE . . . . . 0.468 ' CG1' HG23 ' A' ' 90' ' ' ILE . 56.6 mt -58.87 -38.12 70.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.19 179.623 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -70.6 -42.06 71.5 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.421 -0.512 . . . . 0.0 111.364 -178.538 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 60.9 m-70 . . . . . 0 C--N 1.324 -0.53 0 C-N-CA 119.143 -1.023 . . . . 0.0 109.126 179.51 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.628 ' N ' HD12 ' A' ' 14' ' ' ILE . 1.2 mp . . . . . 0 CA--C 1.52 -0.2 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -94.96 120.25 34.86 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.582 0.706 . . . . 0.0 112.035 -178.924 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 2.5 p90 -149.77 158.79 44.5 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 114.686 -1.143 . . . . 0.0 107.959 177.605 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -95.26 147.11 23.83 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 119.981 -0.688 . . . . 0.0 110.574 -178.963 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.424 ' O ' HD12 ' A' ' 32' ' ' LEU . . . -179.67 178.48 0.64 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.902 -0.59 . . . . 0.0 109.763 179.915 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -96.55 134.04 40.26 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 120.786 -0.365 . . . . 0.0 110.976 179.987 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.583 ' O ' ' O ' ' A' ' 31' ' ' VAL . 7.6 p -135.78 157.04 47.84 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.18 179.044 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.406 ' C ' ' OE1' ' A' ' 21' ' ' GLU . 0.8 OUTLIER -144.74 144.38 31.16 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.122 -0.696 . . . . 0.0 109.122 178.702 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 1.2 mm -119.24 136.75 55.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-O 121.133 0.492 . . . . 0.0 111.591 -177.995 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.549 HD11 ' HG3' ' A' ' 60' ' ' ARG . 0.2 OUTLIER -121.63 123.15 41.24 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.617 -0.72 . . . . 0.0 111.017 -179.882 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.574 ' O ' ' NE2' ' A' ' 24' ' ' GLN . 0.0 OUTLIER -130.34 102.39 6.17 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.096 179.342 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 80.07 -126.06 7.24 Favored Glycine 0 CA--C 1.523 0.564 0 N-CA-C 109.821 -1.312 . . . . 0.0 109.821 -178.707 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -100.19 11.87 38.36 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 179.151 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.486 ' HB3' ' CZ2' ' A' ' 29' ' ' TRP . 2.2 mtt180 -112.74 131.25 55.76 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.846 -0.615 . . . . 0.0 112.364 -177.267 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.452 HH11 ' HD3' ' A' ' 28' ' ' ARG . 36.4 ttt180 -126.24 148.47 49.47 Favored 'General case' 0 CA--C 1.519 -0.238 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.783 178.875 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.53 ' NE1' ' O ' ' A' ' 48' ' ' ASP . 7.1 m-90 -147.47 156.44 42.85 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.459 -178.894 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.536 ' H ' ' CD ' ' A' ' 30' ' ' GLU . 3.1 mp0 -102.4 140.89 36.08 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.162 -0.472 . . . . 0.0 109.9 179.58 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.583 ' O ' ' O ' ' A' ' 20' ' ' SER . 12.4 m -150.25 157.25 6.16 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-O 121.159 0.504 . . . . 0.0 110.904 -179.697 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.507 HD12 ' N ' ' A' ' 33' ' ' LEU . 6.7 tp -94.23 128.54 40.74 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 107.475 -1.306 . . . . 0.0 107.475 178.144 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.802 HD23 ' O ' ' A' ' 33' ' ' LEU . 0.4 OUTLIER -90.22 126.01 35.68 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.57 -0.53 . . . . 0.0 109.57 -179.727 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 40.0 m-70 -93.06 -28.64 16.24 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.558 -0.747 . . . . 0.0 111.962 -178.218 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 2.0 p-10 -172.75 158.76 4.08 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 119.483 -0.887 . . . . 0.0 110.862 177.418 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' VAL . . . . . 0.538 HG22 ' N ' ' A' ' 37' ' ' SER . 7.1 p -143.54 169.27 11.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.494 -0.775 . . . . 0.0 110.878 -178.904 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 37' ' ' SER . . . . . 0.538 ' N ' HG22 ' A' ' 36' ' ' VAL . 17.1 t -140.91 170.72 15.2 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 178.814 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.489 HD12 ' N ' ' A' ' 39' ' ' HIS . 1.1 pp -67.4 -0.11 3.39 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 119.976 -0.689 . . . . 0.0 111.11 -179.397 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 39' ' ' HIS . . . . . 0.514 ' NE2' ' O ' ' A' ' 87' ' ' CYS . 1.6 t60 -162.22 35.12 0.12 Allowed 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 120.73 -0.388 . . . . 0.0 111.217 179.776 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -171.66 156.06 25.23 Favored Glycine 0 CA--C 1.526 0.731 0 N-CA-C 110.759 -0.936 . . . . 0.0 110.759 179.903 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -148.03 150.37 14.43 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 CA-C-O 121.597 0.713 . . . . 0.0 112.606 -178.839 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.415 HD23 ' N ' ' A' ' 43' ' ' VAL . 0.6 OUTLIER -123.0 140.51 52.96 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 114.665 -1.152 . . . . 0.0 109.191 178.849 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.415 ' N ' HD23 ' A' ' 42' ' ' LEU . 10.6 m -145.58 174.99 2.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-O 121.091 0.472 . . . . 0.0 111.092 179.95 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -96.96 145.38 17.84 Favored Glycine 0 CA--C 1.526 0.775 0 N-CA-C 109.47 -1.452 . . . . 0.0 109.47 178.237 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 45.2 tt0 -86.6 115.63 62.99 Favored Pre-proline 0 N--CA 1.462 0.154 0 CA-C-N 117.732 0.766 . . . . 0.0 111.79 -178.538 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 66.4 Cg_endo -85.13 161.33 11.53 Favored 'Trans proline' 0 C--N 1.306 -1.67 0 C-N-CA 121.569 1.513 . . . . 0.0 111.134 178.856 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 58.7 mt-30 -65.17 -40.14 93.89 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 112.128 0.418 . . . . 0.0 112.128 -178.885 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' ASP . . . . . 0.562 ' O ' ' N ' ' A' ' 50' ' ' ASN . 0.9 OUTLIER -72.21 8.63 1.24 Allowed 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 111.85 0.315 . . . . 0.0 111.85 -178.794 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 49' ' ' TRP . . . . . 0.486 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 64.9 t-105 -59.57 67.17 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 111.825 0.305 . . . . 0.0 111.825 -179.738 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 50' ' ' ASN . . . . . 0.562 ' N ' ' O ' ' A' ' 48' ' ' ASP . 32.8 t-20 -93.33 78.34 4.47 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 120.159 -0.616 . . . . 0.0 109.59 178.325 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -144.58 144.34 13.18 Favored Glycine 0 CA--C 1.523 0.533 0 N-CA-C 111.17 -0.772 . . . . 0.0 111.17 -179.38 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 23.0 t0 -77.94 113.33 31.94 Favored Pre-proline 0 CA--C 1.533 0.318 0 CA-C-N 115.878 -0.161 . . . . 0.0 111.102 -179.709 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -50.07 -22.63 8.12 Favored 'Trans proline' 0 N--CA 1.495 1.584 0 C-N-CA 122.522 2.148 . . . . 0.0 112.673 179.578 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 67.1 mm-40 -77.51 -23.99 50.12 Favored 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 120.642 -0.423 . . . . 0.0 111.769 -178.853 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.575 ' O ' ' CE1' ' A' ' 57' ' ' PHE . 66.8 mtm180 -92.94 151.04 40.34 Favored Pre-proline 0 C--N 1.33 -0.252 0 C-N-CA 120.671 -0.412 . . . . 0.0 110.077 179.741 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -62.94 160.73 32.32 Favored 'Trans proline' 0 N--CA 1.495 1.596 0 C-N-CA 122.834 2.356 . . . . 0.0 113.436 -178.701 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.575 ' CE1' ' O ' ' A' ' 55' ' ' ARG . 41.6 m-85 -130.59 155.18 46.97 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 114.897 -1.047 . . . . 0.0 109.147 179.343 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.411 ' O ' HD12 ' A' ' 23' ' ' LEU . 14.3 mt-10 -123.06 139.07 54.46 Favored 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 178.777 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 59' ' ' ALA . . . . . 0.429 ' HB2' HD13 ' A' ' 73' ' ' ILE . . . -118.66 135.93 54.2 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 112.501 0.556 . . . . 0.0 112.501 -177.772 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.574 ' C ' HD12 ' A' ' 61' ' ' LEU . 2.1 mmt85 -122.74 127.67 49.5 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 108.261 -1.014 . . . . 0.0 108.261 177.107 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.625 ' N ' HD12 ' A' ' 61' ' ' LEU . 7.9 mp -111.48 151.22 28.85 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 120.67 -0.412 . . . . 0.0 111.241 -178.558 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 9.8 m-85 -131.76 110.09 10.61 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.625 179.446 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.507 HD23 ' C ' ' A' ' 63' ' ' LEU . 2.0 tt -103.78 -85.43 0.46 Allowed 'General case' 0 C--N 1.333 -0.143 0 N-CA-C 108.991 -0.744 . . . . 0.0 108.991 178.968 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.45 ' H ' ' HB ' ' A' ' 67' ' ' VAL . . . -75.28 179.84 45.1 Favored Glycine 0 CA--C 1.522 0.508 0 N-CA-C 109.017 -1.633 . . . . 0.0 109.017 178.338 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.79 ' N ' HD22 ' A' ' 65' ' ' LEU . 2.5 mm? -74.42 -32.44 62.66 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 119.709 -0.796 . . . . 0.0 110.232 -179.479 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 24.7 m-20 -102.53 9.27 39.59 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 122.734 0.414 . . . . 0.0 111.063 -179.827 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' VAL . . . . . 0.574 ' O ' HG12 ' A' ' 67' ' ' VAL . 8.5 t -103.22 93.76 2.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-O 121.34 0.59 . . . . 0.0 111.667 -178.905 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 4.4 tp -109.99 117.66 34.37 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 178.272 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.55 HG23 ' OG ' ' A' ' 94' ' ' SER . 6.3 mt -115.78 143.99 24.45 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.278 0 CA-C-O 120.982 0.42 . . . . 0.0 111.374 -178.88 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.502 ' NH2' ' OD2' ' A' ' 91' ' ' ASP . 28.5 ptt-85 -128.38 130.73 48.13 Favored 'General case' 0 C--O 1.237 0.441 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.007 179.223 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 71' ' ' MET . . . . . 0.699 ' SD ' HD12 ' A' ' 90' ' ' ILE . 1.5 mtm -139.95 148.19 41.58 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 115.934 -0.576 . . . . 0.0 109.691 179.453 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -101.97 132.68 47.65 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 107.87 -1.159 . . . . 0.0 107.87 178.718 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.649 HD12 ' HB2' ' A' ' 85' ' ' PHE . 4.1 pt -142.7 157.41 18.5 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 C-N-CA 119.44 -0.904 . . . . 0.0 112.977 -177.666 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 3.3 t -121.91 155.45 35.42 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 115.47 -0.786 . . . . 0.0 109.763 179.032 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.593 HD13 ' N ' ' A' ' 76' ' ' ALA . 0.2 OUTLIER -65.02 118.43 9.11 Favored 'General case' 0 CA--C 1.521 -0.162 0 CA-C-O 121.161 0.505 . . . . 0.0 110.603 -178.575 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 76' ' ' ALA . . . . . 0.593 ' N ' HD13 ' A' ' 75' ' ' LEU . . . -97.22 -40.99 8.51 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.064 177.446 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 77' ' ' TRP . . . . . 0.475 ' NE1' ' HA3' ' A' ' 84' ' ' GLY . 68.8 p-90 -170.42 169.76 7.33 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.79 -179.819 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -151.07 123.99 8.65 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 116.299 -0.409 . . . . 0.0 109.948 178.658 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -152.04 132.03 13.42 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 120.043 -0.663 . . . . 0.0 112.364 179.593 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 55.67 47.19 21.14 Favored 'General case' 0 N--CA 1.465 0.287 0 N-CA-C 113.089 0.774 . . . . 0.0 113.089 176.85 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 68.17 12.67 63.44 Favored Glycine 0 CA--C 1.523 0.547 0 C-N-CA 120.343 -0.932 . . . . 0.0 111.902 178.385 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 29.1 mt -115.74 136.13 53.36 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 108.474 -0.935 . . . . 0.0 108.474 178.488 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 37.6 mt -124.48 136.41 53.99 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.497 -178.928 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 84' ' ' GLY . . . . . 0.475 ' HA3' ' NE1' ' A' ' 77' ' ' TRP . . . -123.36 134.58 9.49 Favored Glycine 0 CA--C 1.519 0.337 0 N-CA-C 109.481 -1.448 . . . . 0.0 109.481 178.551 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 85' ' ' PHE . . . . . 0.649 ' HB2' HD12 ' A' ' 73' ' ' ILE . 26.0 m-85 -122.65 157.78 31.46 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.964 0.412 . . . . 0.0 110.096 -179.805 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -104.8 130.55 52.89 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 178.314 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 87' ' ' CYS . . . . . 0.514 ' O ' ' NE2' ' A' ' 39' ' ' HIS . 44.5 t -74.78 124.23 26.42 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.826 0.346 . . . . 0.0 111.336 -178.976 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 3.6 pm0 -100.73 -31.2 11.31 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.458 179.598 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 89' ' ' HIS . . . . . 0.611 ' ND1' ' N ' ' A' ' 90' ' ' ILE . 0.0 OUTLIER -159.2 141.0 13.4 Favored 'General case' 0 C--O 1.225 -0.203 0 CA-C-O 120.909 0.385 . . . . 0.0 110.08 179.283 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.699 HD12 ' SD ' ' A' ' 71' ' ' MET . 7.7 tt -145.31 140.51 22.47 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-O 121.438 0.637 . . . . 0.0 110.15 -178.947 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 91' ' ' ASP . . . . . 0.502 ' OD2' ' NH2' ' A' ' 70' ' ' ARG . 0.1 OUTLIER -55.02 140.85 36.34 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 115.033 -0.985 . . . . 0.0 112.334 -178.058 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 6.6 tp -54.56 -42.62 71.21 Favored 'General case' 0 N--CA 1.462 0.136 0 CA-C-N 115.075 -0.966 . . . . 0.0 110.321 -179.642 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 93' ' ' ASP . . . . . 0.414 ' OD1' ' N ' ' A' ' 94' ' ' SER . 0.5 OUTLIER -71.93 -35.8 69.75 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 179.557 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 94' ' ' SER . . . . . 0.55 ' OG ' HG23 ' A' ' 69' ' ' ILE . 1.5 t -64.53 -38.26 90.39 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.427 179.078 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 95' ' ' ILE . . . . . 0.442 ' CG1' HG23 ' A' ' 90' ' ' ILE . 22.0 mt -59.01 -37.49 68.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.372 179.133 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -70.19 -40.12 74.83 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.096 -0.641 . . . . 0.0 110.612 -178.938 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 59.7 m-70 . . . . . 0 C--N 1.324 -0.51 0 C-N-CA 119.475 -0.89 . . . . 0.0 109.097 179.315 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.704 ' N ' HD12 ' A' ' 14' ' ' ILE . 1.5 mp . . . . . 0 C--O 1.231 0.126 0 N-CA-C 109.762 -0.459 . . . . 0.0 109.762 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -95.5 120.68 36.17 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.307 0.575 . . . . 0.0 112.497 -178.806 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 28.9 p90 -149.74 158.71 44.43 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.009 -0.996 . . . . 0.0 108.316 177.199 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -95.42 147.59 23.37 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 120.152 -0.619 . . . . 0.0 110.74 -179.174 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.617 ' O ' HD12 ' A' ' 32' ' ' LEU . . . 179.27 176.79 0.58 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.097 179.879 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -96.26 134.16 39.71 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.946 -179.927 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.492 ' O ' ' O ' ' A' ' 31' ' ' VAL . 11.7 p -134.44 153.37 51.95 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.925 0.393 . . . . 0.0 110.375 178.952 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 68.6 mt-10 -133.49 140.02 47.0 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 109.136 -0.69 . . . . 0.0 109.136 179.437 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' ILE . . . . . 0.411 ' HA ' ' O ' ' A' ' 58' ' ' GLU . 0.6 OUTLIER -119.9 135.77 59.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-O 121.311 0.577 . . . . 0.0 110.639 -179.47 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.459 ' H ' HD12 ' A' ' 23' ' ' LEU . 0.2 OUTLIER -123.71 123.26 40.14 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.407 -0.815 . . . . 0.0 111.113 -179.075 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.496 ' OE1' ' NH1' ' A' ' 27' ' ' ARG . 1.5 tm0? -129.62 102.09 6.21 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.377 -0.828 . . . . 0.0 110.042 179.079 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 81.06 -126.44 7.38 Favored Glycine 0 CA--C 1.523 0.549 0 N-CA-C 109.961 -1.256 . . . . 0.0 109.961 -178.87 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 14.7 pt-20 -100.18 11.66 38.83 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 179.269 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.496 ' NH1' ' OE1' ' A' ' 24' ' ' GLN . 0.2 OUTLIER -114.51 133.07 56.05 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.604 -0.726 . . . . 0.0 112.607 -176.443 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.433 ' O ' ' CD1' ' A' ' 29' ' ' TRP . 41.8 ttt-85 -128.12 153.0 47.33 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.334 179.555 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.433 ' CD1' ' O ' ' A' ' 28' ' ' ARG . 6.3 m-90 -150.51 156.48 41.5 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.276 -0.875 . . . . 0.0 110.501 -179.41 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.453 ' N ' ' CD ' ' A' ' 30' ' ' GLU . 4.7 mp0 -100.72 138.59 37.57 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.692 -0.485 . . . . 0.0 109.692 179.462 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.492 ' O ' ' O ' ' A' ' 20' ' ' SER . 18.4 m -148.34 158.69 7.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 121.232 0.539 . . . . 0.0 111.357 -179.241 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.617 HD12 ' O ' ' A' ' 18' ' ' ALA . 15.9 tp -96.52 128.16 43.19 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 108.392 -0.966 . . . . 0.0 108.392 178.732 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -91.08 125.85 35.99 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.249 0.547 . . . . 0.0 110.061 -179.885 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 72.2 m-70 -92.1 -28.24 17.24 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.308 -0.86 . . . . 0.0 111.76 -178.809 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 3.6 p30 -173.78 162.47 4.02 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 119.409 -0.916 . . . . 0.0 111.449 177.677 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' VAL . . . . . 0.504 HG22 ' H ' ' A' ' 37' ' ' SER . 3.3 p -145.35 168.84 7.93 Favored 'Isoleucine or valine' 0 C--O 1.231 0.124 0 CA-C-N 115.564 -0.744 . . . . 0.0 111.098 -179.063 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 37' ' ' SER . . . . . 0.504 ' H ' HG22 ' A' ' 36' ' ' VAL . 30.1 t -140.99 169.32 17.84 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 107.93 -1.137 . . . . 0.0 107.93 178.694 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.68 ' H ' HD12 ' A' ' 38' ' ' LEU . 5.9 mp -64.65 0.21 1.19 Allowed 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 119.44 -0.904 . . . . 0.0 110.241 -179.256 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 39' ' ' HIS . . . . . 0.445 ' H ' ' C ' ' A' ' 37' ' ' SER . 32.9 p-80 -163.36 43.81 0.11 Allowed 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 120.633 -0.427 . . . . 0.0 111.581 179.995 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 178.78 158.18 20.79 Favored Glycine 0 CA--C 1.53 0.977 0 C-N-CA 120.716 -0.754 . . . . 0.0 111.525 179.784 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -149.34 149.19 15.01 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.352 0 CA-C-O 121.364 0.602 . . . . 0.0 111.751 -178.759 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.416 HD23 ' N ' ' A' ' 43' ' ' VAL . 1.1 tt -121.88 127.75 50.82 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 114.93 -1.032 . . . . 0.0 108.442 178.325 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.416 ' N ' HD23 ' A' ' 42' ' ' LEU . 23.2 m -130.9 174.72 12.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-O 121.3 0.571 . . . . 0.0 111.543 -179.028 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -96.81 144.15 17.16 Favored Glycine 0 CA--C 1.526 0.774 0 N-CA-C 109.164 -1.574 . . . . 0.0 109.164 178.062 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -85.4 115.49 61.59 Favored Pre-proline 0 N--CA 1.464 0.239 0 CA-C-N 117.995 0.897 . . . . 0.0 111.713 -178.633 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 78.2 Cg_endo -85.47 160.63 11.01 Favored 'Trans proline' 0 C--N 1.307 -1.616 0 C-N-CA 121.685 1.59 . . . . 0.0 111.259 178.923 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 16.5 pt20 -65.43 -30.59 71.4 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.127 0.417 . . . . 0.0 112.127 -179.106 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' ASP . . . . . 0.543 ' O ' ' N ' ' A' ' 50' ' ' ASN . 40.7 m-20 -80.5 8.45 7.72 Favored 'General case' 0 N--CA 1.465 0.278 0 N-CA-C 111.957 0.355 . . . . 0.0 111.957 -178.699 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 49' ' ' TRP . . . . . 0.441 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 61.8 t-105 -60.1 66.75 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 112.089 0.403 . . . . 0.0 112.089 -179.389 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 50' ' ' ASN . . . . . 0.551 HD22 ' C ' ' A' ' 50' ' ' ASN . 0.2 OUTLIER -93.25 78.9 4.48 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 120.002 -0.679 . . . . 0.0 109.555 178.386 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -143.9 160.27 27.73 Favored Glycine 0 CA--C 1.523 0.535 0 N-CA-C 111.098 -0.801 . . . . 0.0 111.098 -179.45 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -95.03 109.22 43.18 Favored Pre-proline 0 CA--C 1.534 0.358 0 CA-C-N 115.63 -0.285 . . . . 0.0 110.694 -179.756 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -48.68 -22.53 4.56 Favored 'Trans proline' 0 N--CA 1.494 1.51 0 C-N-CA 122.391 2.061 . . . . 0.0 112.549 179.831 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 38.6 mt-30 -75.71 -24.02 56.18 Favored 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 120.497 -0.481 . . . . 0.0 111.413 -179.13 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.518 ' O ' ' CE1' ' A' ' 57' ' ' PHE . 21.7 mtm180 -94.77 155.79 38.92 Favored Pre-proline 0 C--N 1.33 -0.242 0 C-N-CA 120.838 -0.345 . . . . 0.0 110.085 179.777 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -67.05 160.8 45.61 Favored 'Trans proline' 0 C--N 1.308 -1.569 0 C-N-CA 122.753 2.302 . . . . 0.0 112.935 -179.063 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.518 ' CE1' ' O ' ' A' ' 55' ' ' ARG . 58.8 m-85 -130.53 156.0 45.54 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.142 -0.936 . . . . 0.0 108.953 179.418 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.411 ' O ' ' HA ' ' A' ' 22' ' ' ILE . 33.9 mt-10 -122.5 138.61 54.5 Favored 'General case' 0 C--O 1.221 -0.434 0 N-CA-C 109.063 -0.717 . . . . 0.0 109.063 178.483 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 59' ' ' ALA . . . . . 0.474 ' HB2' HD13 ' A' ' 73' ' ' ILE . . . -119.86 138.3 53.48 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 112.463 0.542 . . . . 0.0 112.463 -177.876 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.505 ' CZ ' ' OH ' ' A' ' 62' ' ' TYR . 31.3 mtm180 -123.92 127.68 48.34 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 177.681 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.502 HD12 ' C ' ' A' ' 60' ' ' ARG . 11.2 mp -108.73 151.16 26.57 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.0 0.429 . . . . 0.0 111.053 -178.798 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 62' ' ' TYR . . . . . 0.505 ' OH ' ' CZ ' ' A' ' 60' ' ' ARG . 36.8 m-85 -133.42 108.6 8.77 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.29 179.539 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.499 HD12 ' C ' ' A' ' 62' ' ' TYR . 8.8 mp -104.47 -90.11 0.4 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.165 179.436 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -70.12 177.23 32.45 Favored Glycine 0 CA--C 1.523 0.538 0 N-CA-C 109.166 -1.574 . . . . 0.0 109.166 178.304 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.75 ' H ' HD12 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -73.21 -32.61 64.88 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 119.824 -0.75 . . . . 0.0 110.219 -179.544 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -102.42 9.65 39.55 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 122.846 0.459 . . . . 0.0 111.251 -179.763 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' VAL . . . . . 0.463 ' O ' HG12 ' A' ' 67' ' ' VAL . 34.3 t -106.03 96.51 4.67 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.378 0 CA-C-O 121.441 0.639 . . . . 0.0 111.997 -178.747 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.446 HD13 ' CE2' ' A' ' 62' ' ' TYR . 6.5 tp -113.22 117.61 32.36 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.078 -0.965 . . . . 0.0 108.421 178.514 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.472 HG23 ' CB ' ' A' ' 94' ' ' SER . 3.7 mt -114.16 145.19 20.31 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-O 120.933 0.397 . . . . 0.0 111.56 -178.707 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 6.9 ptm180 -128.01 135.47 49.93 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.801 179.018 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -146.33 149.54 34.0 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.426 -179.597 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -102.96 135.62 44.29 Favored 'General case' 0 N--CA 1.463 0.184 0 N-CA-C 108.01 -1.107 . . . . 0.0 108.01 178.166 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.583 HD12 ' CB ' ' A' ' 85' ' ' PHE . 1.9 pt -144.37 157.89 15.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 C-N-CA 119.467 -0.893 . . . . 0.0 113.163 -177.59 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 1.3 t -123.07 155.86 36.07 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.067 178.805 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.618 HD13 ' N ' ' A' ' 76' ' ' ALA . 0.2 OUTLIER -65.2 118.66 9.56 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.951 0.405 . . . . 0.0 110.338 -179.65 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 76' ' ' ALA . . . . . 0.618 ' N ' HD13 ' A' ' 75' ' ' LEU . . . -97.1 -40.83 8.63 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.047 177.658 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 77' ' ' TRP . . . . . 0.547 ' NE1' ' HA3' ' A' ' 84' ' ' GLY . 67.2 p-90 -171.04 169.23 6.66 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.316 -179.956 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -151.27 123.86 8.47 Favored 'General case' 0 N--CA 1.464 0.226 0 N-CA-C 109.97 -0.382 . . . . 0.0 109.97 178.778 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 2.7 ttm180 -152.27 134.08 14.78 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 119.827 -0.749 . . . . 0.0 113.016 179.651 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 40.6 m-20 56.56 47.34 18.78 Favored 'General case' 0 N--CA 1.463 0.219 0 N-CA-C 113.983 1.105 . . . . 0.0 113.983 176.485 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 84.36 -27.76 4.52 Favored Glycine 0 CA--C 1.523 0.581 0 C-N-CA 120.408 -0.901 . . . . 0.0 113.452 177.23 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 4.0 mt -89.58 155.76 19.05 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 117.847 0.824 . . . . 0.0 110.439 -179.008 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 44.1 mt -128.62 135.57 49.5 Favored 'General case' 0 CA--C 1.52 -0.208 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.456 -179.136 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 84' ' ' GLY . . . . . 0.547 ' HA3' ' NE1' ' A' ' 77' ' ' TRP . . . -98.98 151.51 19.5 Favored Glycine 0 N--CA 1.453 -0.199 0 N-CA-C 109.691 -1.363 . . . . 0.0 109.691 178.615 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 85' ' ' PHE . . . . . 0.583 ' CB ' HD12 ' A' ' 73' ' ' ILE . 46.5 m-85 -145.97 136.77 24.35 Favored 'General case' 0 C--N 1.32 -0.702 0 C-N-CA 120.655 -0.418 . . . . 0.0 110.46 -179.716 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -104.06 127.28 51.63 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.411 -0.588 . . . . 0.0 109.411 179.822 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 43.3 t -77.55 128.31 33.96 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.071 0.462 . . . . 0.0 111.21 -179.065 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -103.98 -27.37 12.19 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.191 179.962 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 89' ' ' HIS . . . . . 0.601 ' ND1' ' N ' ' A' ' 90' ' ' ILE . 0.0 OUTLIER -159.67 140.74 12.55 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.063 0.458 . . . . 0.0 110.281 179.484 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.601 ' N ' ' ND1' ' A' ' 89' ' ' HIS . 8.8 tt -146.06 141.15 21.52 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 115.741 -0.663 . . . . 0.0 109.817 -179.942 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -53.71 140.41 29.61 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.086 -0.961 . . . . 0.0 112.242 -178.004 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 6.4 tt -54.63 -42.22 70.97 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.148 -0.933 . . . . 0.0 109.847 179.822 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -68.27 -36.73 79.84 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 179.225 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 94' ' ' SER . . . . . 0.472 ' CB ' HG23 ' A' ' 69' ' ' ILE . 4.1 m -67.59 -36.4 80.81 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.595 -0.729 . . . . 0.0 109.738 179.146 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 95' ' ' ILE . . . . . 0.441 HG12 HG23 ' A' ' 90' ' ' ILE . 1.0 OUTLIER -58.66 -38.55 72.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.757 -0.656 . . . . 0.0 109.936 179.284 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -70.9 -38.48 72.99 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.281 -0.568 . . . . 0.0 111.281 -178.735 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 60.4 m-70 . . . . . 0 C--N 1.323 -0.548 0 C-N-CA 118.929 -1.108 . . . . 0.0 108.821 179.456 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 20.5 mm . . . . . 0 CA--C 1.522 -0.113 0 CA-C-O 120.534 0.207 . . . . 0.0 110.53 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -95.25 119.72 34.24 Favored 'General case' 0 C--N 1.331 -0.225 0 C-N-CA 120.157 -0.617 . . . . 0.0 111.694 -179.744 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 6.2 p90 -150.36 159.03 44.75 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 114.876 -1.057 . . . . 0.0 108.201 177.206 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -94.99 146.47 24.23 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 119.935 -0.706 . . . . 0.0 111.176 -178.503 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -178.23 175.86 1.16 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.867 -0.606 . . . . 0.0 109.964 179.646 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -96.22 134.79 38.89 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.083 -179.615 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.58 ' O ' ' O ' ' A' ' 31' ' ' VAL . 11.4 p -134.87 154.07 51.8 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.035 0.445 . . . . 0.0 110.428 178.861 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -133.94 142.61 47.77 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 108.904 -0.776 . . . . 0.0 108.904 179.419 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 53.3 mt -122.61 136.8 58.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-O 121.429 0.633 . . . . 0.0 111.108 -179.541 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.676 ' H ' HD12 ' A' ' 23' ' ' LEU . 0.0 OUTLIER -121.94 123.81 42.56 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.133 -0.94 . . . . 0.0 110.949 -179.158 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.7 ' NE2' ' CE2' ' A' ' 57' ' ' PHE . 2.5 tt0 -126.77 131.2 51.35 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 107.876 -1.157 . . . . 0.0 107.876 178.339 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 47.47 -120.5 5.75 Favored Glycine 0 CA--C 1.528 0.876 0 N-CA-C 110.451 -1.06 . . . . 0.0 110.451 -179.234 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -105.08 13.21 31.18 Favored 'General case' 0 N--CA 1.463 0.225 0 N-CA-C 111.637 0.236 . . . . 0.0 111.637 -179.503 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.618 ' HB3' ' CZ2' ' A' ' 29' ' ' TRP . 2.6 mpt_? -111.95 133.1 54.35 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 -179.023 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.473 ' HG3' ' N ' ' A' ' 29' ' ' TRP . 0.0 OUTLIER -125.18 145.04 50.15 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.02 -0.536 . . . . 0.0 109.799 179.261 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.618 ' CZ2' ' HB3' ' A' ' 27' ' ' ARG . 6.3 m-90 -145.52 156.53 43.77 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.364 -0.835 . . . . 0.0 110.705 -179.03 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 16.4 mt-10 -100.6 137.94 38.34 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 178.773 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.58 ' O ' ' O ' ' A' ' 20' ' ' SER . 26.3 m -147.74 159.05 8.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-O 121.199 0.523 . . . . 0.0 111.287 -179.548 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.872 ' H ' HD23 ' A' ' 32' ' ' LEU . 1.4 pt? -98.38 130.04 45.03 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 108.79 -0.818 . . . . 0.0 108.79 178.652 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -93.31 126.58 38.5 Favored 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 120.179 -0.608 . . . . 0.0 109.661 -179.762 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 76.1 m-70 -91.82 -26.14 18.66 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.366 -0.834 . . . . 0.0 111.959 -178.31 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -174.01 161.03 3.6 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 119.38 -0.928 . . . . 0.0 111.354 177.443 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' VAL . . . . . 0.526 HG22 ' H ' ' A' ' 37' ' ' SER . 3.4 p -144.22 168.74 10.39 Favored 'Isoleucine or valine' 0 C--O 1.232 0.135 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.987 -179.128 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 37' ' ' SER . . . . . 0.526 ' H ' HG22 ' A' ' 36' ' ' VAL . 6.3 t -142.2 168.42 19.79 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 107.621 -1.251 . . . . 0.0 107.621 178.659 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.586 ' CD1' ' ND1' ' A' ' 39' ' ' HIS . 0.3 OUTLIER -63.81 1.02 0.69 Allowed 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 119.216 -0.994 . . . . 0.0 110.549 -179.625 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 39' ' ' HIS . . . . . 0.586 ' ND1' ' CD1' ' A' ' 38' ' ' LEU . 21.9 p-80 -166.53 44.51 0.06 Allowed 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 120.718 -0.393 . . . . 0.0 111.226 179.35 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -176.97 152.04 11.81 Favored Glycine 0 CA--C 1.526 0.719 0 N-CA-C 111.012 -0.835 . . . . 0.0 111.012 179.68 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -148.01 149.01 15.69 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.259 0 CA-C-O 121.545 0.688 . . . . 0.0 111.581 -179.337 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -121.34 135.04 55.14 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 114.873 -1.058 . . . . 0.0 108.191 178.488 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 20.2 m -140.61 174.71 7.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 C-N-CA 120.261 -0.576 . . . . 0.0 111.826 -178.887 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -97.41 143.99 17.05 Favored Glycine 0 CA--C 1.526 0.746 0 N-CA-C 109.497 -1.441 . . . . 0.0 109.497 178.305 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' GLN . . . . . 0.54 ' O ' ' CD ' ' A' ' 45' ' ' GLN . 0.0 OUTLIER -86.58 115.91 64.02 Favored Pre-proline 0 CA--C 1.533 0.327 0 CA-C-N 117.74 0.77 . . . . 0.0 111.729 -178.569 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 89.7 Cg_endo -84.62 161.14 12.49 Favored 'Trans proline' 0 C--N 1.308 -1.557 0 C-N-CA 121.42 1.414 . . . . 0.0 111.262 179.003 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.2 pt20 -65.3 -38.34 89.9 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 112.437 0.532 . . . . 0.0 112.437 -178.745 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' ASP . . . . . 0.594 ' O ' ' NE1' ' A' ' 29' ' ' TRP . 1.3 m-20 -74.66 8.36 2.42 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 111.87 0.322 . . . . 0.0 111.87 -178.647 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 49' ' ' TRP . . . . . 0.463 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 65.4 t-105 -58.57 67.98 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 112.03 0.382 . . . . 0.0 112.03 -179.534 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 50' ' ' ASN . . . . . 0.561 ' N ' ' O ' ' A' ' 48' ' ' ASP . 32.2 t-20 -93.22 78.73 4.51 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 120.086 -0.646 . . . . 0.0 109.585 178.484 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -146.15 143.75 11.98 Favored Glycine 0 CA--C 1.526 0.733 0 N-CA-C 111.242 -0.743 . . . . 0.0 111.242 -179.492 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -77.46 122.22 85.62 Favored Pre-proline 0 CA--C 1.536 0.43 0 CA-C-N 115.77 -0.215 . . . . 0.0 110.939 -179.813 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 12.7 Cg_endo -58.35 -22.69 59.43 Favored 'Trans proline' 0 N--CA 1.496 1.654 0 C-N-CA 122.698 2.266 . . . . 0.0 112.362 -179.441 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 22.2 mp0 -78.77 -23.86 45.04 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.337 -0.545 . . . . 0.0 111.69 -179.183 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.522 ' O ' ' CE1' ' A' ' 57' ' ' PHE . 42.2 mtt180 -91.1 155.41 44.77 Favored Pre-proline 0 N--CA 1.463 0.201 0 C-N-CA 120.471 -0.492 . . . . 0.0 109.921 179.772 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 56' ' ' PRO . . . . . 0.544 ' O ' ' NE2' ' A' ' 24' ' ' GLN . 44.6 Cg_endo -67.81 160.59 47.63 Favored 'Trans proline' 0 C--N 1.308 -1.601 0 C-N-CA 122.762 2.308 . . . . 0.0 113.243 -178.846 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.7 ' CE2' ' NE2' ' A' ' 24' ' ' GLN . 51.5 m-85 -130.64 156.54 44.72 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 114.935 -1.029 . . . . 0.0 108.953 179.433 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.532 ' O ' HD12 ' A' ' 23' ' ' LEU . 19.5 mt-10 -121.95 135.07 54.84 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 108.852 -0.796 . . . . 0.0 108.852 178.466 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 59' ' ' ALA . . . . . 0.636 ' HB2' HD13 ' A' ' 73' ' ' ILE . . . -116.49 136.92 52.58 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.088 0.47 . . . . 0.0 111.56 -178.431 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 7.0 mtt180 -123.65 127.77 48.7 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 108.538 -0.912 . . . . 0.0 108.538 177.848 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 6.6 mt -107.07 144.82 33.19 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.593 -0.443 . . . . 0.0 110.54 -179.184 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' TYR . . . . . 0.517 ' N ' ' CD1' ' A' ' 62' ' ' TYR . 6.5 m-85 -128.58 110.3 12.13 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.719 179.899 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 9.1 mp -105.57 -91.15 0.4 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.257 179.294 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -68.84 178.8 24.35 Favored Glycine 0 CA--C 1.521 0.461 0 N-CA-C 109.484 -1.446 . . . . 0.0 109.484 178.689 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.627 ' C ' HD12 ' A' ' 65' ' ' LEU . 0.9 OUTLIER -74.0 -31.4 62.94 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.015 -0.674 . . . . 0.0 110.122 -179.893 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 66' ' ' ASP . . . . . 0.416 ' O ' ' OD1' ' A' ' 66' ' ' ASP . 37.5 t0 -103.39 9.23 37.94 Favored 'General case' 0 C--N 1.333 -0.141 0 C-N-CA 122.663 0.385 . . . . 0.0 111.272 -179.802 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 67' ' ' VAL . . . . . 0.549 ' O ' HG12 ' A' ' 67' ' ' VAL . 16.4 t -104.08 95.26 3.68 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.3 0 CA-C-O 121.4 0.619 . . . . 0.0 111.761 -178.876 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.491 HD12 ' N ' ' A' ' 69' ' ' ILE . 3.7 tp -111.51 117.19 32.32 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 107.859 -1.163 . . . . 0.0 107.859 178.128 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.609 HG23 ' OG ' ' A' ' 94' ' ' SER . 5.1 mt -114.37 144.12 22.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-O 120.959 0.409 . . . . 0.0 111.086 -178.812 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.416 HH11 ' HD3' ' A' ' 70' ' ' ARG . 4.1 ptt180 -128.28 130.6 48.1 Favored 'General case' 0 C--O 1.238 0.48 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.828 179.189 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 71' ' ' MET . . . . . 0.784 ' SD ' HD12 ' A' ' 90' ' ' ILE . 1.2 mtm -140.01 147.47 40.44 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.66 -0.7 . . . . 0.0 109.622 179.583 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -99.68 132.59 44.92 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 107.627 -1.249 . . . . 0.0 107.627 178.529 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.636 HD13 ' HB2' ' A' ' 59' ' ' ALA . 13.1 pt -142.0 157.21 20.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 C-N-CA 119.109 -1.036 . . . . 0.0 113.132 -177.467 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 2.7 p -123.65 155.48 37.67 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 114.983 -1.008 . . . . 0.0 110.021 179.219 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.49 HD12 ' CE1' ' A' ' 85' ' ' PHE . 5.6 tp -66.01 119.45 11.38 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.0 0.429 . . . . 0.0 110.802 -179.699 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -97.22 -41.05 8.48 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.342 177.796 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 77' ' ' TRP . . . . . 0.576 ' NE1' ' HA3' ' A' ' 84' ' ' GLY . 67.8 p-90 -171.0 170.73 6.13 Favored 'General case' 0 N--CA 1.466 0.375 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.051 -179.782 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -151.28 124.11 8.58 Favored 'General case' 0 N--CA 1.465 0.289 0 N-CA-C 110.197 -0.298 . . . . 0.0 110.197 178.89 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 1.2 ttp180 -152.37 134.07 14.69 Favored 'General case' 0 CA--C 1.533 0.326 0 N-CA-C 113.148 0.796 . . . . 0.0 113.148 179.795 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 57.11 47.41 17.34 Favored 'General case' 0 N--CA 1.463 0.225 0 N-CA-C 114.124 1.157 . . . . 0.0 114.124 176.434 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 84.55 -28.64 4.28 Favored Glycine 0 CA--C 1.523 0.571 0 C-N-CA 120.382 -0.913 . . . . 0.0 113.157 177.184 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 6.4 mt -89.5 157.81 17.94 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 117.574 0.687 . . . . 0.0 110.57 -178.927 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.442 HD11 ' CB ' ' A' ' 45' ' ' GLN . 38.0 mt -128.74 135.25 48.94 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.833 -0.622 . . . . 0.0 111.016 -179.397 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 84' ' ' GLY . . . . . 0.576 ' HA3' ' NE1' ' A' ' 77' ' ' TRP . . . -95.04 152.1 20.32 Favored Glycine 0 N--CA 1.45 -0.392 0 N-CA-C 109.471 -1.451 . . . . 0.0 109.471 178.544 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 85' ' ' PHE . . . . . 0.49 ' CE1' HD12 ' A' ' 75' ' ' LEU . 22.5 m-85 -145.74 132.44 19.96 Favored 'General case' 0 C--N 1.32 -0.716 0 C-N-CA 120.641 -0.424 . . . . 0.0 110.675 -179.247 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.412 ' O ' ' CG ' ' A' ' 86' ' ' GLU . 7.4 pt-20 -104.02 127.45 51.58 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 179.67 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 1.8 t -74.8 125.69 29.33 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.16 0.505 . . . . 0.0 111.824 -178.685 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 1.5 pt20 -100.79 -29.22 12.38 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.162 179.327 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 89' ' ' HIS . . . . . 0.622 ' ND1' ' N ' ' A' ' 90' ' ' ILE . 0.0 OUTLIER -160.39 141.18 11.9 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.958 0.409 . . . . 0.0 110.143 179.512 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.784 HD12 ' SD ' ' A' ' 71' ' ' MET . 6.5 tt -145.65 140.71 22.02 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.096 -179.23 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -56.33 139.64 47.77 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 115.21 -0.905 . . . . 0.0 112.373 -178.079 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 5.5 tp -54.29 -42.29 69.88 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 115.145 -0.934 . . . . 0.0 110.431 -180.0 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 25.6 t0 -69.06 -37.76 78.69 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 179.277 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 94' ' ' SER . . . . . 0.609 ' OG ' HG23 ' A' ' 69' ' ' ILE . 1.2 t -68.54 -35.19 77.1 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.639 179.183 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 95' ' ' ILE . . . . . 0.445 ' CG1' HG23 ' A' ' 90' ' ' ILE . 20.3 mt -58.64 -37.27 64.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.771 179.233 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -70.33 -40.71 73.97 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 120.278 -0.569 . . . . 0.0 110.669 -178.999 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 61.6 m-70 . . . . . 0 C--N 1.326 -0.451 0 C-N-CA 119.499 -0.88 . . . . 0.0 109.149 179.454 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.635 ' N ' HD12 ' A' ' 14' ' ' ILE . 1.8 mp . . . . . 0 CA--C 1.52 -0.203 0 CA-C-O 121.008 0.432 . . . . 0.0 110.21 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -94.91 120.57 35.35 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.954 -179.834 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.453 ' HE2' HD23 ' A' ' 63' ' ' LEU . 0.4 OUTLIER -149.48 153.43 37.23 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.058 -0.974 . . . . 0.0 108.453 178.399 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -95.36 149.64 21.15 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 120.299 -0.56 . . . . 0.0 111.149 -178.503 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . 178.39 178.78 0.38 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.802 -0.635 . . . . 0.0 109.99 179.626 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -96.36 134.71 39.16 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.892 -179.941 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.67 ' O ' ' O ' ' A' ' 31' ' ' VAL . 5.8 p -136.5 159.03 43.02 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.34 179.169 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.414 ' C ' ' OE1' ' A' ' 21' ' ' GLU . 0.5 OUTLIER -146.71 146.23 30.26 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 178.674 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 22' ' ' ILE . . . . . 0.516 ' CD1' HD11 ' A' ' 73' ' ' ILE . 1.1 mm -120.37 136.47 57.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-O 121.208 0.528 . . . . 0.0 111.645 -178.091 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.51 ' H ' HD12 ' A' ' 23' ' ' LEU . 0.2 OUTLIER -121.25 123.11 41.42 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.836 -179.902 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.725 ' NE2' ' CE2' ' A' ' 57' ' ' PHE . 12.2 tt0 -130.39 102.27 6.11 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.303 -0.862 . . . . 0.0 109.775 179.028 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 79.89 -126.51 7.48 Favored Glycine 0 CA--C 1.525 0.657 0 N-CA-C 110.053 -1.219 . . . . 0.0 110.053 -179.022 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.4 pm0 -100.61 10.89 40.58 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.816 0.341 . . . . 0.0 110.213 179.444 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.576 ' HB3' ' CZ2' ' A' ' 29' ' ' TRP . 6.5 mtt180 -112.56 133.82 54.4 Favored 'General case' 0 CA--C 1.52 -0.175 0 N-CA-C 112.228 0.455 . . . . 0.0 112.228 -178.758 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 74.7 ttt180 -128.02 149.2 50.47 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.182 179.417 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.576 ' CZ2' ' HB3' ' A' ' 27' ' ' ARG . 6.7 m-90 -147.15 155.54 42.22 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.246 -179.079 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.559 ' H ' ' CD ' ' A' ' 30' ' ' GLU . 3.0 mp0 -101.5 137.89 39.23 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 179.566 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.67 ' O ' ' O ' ' A' ' 20' ' ' SER . 19.2 m -146.71 157.45 10.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 121.261 0.553 . . . . 0.0 111.16 -179.768 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 1.014 ' H ' HD23 ' A' ' 32' ' ' LEU . 1.6 pt? -96.17 130.27 43.27 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 108.614 -0.884 . . . . 0.0 108.614 178.363 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.518 HD13 HD21 ' A' ' 61' ' ' LEU . 1.7 tt -91.47 125.97 36.39 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.241 0.543 . . . . 0.0 110.088 -179.329 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 75.2 m-70 -91.85 -28.57 17.24 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.225 -0.898 . . . . 0.0 111.86 -178.5 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 2.0 p30 -173.39 162.99 4.42 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 119.412 -0.915 . . . . 0.0 111.461 177.632 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' VAL . . . . . 0.521 HG22 ' N ' ' A' ' 37' ' ' SER . 7.3 p -145.48 168.01 8.65 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.084 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.777 -179.193 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 37' ' ' SER . . . . . 0.521 ' N ' HG22 ' A' ' 36' ' ' VAL . 6.5 t -141.78 170.39 15.81 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 107.907 -1.145 . . . . 0.0 107.907 179.042 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -66.11 -0.62 2.55 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 119.488 -0.885 . . . . 0.0 110.832 -178.909 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 39' ' ' HIS . . . . . 0.43 ' NE2' ' O ' ' A' ' 87' ' ' CYS . 3.0 t60 -163.09 40.03 0.1 Allowed 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 120.682 -0.407 . . . . 0.0 111.128 179.713 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -175.05 155.38 20.46 Favored Glycine 0 CA--C 1.526 0.749 0 N-CA-C 111.144 -0.782 . . . . 0.0 111.144 179.849 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -148.2 148.94 15.69 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.204 0 CA-C-O 121.359 0.599 . . . . 0.0 111.375 -179.17 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -122.09 137.33 54.85 Favored 'General case' 0 N--CA 1.462 0.134 0 CA-C-N 115.133 -0.94 . . . . 0.0 108.642 178.932 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 19.8 m -141.39 174.88 6.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 C-N-CA 120.27 -0.572 . . . . 0.0 111.788 -179.181 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -96.58 145.25 17.75 Favored Glycine 0 CA--C 1.529 0.968 0 N-CA-C 109.572 -1.411 . . . . 0.0 109.572 178.257 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.4 tm0? -87.34 114.18 57.45 Favored Pre-proline 0 N--CA 1.465 0.283 0 CA-C-N 117.877 0.839 . . . . 0.0 111.947 -178.518 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 94.3 Cg_endo -85.26 161.42 11.34 Favored 'Trans proline' 0 C--N 1.309 -1.524 0 C-N-CA 121.714 1.609 . . . . 0.0 111.723 179.082 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.403 ' HG2' ' H ' ' A' ' 48' ' ' ASP . 0.5 OUTLIER -65.57 -40.32 92.63 Favored 'General case' 0 CA--C 1.532 0.277 0 N-CA-C 112.439 0.533 . . . . 0.0 112.439 -179.081 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 48' ' ' ASP . . . . . 0.531 ' O ' ' NE1' ' A' ' 29' ' ' TRP . 37.7 m-20 -72.85 8.06 1.7 Allowed 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 111.839 0.311 . . . . 0.0 111.839 -178.565 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 49' ' ' TRP . . . . . 0.448 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 60.3 t-105 -60.67 68.28 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.712 -179.58 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 50' ' ' ASN . . . . . 0.531 ' N ' ' O ' ' A' ' 48' ' ' ASP . 0.6 OUTLIER -93.22 78.78 4.51 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 120.207 -0.597 . . . . 0.0 109.572 178.643 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -141.45 159.54 26.77 Favored Glycine 0 CA--C 1.524 0.638 0 N-CA-C 111.31 -0.716 . . . . 0.0 111.31 -179.381 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 22.4 t0 -94.47 110.34 48.29 Favored Pre-proline 0 CA--C 1.533 0.291 0 CA-C-N 115.823 -0.189 . . . . 0.0 110.546 -179.98 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_exo -46.39 -22.72 1.76 Allowed 'Trans proline' 0 N--CA 1.495 1.579 0 C-N-CA 122.647 2.232 . . . . 0.0 112.393 -179.919 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 69.1 mt-30 -79.61 -24.05 42.24 Favored 'General case' 0 C--N 1.326 -0.444 0 C-N-CA 120.648 -0.421 . . . . 0.0 111.815 -178.751 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.578 ' O ' ' CE1' ' A' ' 57' ' ' PHE . 0.0 OUTLIER -93.55 150.72 39.32 Favored Pre-proline 0 C--N 1.329 -0.283 0 C-N-CA 120.531 -0.468 . . . . 0.0 110.166 179.941 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 56' ' ' PRO . . . . . 0.589 ' O ' ' NE2' ' A' ' 24' ' ' GLN . 35.9 Cg_endo -64.43 160.68 38.18 Favored 'Trans proline' 0 N--CA 1.495 1.582 0 C-N-CA 122.841 2.361 . . . . 0.0 113.421 -178.655 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.725 ' CE2' ' NE2' ' A' ' 24' ' ' GLN . 50.4 m-85 -131.22 157.02 44.34 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 114.845 -1.07 . . . . 0.0 109.134 179.594 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.411 ' O ' HD12 ' A' ' 23' ' ' LEU . 83.5 mt-10 -122.72 137.18 54.99 Favored 'General case' 0 N--CA 1.468 0.444 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 178.535 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -116.29 135.41 53.91 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.026 0.441 . . . . 0.0 111.894 -178.44 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.609 ' C ' HD12 ' A' ' 61' ' ' LEU . 39.2 mmt-85 -122.05 127.22 49.96 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 107.757 -1.201 . . . . 0.0 107.757 177.141 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.609 HD12 ' C ' ' A' ' 60' ' ' ARG . 9.0 mp -112.07 151.23 29.63 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.945 0.402 . . . . 0.0 111.21 -178.447 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 9.4 m-85 -131.32 108.45 9.66 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.447 179.471 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.543 ' C ' HD13 ' A' ' 63' ' ' LEU . 2.1 tm? -103.93 -84.58 0.47 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.65 -0.704 . . . . 0.0 109.232 179.521 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.434 ' H ' ' HB ' ' A' ' 67' ' ' VAL . . . -76.09 175.96 51.94 Favored Glycine 0 CA--C 1.521 0.438 0 N-CA-C 108.76 -1.736 . . . . 0.0 108.76 178.065 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 9.8 mt -72.5 -32.64 66.33 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 119.537 -0.865 . . . . 0.0 110.103 -179.557 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -102.84 9.53 38.88 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 122.912 0.485 . . . . 0.0 111.034 -179.842 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' VAL . . . . . 0.55 ' O ' HG12 ' A' ' 67' ' ' VAL . 9.1 t -106.71 96.61 4.76 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.343 0 CA-C-O 121.4 0.619 . . . . 0.0 111.738 -179.108 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 6.4 tp -112.24 117.35 32.29 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 108.032 -1.099 . . . . 0.0 108.032 178.168 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.405 HG23 ' HB2' ' A' ' 94' ' ' SER . 5.7 mt -112.55 143.43 22.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.86 0.362 . . . . 0.0 111.222 -178.648 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.412 ' HD2' HH11 ' A' ' 70' ' ' ARG . 11.1 mtm180 -128.05 130.65 48.6 Favored 'General case' 0 C--O 1.238 0.463 0 CA-C-O 121.224 0.535 . . . . 0.0 111.346 179.715 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 2.4 mtp -140.28 148.56 41.62 Favored 'General case' 0 C--N 1.334 -0.1 0 CA-C-N 115.535 -0.757 . . . . 0.0 109.881 179.666 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 27.8 tt0 -106.51 125.54 51.12 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 107.793 -1.188 . . . . 0.0 107.793 177.997 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.592 HD12 ' CB ' ' A' ' 85' ' ' PHE . 9.9 pt -133.09 160.26 42.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 N-CA-C 113.279 0.844 . . . . 0.0 113.279 -176.945 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 37.6 m -121.67 151.87 39.98 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 114.564 -1.198 . . . . 0.0 109.357 178.763 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.588 HD12 ' CE1' ' A' ' 85' ' ' PHE . 6.3 tp -67.09 123.02 19.08 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.297 0.57 . . . . 0.0 110.5 -179.679 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -97.81 -41.84 7.86 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 115.146 -0.934 . . . . 0.0 110.667 178.241 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 77' ' ' TRP . . . . . 0.587 ' NE1' ' HA3' ' A' ' 84' ' ' GLY . 67.5 p-90 -170.51 168.64 7.66 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.356 -179.349 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -147.46 123.87 10.98 Favored 'General case' 0 N--CA 1.465 0.299 0 N-CA-C 109.95 -0.389 . . . . 0.0 109.95 178.67 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 38.6 ttt180 -152.3 133.76 14.52 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 119.944 -0.703 . . . . 0.0 112.826 179.931 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 80' ' ' ASP . . . . . 0.452 ' O ' ' OD1' ' A' ' 80' ' ' ASP . 33.4 t0 56.98 47.22 18.04 Favored 'General case' 0 N--CA 1.463 0.181 0 N-CA-C 113.951 1.093 . . . . 0.0 113.951 176.585 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 82.29 -27.42 3.62 Favored Glycine 0 CA--C 1.524 0.597 0 C-N-CA 120.397 -0.906 . . . . 0.0 113.162 177.28 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 6.9 mt -89.5 156.73 18.45 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 117.672 0.736 . . . . 0.0 110.447 -179.084 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 36.2 mt -128.88 135.51 49.17 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.202 -179.282 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 84' ' ' GLY . . . . . 0.587 ' HA3' ' NE1' ' A' ' 77' ' ' TRP . . . -96.18 153.19 20.46 Favored Glycine 0 N--CA 1.45 -0.424 0 N-CA-C 109.576 -1.409 . . . . 0.0 109.576 178.692 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 85' ' ' PHE . . . . . 0.592 ' CB ' HD12 ' A' ' 73' ' ' ILE . 26.6 m-85 -145.62 132.36 20.0 Favored 'General case' 0 C--N 1.317 -0.808 0 C-N-CA 120.792 -0.363 . . . . 0.0 110.733 -179.298 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.421 ' O ' ' CG ' ' A' ' 86' ' ' GLU . 6.5 pt-20 -103.66 126.21 50.66 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 108.632 -0.877 . . . . 0.0 108.632 179.059 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 87' ' ' CYS . . . . . 0.455 ' HA ' HG22 ' A' ' 73' ' ' ILE . 7.8 t -64.55 119.6 10.77 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 112.278 0.473 . . . . 0.0 112.278 -177.984 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 10.3 mm100 -89.32 -37.82 14.62 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.693 179.323 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 89' ' ' HIS . . . . . 0.412 ' ND1' ' N ' ' A' ' 90' ' ' ILE . 0.0 OUTLIER -164.66 144.85 7.55 Favored 'General case' 0 C--O 1.222 -0.375 0 CA-C-N 115.716 -0.674 . . . . 0.0 109.82 179.928 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.535 HG23 ' CG1' ' A' ' 95' ' ' ILE . 7.2 tt -143.81 140.45 25.47 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-O 121.407 0.623 . . . . 0.0 110.063 -179.814 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 91' ' ' ASP . . . . . 0.503 ' CB ' ' OG ' ' A' ' 94' ' ' SER . 0.2 OUTLIER -57.38 141.08 48.46 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 115.001 -1.0 . . . . 0.0 112.084 -178.001 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.48 ' HA ' HD12 ' A' ' 95' ' ' ILE . 3.2 tp -54.36 -42.06 69.85 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.254 -0.885 . . . . 0.0 110.403 -179.84 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -65.1 -42.94 93.55 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 179.295 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 94' ' ' SER . . . . . 0.503 ' OG ' ' CB ' ' A' ' 91' ' ' ASP . 1.1 p -66.86 -35.45 80.07 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.718 179.184 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 95' ' ' ILE . . . . . 0.535 ' CG1' HG23 ' A' ' 90' ' ' ILE . 31.3 mt -58.73 -38.33 71.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.248 179.769 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -69.79 -37.7 76.41 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 119.876 -0.73 . . . . 0.0 111.422 -177.945 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 37.7 m80 . . . . . 0 C--N 1.326 -0.435 0 C-N-CA 119.567 -0.853 . . . . 0.0 109.578 179.767 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.652 ' H2 ' HE22 ' A' ' 4' ' ' GLN . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.613 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.549 ' H ' ' CD ' ' A' ' 4' ' ' GLN . 39.9 t -101.97 -119.45 0.18 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.385 -0.371 . . . . 0.0 110.363 179.964 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ASP . . . . . 0.407 ' N ' ' OG ' ' A' ' 2' ' ' SER . 6.0 m-20 -92.85 26.95 2.54 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.916 179.828 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.679 ' O ' ' N ' ' A' ' 6' ' ' ASP . 0.0 OUTLIER -112.78 -18.02 12.4 Favored 'General case' 0 N--CA 1.463 0.188 0 C-N-CA 120.83 -0.348 . . . . 0.0 110.56 179.517 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 5' ' ' HIS . . . . . 0.645 ' N ' HE21 ' A' ' 4' ' ' GLN . 0.6 OUTLIER 31.43 27.77 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 120.99 0.424 . . . . 0.0 110.793 -179.719 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ASP . . . . . 0.679 ' N ' ' O ' ' A' ' 4' ' ' GLN . 36.2 m-20 43.43 74.57 0.11 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.384 -179.93 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -82.1 128.12 33.81 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.731 -179.393 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.628 ' NH2' ' N11' ' A' ' 501' ' ' C2E . 0.0 OUTLIER -124.88 -6.22 7.36 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 116.037 -0.528 . . . . 0.0 112.119 -179.065 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.67 ' O ' ' N ' ' A' ' 11' ' ' PHE . 1.1 ptt85 -108.27 88.79 2.81 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 120.684 -0.406 . . . . 0.0 110.212 179.811 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.569 ' C ' ' O ' ' A' ' 9' ' ' ARG . 0.0 OUTLIER 8.79 -71.28 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 115.21 -0.904 . . . . 0.0 111.608 -179.714 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 11' ' ' PHE . . . . . 0.67 ' N ' ' O ' ' A' ' 9' ' ' ARG . 1.5 m-85 -124.85 158.37 33.61 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 121.155 0.502 . . . . 0.0 111.235 -179.782 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' HIS . . . . . 0.621 ' CD2' ' H ' ' A' ' 12' ' ' HIS . 6.7 m-70 -54.48 -172.38 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.242 179.828 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.549 ' NH1' ' C6 ' ' A' ' 501' ' ' C2E . 31.7 mtm180 -135.95 127.06 27.98 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.068 179.892 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.646 ' N ' HD12 ' A' ' 14' ' ' ILE . 1.8 mp -46.5 100.06 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.093 179.874 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -95.02 120.16 34.76 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.338 0.59 . . . . 0.0 111.262 -179.675 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 5.1 p90 -150.25 158.92 44.68 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 177.668 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ASP . . . . . 0.437 ' OD1' ' N ' ' A' ' 17' ' ' ASP . 0.1 OUTLIER -95.49 146.03 24.74 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 120.304 -0.558 . . . . 0.0 110.858 -179.028 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -178.49 176.56 1.02 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.783 179.148 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -96.54 133.63 40.76 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.023 -179.454 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.538 ' O ' ' O ' ' A' ' 31' ' ' VAL . 4.9 p -132.51 149.9 52.25 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.316 0.579 . . . . 0.0 110.201 178.378 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 12.5 mm-40 -131.0 138.97 49.92 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.435 -0.802 . . . . 0.0 108.838 179.708 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 1.1 mm -120.27 136.39 57.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-O 121.282 0.563 . . . . 0.0 110.704 -179.374 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.712 ' H ' HD12 ' A' ' 23' ' ' LEU . 0.0 OUTLIER -126.12 123.4 38.23 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.393 -0.821 . . . . 0.0 111.014 -179.133 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.691 ' NE2' ' CE2' ' A' ' 57' ' ' PHE . 9.2 tt0 -129.35 102.18 6.31 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.094 -0.957 . . . . 0.0 109.676 178.826 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 80.3 -127.33 7.88 Favored Glycine 0 CA--C 1.524 0.606 0 N-CA-C 109.94 -1.264 . . . . 0.0 109.94 -178.97 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -100.22 11.32 39.66 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.833 0.349 . . . . 0.0 110.179 179.586 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.579 ' HB3' ' CZ2' ' A' ' 29' ' ' TRP . 35.4 mtt180 -113.14 133.82 54.85 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 112.423 0.527 . . . . 0.0 112.423 -178.34 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.439 ' HG2' ' N ' ' A' ' 29' ' ' TRP . 17.2 ttt180 -128.35 149.22 50.61 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.582 179.786 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.579 ' CZ2' ' HB3' ' A' ' 27' ' ' ARG . 6.8 m-90 -146.7 155.79 42.68 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.505 -179.286 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.539 ' OE1' ' N ' ' A' ' 30' ' ' GLU . 1.9 mp0 -100.56 135.44 42.0 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.774 179.459 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.538 ' O ' ' O ' ' A' ' 20' ' ' SER . 15.4 m -145.61 157.33 12.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-O 121.315 0.579 . . . . 0.0 111.026 -179.612 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 1.057 ' H ' HD23 ' A' ' 32' ' ' LEU . 1.5 pt? -96.86 130.57 44.12 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 178.759 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -91.97 125.0 36.5 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.278 0.561 . . . . 0.0 109.908 -179.512 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 69.6 m-70 -91.4 -28.54 17.61 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.307 -0.861 . . . . 0.0 111.662 -178.695 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 -172.66 161.07 4.76 Favored 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 119.484 -0.886 . . . . 0.0 111.08 177.577 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.531 HG22 ' H ' ' A' ' 37' ' ' SER . 4.6 p -145.56 169.08 7.3 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.243 -178.894 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.531 ' H ' HG22 ' A' ' 36' ' ' VAL . 32.1 t -142.18 169.59 17.31 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 107.894 -1.15 . . . . 0.0 107.894 178.348 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 2.6 mt -66.36 -0.82 2.88 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 119.793 -0.763 . . . . 0.0 110.856 -179.461 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' HIS . . . . . 0.546 ' CE1' ' O ' ' A' ' 87' ' ' CYS . 36.3 t60 -159.72 40.17 0.2 Allowed 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 120.664 -0.415 . . . . 0.0 111.472 -179.908 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' GLY . . . . . 0.483 ' HA3' ' N3 ' ' A' ' 501' ' ' C2E . . . -179.83 157.74 20.82 Favored Glycine 0 CA--C 1.525 0.681 0 N-CA-C 111.021 -0.832 . . . . 0.0 111.021 179.803 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -148.47 148.83 15.67 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.259 0 CA-C-O 121.382 0.61 . . . . 0.0 111.628 -178.804 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.491 HD23 ' N ' ' A' ' 43' ' ' VAL . 1.0 OUTLIER -121.95 137.4 54.81 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 115.016 -0.993 . . . . 0.0 108.759 178.664 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.491 ' N ' HD23 ' A' ' 42' ' ' LEU . 32.7 m -141.98 174.53 6.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-O 121.214 0.531 . . . . 0.0 111.534 -179.447 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -96.43 145.48 17.85 Favored Glycine 0 CA--C 1.528 0.882 0 N-CA-C 109.506 -1.438 . . . . 0.0 109.506 178.39 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' GLN . . . . . 0.463 ' O ' ' OE1' ' A' ' 45' ' ' GLN . 1.9 tm0? -86.86 115.19 61.62 Favored Pre-proline 0 N--CA 1.464 0.235 0 CA-C-N 117.88 0.84 . . . . 0.0 111.838 -178.492 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 97.4 Cg_endo -84.92 160.55 11.86 Favored 'Trans proline' 0 C--N 1.307 -1.613 0 C-N-CA 121.51 1.473 . . . . 0.0 111.22 178.715 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.491 ' N ' ' CD ' ' A' ' 47' ' ' GLN . 12.4 mp0 -65.33 -40.4 93.66 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 112.422 0.527 . . . . 0.0 112.422 -178.677 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.549 ' O ' ' N ' ' A' ' 50' ' ' ASN . 46.8 t0 -73.09 8.37 1.65 Allowed 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 111.89 0.33 . . . . 0.0 111.89 -178.592 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' TRP . . . . . 0.444 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 60.6 t-105 -59.3 69.62 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 111.828 0.307 . . . . 0.0 111.828 -179.579 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' ASN . . . . . 0.549 ' N ' ' O ' ' A' ' 48' ' ' ASP . 0.5 OUTLIER -93.21 79.06 4.5 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 120.439 -0.505 . . . . 0.0 110.024 178.909 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -142.94 161.25 27.54 Favored Glycine 0 CA--C 1.526 0.765 0 N-CA-C 111.417 -0.673 . . . . 0.0 111.417 -179.44 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -95.44 109.94 48.08 Favored Pre-proline 0 CA--C 1.535 0.366 0 N-CA-C 110.512 -0.181 . . . . 0.0 110.512 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 78.7 Cg_exo -46.32 -22.98 1.8 Allowed 'Trans proline' 0 N--CA 1.498 1.769 0 C-N-CA 122.713 2.275 . . . . 0.0 112.813 -179.785 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 3.4 mm100 -79.86 -24.23 41.4 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 120.354 -0.539 . . . . 0.0 111.652 -178.718 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.578 ' O ' ' CE1' ' A' ' 57' ' ' PHE . 82.1 mtt180 -92.15 148.81 37.49 Favored Pre-proline 0 C--N 1.33 -0.246 0 C-N-CA 120.721 -0.391 . . . . 0.0 110.403 -179.978 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' PRO . . . . . 0.575 ' O ' ' NE2' ' A' ' 24' ' ' GLN . 29.8 Cg_endo -63.23 160.87 32.79 Favored 'Trans proline' 0 N--CA 1.497 1.724 0 C-N-CA 123.07 2.514 . . . . 0.0 113.436 -178.761 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.691 ' CE2' ' NE2' ' A' ' 24' ' ' GLN . 49.0 m-85 -131.12 157.3 43.49 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 114.971 -1.013 . . . . 0.0 109.161 179.419 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.6 ' O ' HD12 ' A' ' 23' ' ' LEU . 64.8 mt-10 -122.21 138.46 54.47 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 178.245 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -118.98 137.08 53.76 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.316 0.487 . . . . 0.0 112.316 -178.116 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.622 ' HG3' HD11 ' A' ' 23' ' ' LEU . 9.4 mtm180 -123.11 127.73 49.13 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 108.379 -0.971 . . . . 0.0 108.379 177.237 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.556 HD23 ' C ' ' A' ' 60' ' ' ARG . 0.4 OUTLIER -109.88 144.16 38.75 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 120.638 -0.425 . . . . 0.0 110.736 -178.898 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 62' ' ' TYR . . . . . 0.431 ' N ' ' CD1' ' A' ' 62' ' ' TYR . 14.3 m-85 -125.47 109.47 12.75 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.694 179.862 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -106.17 -85.87 0.49 Allowed 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.39 -0.823 . . . . 0.0 109.488 179.579 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.413 ' H ' ' HB ' ' A' ' 67' ' ' VAL . . . -74.65 176.06 48.89 Favored Glycine 0 CA--C 1.521 0.428 0 N-CA-C 109.168 -1.573 . . . . 0.0 109.168 178.46 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.409 HD23 ' N ' ' A' ' 65' ' ' LEU . 2.0 mt -73.12 -33.18 65.39 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 119.667 -0.813 . . . . 0.0 110.011 -179.587 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 51.4 t0 -102.35 8.82 40.17 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.869 179.858 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.54 ' O ' HG12 ' A' ' 67' ' ' VAL . 13.2 t -106.05 96.68 4.81 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.283 0 CA-C-O 121.364 0.602 . . . . 0.0 111.833 -178.832 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 7.9 tp -113.04 117.4 31.92 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 107.977 -1.12 . . . . 0.0 107.977 178.089 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.485 HG23 ' CB ' ' A' ' 94' ' ' SER . 8.5 mt -111.64 142.54 23.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-O 120.909 0.385 . . . . 0.0 110.881 -178.541 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 26.3 ttp180 -128.49 130.64 47.8 Favored 'General case' 0 C--O 1.24 0.553 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.343 179.824 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' MET . . . . . 0.783 ' SD ' HD12 ' A' ' 90' ' ' ILE . 1.4 mtm -139.42 147.63 41.69 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.739 -0.664 . . . . 0.0 109.575 179.238 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 22.0 tt0 -104.75 124.5 49.52 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 107.529 -1.286 . . . . 0.0 107.529 178.273 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.405 HG22 ' HA ' ' A' ' 87' ' ' CYS . 2.7 pt -134.34 160.75 41.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 C-N-CA 119.673 -0.811 . . . . 0.0 113.0 -177.162 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 35.5 m -121.13 152.2 39.0 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.057 -0.974 . . . . 0.0 109.46 178.804 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.59 HD12 ' CE1' ' A' ' 85' ' ' PHE . 10.2 tp -66.44 123.36 19.8 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.274 0.559 . . . . 0.0 109.97 -179.659 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -97.68 -41.7 7.98 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.854 178.373 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' TRP . . . . . 0.554 ' NE1' ' HA3' ' A' ' 84' ' ' GLY . 65.9 p-90 -171.22 165.04 7.3 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.556 -179.121 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -143.59 123.98 13.89 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 109.622 -0.511 . . . . 0.0 109.622 178.437 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 6.7 ttt180 -152.1 133.46 14.5 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 119.634 -0.826 . . . . 0.0 112.96 179.868 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 3.6 t70 57.01 47.03 18.32 Favored 'General case' 0 N--CA 1.462 0.139 0 N-CA-C 113.735 1.013 . . . . 0.0 113.735 176.804 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 82.56 -26.68 3.98 Favored Glycine 0 CA--C 1.523 0.532 0 C-N-CA 120.445 -0.883 . . . . 0.0 113.263 177.238 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.405 ' N ' HD23 ' A' ' 82' ' ' LEU . 5.0 mt -89.66 159.21 17.24 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 117.631 0.715 . . . . 0.0 110.362 -179.11 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 44.0 mt -132.0 135.73 46.75 Favored 'General case' 0 CA--C 1.516 -0.356 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.344 -179.16 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' GLY . . . . . 0.554 ' HA3' ' NE1' ' A' ' 77' ' ' TRP . . . -102.58 154.0 18.39 Favored Glycine 0 N--CA 1.452 -0.278 0 N-CA-C 109.758 -1.337 . . . . 0.0 109.758 178.714 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 85' ' ' PHE . . . . . 0.59 ' CE1' HD12 ' A' ' 75' ' ' LEU . 50.5 m-85 -145.36 136.55 24.89 Favored 'General case' 0 C--N 1.318 -0.763 0 C-N-CA 120.921 -0.312 . . . . 0.0 110.45 -179.66 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -104.01 128.96 51.6 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 179.53 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' CYS . . . . . 0.546 ' O ' ' CE1' ' A' ' 39' ' ' HIS . 42.9 t -69.38 120.45 15.2 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 112.378 0.51 . . . . 0.0 112.378 -178.237 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 7.5 mm100 -94.58 -34.79 12.51 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.075 178.935 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' HIS . . . . . 0.449 ' ND1' ' C ' ' A' ' 89' ' ' HIS . 0.0 OUTLIER -161.41 141.89 10.9 Favored 'General case' 0 C--O 1.223 -0.338 0 CA-C-N 116.187 -0.46 . . . . 0.0 109.848 179.761 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.783 HD12 ' SD ' ' A' ' 71' ' ' MET . 6.0 tt -145.04 140.9 23.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-O 121.332 0.587 . . . . 0.0 110.465 -178.833 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -56.9 142.86 39.78 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 115.153 -0.931 . . . . 0.0 112.297 -178.455 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 5.0 tp -54.28 -42.04 69.57 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 114.892 -1.049 . . . . 0.0 110.319 -179.343 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 26.3 t0 -68.3 -42.65 79.15 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.04 179.603 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' SER . . . . . 0.485 ' CB ' HG23 ' A' ' 69' ' ' ILE . 14.8 m -60.07 -38.39 82.7 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.062 179.5 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 50.8 mt -58.79 -38.46 72.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.317 179.913 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -70.97 -40.79 71.73 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.235 -0.586 . . . . 0.0 111.157 -179.204 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 97' ' ' HIS . . . . . 0.513 ' O ' HD23 ' A' ' 101' ' ' LEU . 60.0 m-70 -61.52 -34.86 76.26 Favored 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 119.177 -1.009 . . . . 0.0 108.704 179.87 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.598 ' O ' HD13 ' A' ' 98' ' ' LEU . 0.2 OUTLIER -67.2 -34.03 76.64 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 108.592 -0.892 . . . . 0.0 108.592 177.09 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.412 ' O ' ' OE2' ' A' ' 103' ' ' GLU . 3.4 mtt180 -66.02 -41.23 91.24 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 177.933 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 100' ' ' ARG . . . . . 0.483 ' NH2' ' ND1' ' A' ' 97' ' ' HIS . 26.3 mtm180 -59.77 -42.98 94.51 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.632 178.585 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.513 HD23 ' O ' ' A' ' 97' ' ' HIS . 3.9 mm? -64.53 -39.5 93.88 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.022 -0.535 . . . . 0.0 109.971 -179.476 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 102' ' ' VAL . . . . . 0.442 HG23 ' O ' ' A' ' 98' ' ' LEU . 77.4 t -68.61 -43.56 83.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.99 179.759 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 103' ' ' GLU . . . . . 0.563 ' N ' ' OE1' ' A' ' 103' ' ' GLU . 0.2 OUTLIER -62.76 -47.66 82.57 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.528 -179.179 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 14.4 mt -66.31 -38.56 88.01 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.814 -0.354 . . . . 0.0 110.702 -179.452 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 15.3 m120 -70.45 -26.26 63.56 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.611 179.975 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 3.7 tt -63.83 -43.72 95.36 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.206 -0.452 . . . . 0.0 109.983 179.759 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 94.97 -107.11 3.5 Favored Glycine 0 CA--C 1.523 0.578 0 N-CA-C 110.592 -1.003 . . . . 0.0 110.592 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -163.91 -177.17 4.94 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.704 0.288 . . . . 0.0 110.314 179.817 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -45.34 143.31 1.8 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.446 179.918 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 4.5 pt-20 -145.28 -168.67 3.01 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.556 -179.857 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 111' ' ' LEU . . . . . 0.538 ' C ' ' H ' ' A' ' 113' ' ' GLU . 1.1 mp -114.09 -130.79 0.31 Allowed 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.82 -179.621 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.647 ' O ' ' N ' ' A' ' 114' ' ' ARG . 7.9 mt 59.17 -1.07 0.13 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.743 -179.833 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 113' ' ' GLU . . . . . 0.557 ' O ' ' N ' ' A' ' 116' ' ' LEU . 4.5 mm-40 36.06 -83.22 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.353 179.798 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 114' ' ' ARG . . . . . 0.701 ' H ' ' CD ' ' A' ' 114' ' ' ARG . 8.5 mpt_? -24.0 -68.43 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.457 -179.533 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 43.2 mm-40 -39.65 -43.88 1.42 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.947 -179.646 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.557 ' N ' ' O ' ' A' ' 113' ' ' GLU . 6.0 tp -67.21 -42.44 84.12 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.838 -179.945 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 117' ' ' ALA . . . . . 0.678 ' O ' HG23 ' A' ' 120' ' ' VAL . . . -68.97 -23.06 64.08 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.234 179.67 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 58.0 mt -53.71 -30.35 43.37 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 120.808 -0.357 . . . . 0.0 110.462 -178.841 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 21.5 mt -57.63 -24.91 59.04 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 178.989 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 120' ' ' VAL . . . . . 0.678 HG23 ' O ' ' A' ' 117' ' ' ALA . 63.7 t -58.39 -43.72 87.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 115.397 -0.819 . . . . 0.0 111.571 -179.782 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 54.3 p -65.61 -11.32 43.38 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 112.273 0.471 . . . . 0.0 112.273 -178.023 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -111.02 -86.9 0.54 Allowed 'General case' 0 N--CA 1.464 0.246 0 C-N-CA 120.314 -0.554 . . . . 0.0 111.72 -179.471 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 123' ' ' HIS . . . . . 0.729 ' CG ' ' H ' ' A' ' 124' ' ' ASP . 5.0 t-80 -127.58 -154.55 0.64 Allowed 'General case' 0 N--CA 1.464 0.249 0 CA-C-O 121.213 0.53 . . . . 0.0 112.297 -178.526 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 124' ' ' ASP . . . . . 0.729 ' H ' ' CG ' ' A' ' 123' ' ' HIS . 99.4 m-20 27.9 51.66 0.05 OUTLIER 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 114.965 -1.016 . . . . 0.0 111.027 -179.319 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 125' ' ' ASP . . . . . 0.473 ' OXT' HG13 ' A' ' 120' ' ' VAL . 1.8 m-20 . . . . . 0 C--O 1.22 -0.468 0 CA-C-O 118.057 -0.973 . . . . 0.0 110.742 179.312 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 501' ' ' C2E . . . . . 0.944 ' O21' " H4'" ' A' ' 501' ' ' C2E . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 502' ' ' C2E . . . . . 0.556 ' N21' ' ND1' ' A' ' 12' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.44 ' N ' ' SD ' ' A' ' 1' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.555 0 N-CA-C 109.341 -0.614 . . . . 0.0 109.341 . . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.448 ' O ' ' NE2' ' A' ' 4' ' ' GLN . 3.5 m -166.76 43.59 0.06 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.719 -179.89 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -99.45 107.64 19.9 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 178.353 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.818 ' O ' ' CD2' ' A' ' 5' ' ' HIS . 1.1 mp0 -113.92 -20.35 11.1 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.148 -0.933 . . . . 0.0 109.724 178.308 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' HIS . . . . . 0.818 ' CD2' ' O ' ' A' ' 4' ' ' GLN . 0.7 OUTLIER 117.28 7.33 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.516 0 O-C-N 124.41 1.069 . . . . 0.0 109.438 -179.628 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 6' ' ' ASP . . . . . 0.443 ' O ' ' O ' ' A' ' 5' ' ' HIS . 78.9 m-20 -37.96 158.29 0.01 OUTLIER 'General case' 0 C--O 1.231 0.107 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.42 -179.586 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.635 ' H ' ' CD ' ' A' ' 7' ' ' GLU . 0.7 OUTLIER -95.04 134.7 37.44 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.162 0.506 . . . . 0.0 111.701 -178.945 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.619 ' NH2' ' N11' ' A' ' 501' ' ' C2E . 0.0 OUTLIER -120.68 -7.7 9.57 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.558 179.763 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.706 ' O ' ' N ' ' A' ' 11' ' ' PHE . 2.6 ptt180 -108.64 93.61 4.61 Favored 'General case' 0 N--CA 1.464 0.266 0 N-CA-C 109.667 -0.494 . . . . 0.0 109.667 179.613 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.611 HH21 ' P11' ' A' ' 501' ' ' C2E . 0.3 OUTLIER 17.76 -73.75 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 115.208 -0.906 . . . . 0.0 111.758 -179.276 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 11' ' ' PHE . . . . . 0.706 ' N ' ' O ' ' A' ' 9' ' ' ARG . 10.1 m-85 -150.61 168.65 23.66 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-O 120.815 0.34 . . . . 0.0 110.587 179.581 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 7.4 p-80 -44.51 130.85 6.71 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.043 -179.841 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.58 ' NH1' ' C6 ' ' A' ' 501' ' ' C2E . 0.1 OUTLIER -89.02 149.22 23.35 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.212 179.583 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 12.2 mm -48.8 86.04 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.085 179.507 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.562 ' N ' ' O ' ' A' ' 13' ' ' ARG . . . -93.67 120.55 34.08 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.506 0.669 . . . . 0.0 111.714 -179.221 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 2.9 p90 -149.37 156.9 42.78 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 114.803 -1.09 . . . . 0.0 108.2 178.298 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -95.51 146.18 24.63 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 120.009 -0.676 . . . . 0.0 110.82 -179.106 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . 179.57 176.75 0.63 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.065 179.865 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -96.47 134.23 39.92 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.731 -179.659 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.508 ' O ' ' O ' ' A' ' 31' ' ' VAL . 6.5 p -134.06 151.89 51.6 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.16 0.505 . . . . 0.0 110.451 178.914 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 22.8 mm-40 -129.27 144.43 51.22 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.679 -0.691 . . . . 0.0 109.169 179.654 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 75.4 mt -126.9 136.46 60.73 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.326 0 C-N-CA 120.352 -0.539 . . . . 0.0 110.869 -179.782 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -125.46 123.27 38.85 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.538 -0.756 . . . . 0.0 111.256 -178.893 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.548 ' OE1' ' CE2' ' A' ' 57' ' ' PHE . 23.8 tt0 -129.58 102.33 6.32 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.453 -0.794 . . . . 0.0 109.717 178.715 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 80.41 -126.23 7.31 Favored Glycine 0 CA--C 1.523 0.564 0 N-CA-C 109.789 -1.324 . . . . 0.0 109.789 -178.96 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -101.42 11.77 38.54 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.816 0.341 . . . . 0.0 110.277 179.58 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.559 ' HB3' ' CZ2' ' A' ' 29' ' ' TRP . 48.0 mtt180 -114.29 134.18 55.13 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 112.664 0.616 . . . . 0.0 112.664 -178.189 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 56.5 ttt180 -127.88 149.48 50.28 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.421 179.288 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.559 ' CZ2' ' HB3' ' A' ' 27' ' ' ARG . 7.2 m-90 -146.31 156.04 43.07 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.477 -179.568 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -100.7 135.23 42.47 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.585 179.22 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.508 ' O ' ' O ' ' A' ' 20' ' ' SER . 28.9 m -145.73 156.3 12.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 C-N-CA 120.652 -0.419 . . . . 0.0 110.83 -179.663 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.519 ' H ' HD23 ' A' ' 32' ' ' LEU . 0.3 OUTLIER -95.12 130.32 41.87 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 108.518 -0.919 . . . . 0.0 108.518 178.429 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.5 tt -90.1 126.01 35.63 Favored 'General case' 0 C--N 1.325 -0.492 0 C-N-CA 120.203 -0.599 . . . . 0.0 110.179 -179.478 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' HIS . . . . . 0.408 ' NE2' HD12 ' A' ' 32' ' ' LEU . 79.3 m-70 -90.29 -30.98 17.15 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.055 -0.975 . . . . 0.0 111.704 -178.811 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -173.67 162.31 4.08 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 119.632 -0.827 . . . . 0.0 111.434 178.303 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.536 HG22 ' H ' ' A' ' 37' ' ' SER . 4.1 p -144.75 168.77 9.21 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.112 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.117 -179.549 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.536 ' H ' HG22 ' A' ' 36' ' ' VAL . 18.8 t -142.33 167.27 22.49 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 107.402 -1.333 . . . . 0.0 107.402 178.262 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.527 ' H ' HD12 ' A' ' 38' ' ' LEU . 1.7 mp -62.42 1.4 0.35 Allowed 'General case' 0 C--N 1.322 -0.588 0 C-N-CA 119.412 -0.915 . . . . 0.0 110.635 -179.483 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' HIS . . . . . 0.483 ' H ' ' C ' ' A' ' 37' ' ' SER . 0.0 OUTLIER -168.34 44.89 0.04 OUTLIER 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 120.655 -0.418 . . . . 0.0 111.338 179.868 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -177.71 150.44 9.99 Favored Glycine 0 CA--C 1.527 0.782 0 N-CA-C 110.573 -1.011 . . . . 0.0 110.573 179.768 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.588 HG21 HG21 ' A' ' 73' ' ' ILE . 0.1 OUTLIER -147.02 148.65 16.45 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.222 0 CA-C-O 121.317 0.579 . . . . 0.0 111.656 -179.082 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.529 HD23 ' N ' ' A' ' 43' ' ' VAL . 1.1 tt -121.87 139.69 53.32 Favored 'General case' 0 N--CA 1.464 0.262 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 178.596 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.529 ' N ' HD23 ' A' ' 42' ' ' LEU . 18.8 m -143.72 175.15 3.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 C-N-CA 120.129 -0.628 . . . . 0.0 112.058 -178.8 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -98.13 143.98 16.99 Favored Glycine 0 CA--C 1.528 0.853 0 N-CA-C 109.224 -1.55 . . . . 0.0 109.224 177.845 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' GLN . . . . . 0.499 ' O ' ' CD ' ' A' ' 45' ' ' GLN . 0.0 OUTLIER -86.25 120.16 72.11 Favored Pre-proline 0 CA--C 1.532 0.262 0 CA-C-N 118.075 0.938 . . . . 0.0 112.046 -178.224 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_endo -86.24 159.64 9.83 Favored 'Trans proline' 0 C--N 1.308 -1.564 0 C-N-CA 121.797 1.665 . . . . 0.0 110.906 178.278 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 65.7 mt-30 -65.38 -40.23 93.25 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.315 0.487 . . . . 0.0 112.315 -178.936 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.554 ' O ' ' NE1' ' A' ' 29' ' ' TRP . 29.5 m-20 -73.59 8.4 1.87 Allowed 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 111.975 0.361 . . . . 0.0 111.975 -178.71 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' TRP . . . . . 0.445 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 58.9 t-105 -59.51 69.57 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 111.914 0.338 . . . . 0.0 111.914 -179.308 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' ASN . . . . . 0.551 ' N ' ' O ' ' A' ' 48' ' ' ASP . 26.7 t-20 -93.39 78.92 4.41 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 120.159 -0.616 . . . . 0.0 109.953 178.729 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -142.88 159.93 27.42 Favored Glycine 0 CA--C 1.524 0.632 0 N-CA-C 111.548 -0.621 . . . . 0.0 111.548 -179.647 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -94.2 111.25 52.65 Favored Pre-proline 0 CA--C 1.536 0.422 0 CA-C-N 115.543 -0.329 . . . . 0.0 110.744 -179.817 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_exo -47.99 -23.31 4.21 Favored 'Trans proline' 0 N--CA 1.497 1.721 0 C-N-CA 122.473 2.116 . . . . 0.0 112.366 179.762 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 1.7 mm100 -78.25 -24.01 47.07 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.782 -178.96 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.558 ' O ' ' CE1' ' A' ' 57' ' ' PHE . 44.3 mtp85 -94.54 148.9 35.72 Favored Pre-proline 0 C--N 1.331 -0.232 0 C-N-CA 120.598 -0.441 . . . . 0.0 110.138 179.94 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' PRO . . . . . 0.423 ' O ' ' OE1' ' A' ' 24' ' ' GLN . 31.1 Cg_endo -63.43 160.82 33.74 Favored 'Trans proline' 0 N--CA 1.494 1.527 0 C-N-CA 122.93 2.42 . . . . 0.0 113.337 -178.598 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.558 ' CE1' ' O ' ' A' ' 55' ' ' ARG . 34.2 m-85 -130.5 158.42 39.99 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 114.8 -1.091 . . . . 0.0 108.922 179.346 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 69.3 mt-10 -121.39 135.34 55.08 Favored 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 108.644 -0.873 . . . . 0.0 108.644 178.175 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' ALA . . . . . 0.563 ' HB2' ' CD1' ' A' ' 73' ' ' ILE . . . -118.02 138.15 52.41 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.281 0.562 . . . . 0.0 111.645 -177.958 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 47.6 mtm180 -124.71 128.11 48.29 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 178.024 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 10.2 mt -107.16 143.0 35.97 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 120.431 -0.508 . . . . 0.0 111.098 -178.522 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' TYR . . . . . 0.473 ' N ' ' CD1' ' A' ' 62' ' ' TYR . 7.7 m-85 -125.93 107.78 10.79 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.242 179.471 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.486 HD23 ' C ' ' A' ' 63' ' ' LEU . 1.9 tt -104.53 -85.37 0.47 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.441 -0.799 . . . . 0.0 109.436 179.688 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.447 ' H ' ' HB ' ' A' ' 67' ' ' VAL . . . -74.23 178.09 44.79 Favored Glycine 0 CA--C 1.522 0.482 0 N-CA-C 109.139 -1.584 . . . . 0.0 109.139 178.403 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.66 HD12 ' N ' ' A' ' 65' ' ' LEU . 7.9 mp -74.63 -31.44 61.98 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 119.846 -0.742 . . . . 0.0 110.151 -179.777 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -103.84 9.5 36.86 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 123.054 0.542 . . . . 0.0 110.798 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.521 ' O ' HG12 ' A' ' 67' ' ' VAL . 20.7 t -105.71 96.06 4.3 Favored 'Isoleucine or valine' 0 C--O 1.234 0.277 0 CA-C-O 121.206 0.527 . . . . 0.0 111.855 -178.929 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 3.8 tp -113.14 117.3 31.55 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 108.128 -1.064 . . . . 0.0 108.128 178.405 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.471 HG23 ' CB ' ' A' ' 94' ' ' SER . 17.7 mm -112.5 143.82 21.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 120.926 0.393 . . . . 0.0 111.049 -178.677 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.473 ' C ' ' HG2' ' A' ' 71' ' ' MET . 59.2 mtp180 -127.64 130.31 48.74 Favored 'General case' 0 C--O 1.239 0.516 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.374 179.3 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 71' ' ' MET . . . . . 0.739 ' SD ' HD12 ' A' ' 90' ' ' ILE . 0.1 OUTLIER -142.4 147.69 36.61 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.223 -0.898 . . . . 0.0 109.476 -179.576 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -102.05 128.89 48.31 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 108.017 -1.105 . . . . 0.0 108.017 178.587 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.588 HG21 HG21 ' A' ' 41' ' ' ILE . 25.9 pt -136.77 157.62 36.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 C-N-CA 119.836 -0.746 . . . . 0.0 112.836 -177.611 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 2.0 p -122.63 155.41 36.42 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 115.068 -0.969 . . . . 0.0 109.414 178.393 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.524 ' CD1' ' CZ ' ' A' ' 85' ' ' PHE . 7.1 tp -70.43 126.13 28.76 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.591 0.71 . . . . 0.0 110.782 -179.752 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -98.36 -43.66 6.84 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 114.515 -1.22 . . . . 0.0 111.138 178.103 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' TRP . . . . . 0.674 ' NE1' ' HA3' ' A' ' 84' ' ' GLY . 69.3 p-90 -167.71 172.4 9.28 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.425 -178.884 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -151.36 123.69 8.32 Favored 'General case' 0 N--CA 1.467 0.39 0 N-CA-C 110.032 -0.358 . . . . 0.0 110.032 178.373 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 61.4 ttt180 -152.58 133.54 14.11 Favored 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 112.91 0.708 . . . . 0.0 112.91 179.842 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 25.7 t0 56.71 47.22 18.66 Favored 'General case' 0 N--CA 1.464 0.229 0 N-CA-C 114.055 1.132 . . . . 0.0 114.055 176.154 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 83.98 -27.51 4.41 Favored Glycine 0 CA--C 1.522 0.529 0 C-N-CA 120.385 -0.912 . . . . 0.0 113.242 177.128 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 4.4 mt -89.52 161.26 16.31 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 117.664 0.732 . . . . 0.0 110.41 -178.994 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.406 HD11 ' CB ' ' A' ' 45' ' ' GLN . 42.3 mt -133.93 135.36 43.52 Favored 'General case' 0 CA--C 1.518 -0.272 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.242 -179.236 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 84' ' ' GLY . . . . . 0.674 ' HA3' ' NE1' ' A' ' 77' ' ' TRP . . . -94.84 152.36 20.47 Favored Glycine 0 N--CA 1.451 -0.331 0 N-CA-C 109.962 -1.255 . . . . 0.0 109.962 178.999 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 85' ' ' PHE . . . . . 0.524 ' CZ ' ' CD1' ' A' ' 75' ' ' LEU . 29.0 m-85 -145.47 133.77 21.75 Favored 'General case' 0 C--N 1.319 -0.754 0 C-N-CA 120.985 -0.286 . . . . 0.0 110.492 -179.602 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -103.8 127.93 51.25 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 108.555 -0.905 . . . . 0.0 108.555 179.242 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' CYS . . . . . 0.565 ' HA ' HG22 ' A' ' 73' ' ' ILE . 2.3 t -67.69 119.89 13.16 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.925 0.393 . . . . 0.0 111.704 -178.595 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 4.4 tp60 -89.33 -36.35 15.59 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.973 179.782 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' HIS . . . . . 0.485 ' C ' ' ND1' ' A' ' 89' ' ' HIS . 0.0 OUTLIER -166.43 147.8 6.45 Favored 'General case' 0 C--O 1.224 -0.237 0 CA-C-N 116.028 -0.533 . . . . 0.0 109.921 179.371 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.739 HD12 ' SD ' ' A' ' 71' ' ' MET . 10.4 tt -145.27 141.1 22.7 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-O 121.418 0.628 . . . . 0.0 110.568 -178.984 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 91' ' ' ASP . . . . . 0.504 ' CB ' ' OG ' ' A' ' 94' ' ' SER . 0.0 OUTLIER -55.6 141.56 37.04 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 115.045 -0.98 . . . . 0.0 112.27 -178.077 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 5.2 tp -54.72 -42.33 71.42 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.192 -0.913 . . . . 0.0 110.294 -179.937 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -68.62 -42.9 77.43 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.264 -0.425 . . . . 0.0 109.93 179.625 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' SER . . . . . 0.504 ' OG ' ' CB ' ' A' ' 91' ' ' ASP . 1.5 p -60.24 -36.32 77.47 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.022 -0.536 . . . . 0.0 109.918 179.303 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 95' ' ' ILE . . . . . 0.412 ' CG1' HG23 ' A' ' 90' ' ' ILE . 38.2 mt -60.35 -38.77 78.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.16 179.894 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -70.44 -37.53 74.39 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 120.342 -0.543 . . . . 0.0 110.852 -178.856 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 97' ' ' HIS . . . . . 0.518 ' O ' ' HB2' ' A' ' 100' ' ' ARG . 67.2 m-70 -66.92 -45.53 77.6 Favored 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 119.666 -0.814 . . . . 0.0 109.385 179.668 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 2.4 tt -61.0 -33.71 73.68 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 177.906 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 9.6 mtt-85 -56.81 -37.06 70.67 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 178.309 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' ARG . . . . . 0.518 ' HB2' ' O ' ' A' ' 97' ' ' HIS . 2.3 mmp_? -56.01 -43.58 77.84 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.178 0.513 . . . . 0.0 109.849 178.517 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.6 HD22 ' N ' ' A' ' 101' ' ' LEU . 3.9 mm? -64.21 -39.29 93.66 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.451 -0.795 . . . . 0.0 111.022 -179.503 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 102' ' ' VAL . . . . . 0.465 ' CG1' ' N ' ' A' ' 103' ' ' GLU . 0.4 OUTLIER -68.3 -46.47 80.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 C-N-CA 120.504 -0.478 . . . . 0.0 110.64 -179.665 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 103' ' ' GLU . . . . . 0.465 ' N ' ' CG1' ' A' ' 102' ' ' VAL . 44.1 mt-10 -66.17 -43.66 86.3 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.723 -179.635 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 10.4 mt -68.31 -40.66 81.63 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 111.991 0.367 . . . . 0.0 111.991 -178.473 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 105' ' ' ASN . . . . . 0.43 ' OD1' ' O ' ' A' ' 102' ' ' VAL . 0.5 OUTLIER -73.94 -26.6 60.58 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.449 -0.5 . . . . 0.0 110.745 -179.542 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 2.1 mt -67.37 -42.61 83.13 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.136 179.783 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 150.88 -83.1 0.17 Allowed Glycine 0 CA--C 1.525 0.708 0 N-CA-C 110.847 -0.901 . . . . 0.0 110.847 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -170.46 123.42 0.67 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.746 0.308 . . . . 0.0 110.508 179.922 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 109' ' ' GLU . . . . . 0.555 ' O ' ' N ' ' A' ' 111' ' ' LEU . 8.0 tp10 66.33 5.72 3.86 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.019 -179.699 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 25.2 tt0 57.49 -74.28 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.789 -0.641 . . . . 0.0 111.085 179.804 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 111' ' ' LEU . . . . . 0.555 ' N ' ' O ' ' A' ' 109' ' ' GLU . 1.8 tp 66.07 114.15 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 -179.377 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.456 HD12 ' N ' ' A' ' 112' ' ' LEU . 9.1 mp 60.04 129.12 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.207 -179.477 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 18.9 mt-10 -43.21 -51.64 6.0 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.808 -179.886 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 114' ' ' ARG . . . . . 0.46 ' HG2' ' H ' ' A' ' 115' ' ' GLU . 11.5 ttm-85 63.45 172.35 0.16 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.226 -179.767 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 115' ' ' GLU . . . . . 0.561 ' O ' ' CE2' ' A' ' 11' ' ' PHE . 11.3 mt-10 56.5 -92.01 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.728 180.0 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 6.9 mt -54.48 -35.48 63.13 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.561 -179.752 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -68.54 -35.58 77.64 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 119.852 -0.739 . . . . 0.0 109.843 179.823 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.435 ' O ' ' O ' ' A' ' 122' ' ' ALA . 19.5 mt -54.14 -49.43 69.23 Favored 'General case' 0 N--CA 1.463 0.175 0 CA-C-N 115.48 -0.782 . . . . 0.0 111.095 -176.802 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 119' ' ' LEU . . . . . 0.418 ' HA ' ' O ' ' A' ' 122' ' ' ALA . 4.8 mt -65.99 -47.97 72.76 Favored 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 120.31 -0.556 . . . . 0.0 110.319 179.865 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 70.9 t -56.99 -47.46 83.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.667 -176.787 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 73.7 m -70.48 -41.11 73.15 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 119.536 -0.866 . . . . 0.0 110.33 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 122' ' ' ALA . . . . . 0.455 ' O ' ' OD2' ' A' ' 124' ' ' ASP . . . -148.77 159.36 44.22 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.834 -0.621 . . . . 0.0 109.855 179.796 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 123' ' ' HIS . . . . . 0.813 ' CG ' ' H ' ' A' ' 124' ' ' ASP . 8.1 p-80 -63.32 -69.74 0.25 Allowed 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 119.666 -0.814 . . . . 0.0 109.399 178.192 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 124' ' ' ASP . . . . . 0.813 ' H ' ' CG ' ' A' ' 123' ' ' HIS . 2.3 m-20 66.65 57.12 0.69 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.229 179.225 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 1.2 p30 . . . . . 0 C--O 1.221 -0.447 0 CA-C-O 117.975 -1.012 . . . . 0.0 110.573 179.639 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 501' ' ' C2E . . . . . 0.619 ' N11' ' NH2' ' A' ' 8' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 502' ' ' C2E . . . . . 0.527 ' C4 ' ' CE2' ' A' ' 77' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.649 ' O ' ' CB ' ' A' ' 2' ' ' SER . 39.7 mtt . . . . . 0 N--CA 1.489 1.513 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.649 ' CB ' ' O ' ' A' ' 1' ' ' MET . 52.8 m 129.21 153.53 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.598 0 O-C-N 123.891 0.744 . . . . 0.0 110.21 179.772 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 8.8 p30 -86.14 28.34 0.83 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.013 0.435 . . . . 0.0 109.991 179.417 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.473 ' O ' ' O ' ' A' ' 5' ' ' HIS . 1.7 tm0? -112.4 2.24 16.34 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.19 179.534 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' HIS . . . . . 0.502 ' CG ' ' O4A' ' A' ' 502' ' ' C2E . 0.1 OUTLIER 50.47 103.66 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.075 179.897 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -40.9 144.5 0.27 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.486 -179.436 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 14.1 pm0 -75.91 135.49 40.1 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.408 0.623 . . . . 0.0 111.136 -179.565 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.861 ' H ' ' C61' ' A' ' 502' ' ' C2E . 0.0 OUTLIER -118.42 -12.71 9.82 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.306 179.404 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.638 ' O ' ' N ' ' A' ' 11' ' ' PHE . 9.3 mtm180 -96.91 76.83 2.75 Favored 'General case' 0 CA--C 1.514 -0.418 0 N-CA-C 109.927 -0.397 . . . . 0.0 109.927 179.914 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.758 ' CZ ' ' H ' ' A' ' 10' ' ' ARG . 0.0 OUTLIER 29.17 -84.56 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.58 -0.737 . . . . 0.0 110.77 179.816 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 11' ' ' PHE . . . . . 0.638 ' N ' ' O ' ' A' ' 9' ' ' ARG . 0.1 OUTLIER -132.7 147.19 52.32 Favored 'General case' 0 CA--C 1.53 0.182 0 N-CA-C 109.878 -0.415 . . . . 0.0 109.878 179.19 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 12' ' ' HIS . . . . . 0.413 ' C ' ' O ' ' A' ' 11' ' ' PHE . 57.1 p-80 -36.25 155.28 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.288 -179.467 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.558 ' CZ ' ' NH1' ' A' ' 9' ' ' ARG . 3.9 mtm180 -111.3 -176.15 2.88 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.394 179.935 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.56 HG13 HG22 ' A' ' 102' ' ' VAL . 41.1 mm -90.66 94.4 4.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.386 179.52 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -91.82 120.22 32.33 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.416 0.627 . . . . 0.0 110.99 179.907 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 3.1 p90 -149.8 158.65 44.37 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.034 -0.984 . . . . 0.0 108.423 178.18 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 3.1 p30 -95.34 144.67 25.7 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 120.184 -0.606 . . . . 0.0 110.051 -179.62 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -177.49 175.7 1.39 Allowed 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 179.697 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -96.37 134.24 39.77 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.704 -179.716 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.542 ' O ' ' O ' ' A' ' 31' ' ' VAL . 10.7 p -134.04 152.7 51.95 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.109 0.481 . . . . 0.0 110.293 178.851 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 12.0 mm-40 -129.5 141.53 50.98 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 179.625 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -122.21 135.72 61.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 C-N-CA 120.096 -0.642 . . . . 0.0 110.371 179.771 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.432 ' H ' HD12 ' A' ' 23' ' ' LEU . 0.1 OUTLIER -126.12 123.15 37.66 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.32 -0.854 . . . . 0.0 110.934 -179.133 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.732 ' NE2' ' CE2' ' A' ' 57' ' ' PHE . 8.7 tt0 -128.79 101.82 6.28 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.245 -0.889 . . . . 0.0 109.678 178.849 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 80.11 -126.77 7.59 Favored Glycine 0 CA--C 1.523 0.55 0 N-CA-C 110.138 -1.185 . . . . 0.0 110.138 -178.999 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -99.65 11.31 39.53 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.844 0.354 . . . . 0.0 110.325 179.57 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.551 ' HB3' ' CZ2' ' A' ' 29' ' ' TRP . 67.7 mtt180 -113.24 134.97 54.32 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 112.422 0.527 . . . . 0.0 112.422 -178.369 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 28.0 ttt180 -129.29 150.62 50.58 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.51 179.65 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.551 ' CZ2' ' HB3' ' A' ' 27' ' ' ARG . 7.0 m-90 -149.0 156.5 42.35 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.675 -178.919 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 14.7 mt-10 -100.28 134.59 42.99 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.003 179.292 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.542 ' O ' ' O ' ' A' ' 20' ' ' SER . 16.8 m -145.9 158.03 12.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 121.104 0.478 . . . . 0.0 111.306 -179.628 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.957 ' H ' HD23 ' A' ' 32' ' ' LEU . 1.4 pt? -97.0 130.21 44.36 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 178.505 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.4 tt -93.29 126.63 38.5 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.27 0.557 . . . . 0.0 109.731 -179.946 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 45.8 m-70 -92.31 -26.09 18.27 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.397 -0.819 . . . . 0.0 111.923 -178.36 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.405 ' OD1' ' CZ ' ' A' ' 13' ' ' ARG . 2.3 p30 -174.24 159.45 3.15 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 119.528 -0.869 . . . . 0.0 111.12 177.652 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.531 HG22 ' N ' ' A' ' 37' ' ' SER . 6.7 p -142.82 168.89 13.14 Favored 'Isoleucine or valine' 0 C--O 1.231 0.099 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.84 -179.178 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.531 ' N ' HG22 ' A' ' 36' ' ' VAL . 22.9 t -142.36 169.15 18.12 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 107.889 -1.152 . . . . 0.0 107.889 178.926 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 91.4 mt -66.23 -1.25 3.12 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 119.642 -0.823 . . . . 0.0 110.941 -179.438 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' HIS . . . . . 0.513 ' NE2' ' O ' ' A' ' 87' ' ' CYS . 3.7 t60 -161.32 38.98 0.14 Allowed 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 120.839 -0.344 . . . . 0.0 111.179 -179.847 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' GLY . . . . . 0.491 ' HA3' ' N3 ' ' A' ' 501' ' ' C2E . . . -175.77 154.67 17.98 Favored Glycine 0 CA--C 1.527 0.825 0 N-CA-C 110.929 -0.868 . . . . 0.0 110.929 179.88 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -148.04 148.87 15.82 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.345 0 CA-C-O 121.389 0.614 . . . . 0.0 111.809 -178.87 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.694 HD23 ' N ' ' A' ' 43' ' ' VAL . 1.8 tt -122.22 140.85 52.11 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 115.088 -0.96 . . . . 0.0 109.1 178.836 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.694 ' N ' HD23 ' A' ' 42' ' ' LEU . 20.8 m -145.42 174.84 2.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-O 121.12 0.486 . . . . 0.0 111.633 -179.568 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -97.9 145.77 17.93 Favored Glycine 0 CA--C 1.529 0.913 0 N-CA-C 109.961 -1.256 . . . . 0.0 109.961 178.86 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 1.6 tm0? -87.64 113.76 55.85 Favored Pre-proline 0 N--CA 1.463 0.184 0 CA-C-N 117.923 0.862 . . . . 0.0 111.841 -178.574 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 77.2 Cg_endo -85.26 163.37 11.32 Favored 'Trans proline' 0 C--N 1.305 -1.752 0 C-N-CA 121.625 1.55 . . . . 0.0 111.289 178.899 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -65.39 -40.52 93.56 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 116.519 -0.309 . . . . 0.0 111.815 -179.054 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.53 ' O ' ' N ' ' A' ' 50' ' ' ASN . 86.0 m-20 -71.28 8.63 0.96 Allowed 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 111.926 0.343 . . . . 0.0 111.926 -178.819 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' TRP . . . . . 0.46 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 61.8 t-105 -61.56 67.4 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 111.856 0.317 . . . . 0.0 111.856 -179.576 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' ASN . . . . . 0.53 ' N ' ' O ' ' A' ' 48' ' ' ASP . 11.5 t30 -93.1 78.71 4.57 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 178.569 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -142.7 159.34 27.28 Favored Glycine 0 CA--C 1.523 0.583 0 N-CA-C 111.239 -0.745 . . . . 0.0 111.239 -179.581 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 14.3 t0 -92.91 121.57 65.58 Favored Pre-proline 0 CA--C 1.534 0.362 0 N-CA-C 110.321 -0.251 . . . . 0.0 110.321 179.886 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -61.29 -22.38 74.44 Favored 'Trans proline' 0 N--CA 1.495 1.587 0 C-N-CA 122.477 2.118 . . . . 0.0 112.075 -179.513 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 58.7 mt-30 -77.45 -20.08 55.04 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.12 -179.492 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.471 ' O ' ' CE1' ' A' ' 57' ' ' PHE . 1.3 mtt85 -97.85 157.32 34.82 Favored Pre-proline 0 CA--C 1.531 0.215 0 CA-C-O 120.745 0.307 . . . . 0.0 110.23 179.926 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' PRO . . . . . 0.593 ' O ' ' NE2' ' A' ' 24' ' ' GLN . 55.7 Cg_endo -70.22 161.0 47.62 Favored 'Trans proline' 0 N--CA 1.495 1.606 0 C-N-CA 122.913 2.409 . . . . 0.0 113.298 -178.766 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.732 ' CE2' ' NE2' ' A' ' 24' ' ' GLN . 53.3 m-85 -131.16 155.63 46.7 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.053 -0.976 . . . . 0.0 109.142 179.605 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -121.34 137.74 54.56 Favored 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 178.517 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -119.74 137.82 53.7 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.143 0.497 . . . . 0.0 111.963 -178.201 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.601 ' HE ' ' CD1' ' A' ' 68' ' ' LEU . 7.0 mmm-85 -123.43 127.56 48.6 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 108.404 -0.961 . . . . 0.0 108.404 177.612 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 12.4 mt -107.18 149.08 28.09 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.906 0.384 . . . . 0.0 110.836 -178.965 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 10.3 m-85 -134.14 111.8 10.61 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.711 -179.735 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.548 HD23 ' C ' ' A' ' 63' ' ' LEU . 2.9 tt -105.94 -83.35 0.52 Allowed 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 115.812 -0.631 . . . . 0.0 109.5 179.444 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.456 ' H ' ' HB ' ' A' ' 67' ' ' VAL . . . -76.81 -177.12 44.42 Favored Glycine 0 CA--C 1.521 0.436 0 N-CA-C 109.326 -1.509 . . . . 0.0 109.326 178.699 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.667 HD12 ' N ' ' A' ' 65' ' ' LEU . 7.3 mp -75.45 -33.2 60.86 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 119.988 -0.685 . . . . 0.0 110.477 -179.612 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -102.63 8.96 39.59 Favored 'General case' 0 C--N 1.332 -0.168 0 C-N-CA 122.67 0.388 . . . . 0.0 111.323 -179.902 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.573 ' O ' HG12 ' A' ' 67' ' ' VAL . 9.5 t -101.49 93.56 2.89 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.245 0 CA-C-O 121.197 0.523 . . . . 0.0 111.694 -178.864 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.601 ' CD1' ' HE ' ' A' ' 60' ' ' ARG . 1.9 tp -111.69 117.81 33.9 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 108.446 -0.946 . . . . 0.0 108.446 178.62 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.653 HG23 ' OG ' ' A' ' 94' ' ' SER . 3.6 mt -115.28 144.78 22.09 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.247 0 CA-C-O 120.945 0.402 . . . . 0.0 111.155 -178.815 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -128.46 134.42 48.73 Favored 'General case' 0 C--O 1.238 0.492 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.251 179.417 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 71' ' ' MET . . . . . 0.55 ' HE3' HD12 ' A' ' 90' ' ' ILE . 0.1 OUTLIER -143.75 148.15 35.22 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.439 -0.8 . . . . 0.0 109.557 179.472 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -110.82 121.49 45.47 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 107.975 -1.12 . . . . 0.0 107.975 178.509 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.683 HD12 ' CB ' ' A' ' 85' ' ' PHE . 4.2 pt -132.19 165.41 32.12 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 N-CA-C 113.627 0.973 . . . . 0.0 113.627 -176.621 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 3.3 p -120.09 148.96 42.96 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 114.926 -1.033 . . . . 0.0 109.642 178.71 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.535 HD12 ' CE1' ' A' ' 85' ' ' PHE . 14.2 tp -66.1 124.4 22.48 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-O 121.239 0.542 . . . . 0.0 110.542 -179.002 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -98.58 -44.89 6.28 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 115.307 -0.861 . . . . 0.0 111.429 178.205 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' TRP . . . . . 0.581 ' NE1' ' HA3' ' A' ' 84' ' ' GLY . 69.2 p-90 -164.91 172.34 12.96 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.808 -179.091 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -151.3 123.78 8.4 Favored 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 178.117 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' ARG . . . . . 0.547 ' O ' ' OD1' ' A' ' 80' ' ' ASP . 5.2 ttm180 -152.2 131.81 13.1 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 119.916 -0.713 . . . . 0.0 112.617 179.891 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 80' ' ' ASP . . . . . 0.563 ' OD2' ' O ' ' A' ' 80' ' ' ASP . 0.6 OUTLIER 53.61 46.76 25.36 Favored 'General case' 0 N--CA 1.467 0.418 0 N-CA-C 113.699 0.999 . . . . 0.0 113.699 177.117 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 72.32 12.15 76.38 Favored Glycine 0 CA--C 1.521 0.461 0 C-N-CA 120.433 -0.889 . . . . 0.0 111.856 178.114 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 52.4 mt -116.24 140.27 49.49 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 178.734 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 35.2 mt -128.17 135.72 50.13 Favored 'General case' 0 CA--C 1.512 -0.501 0 C-N-CA 120.715 -0.394 . . . . 0.0 111.339 -178.988 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' GLY . . . . . 0.581 ' HA3' ' NE1' ' A' ' 77' ' ' TRP . . . -110.66 156.67 15.43 Favored Glycine 0 N--CA 1.448 -0.558 0 N-CA-C 109.317 -1.513 . . . . 0.0 109.317 178.301 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 85' ' ' PHE . . . . . 0.683 ' CB ' HD12 ' A' ' 73' ' ' ILE . 78.4 m-85 -145.37 143.94 30.4 Favored 'General case' 0 C--N 1.312 -1.028 0 N-CA-C 110.001 -0.37 . . . . 0.0 110.001 -179.53 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 52.4 tt0 -103.64 130.16 51.06 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 179.355 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' CYS . . . . . 0.513 ' O ' ' NE2' ' A' ' 39' ' ' HIS . 4.6 t -69.26 118.67 12.44 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.492 0.553 . . . . 0.0 112.492 -177.926 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 58.7 mm-40 -92.43 -36.76 12.93 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.77 178.876 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' HIS . . . . . 0.449 ' ND1' ' C ' ' A' ' 89' ' ' HIS . 0.0 OUTLIER -164.0 143.79 8.06 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.966 179.955 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.602 HD11 ' OG ' ' A' ' 94' ' ' SER . 9.0 tt -145.61 141.3 22.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-O 121.254 0.55 . . . . 0.0 109.994 -179.592 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -58.5 141.04 53.03 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 115.272 -0.876 . . . . 0.0 112.434 -178.029 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 6.3 tp -54.15 -41.73 68.77 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 114.853 -1.067 . . . . 0.0 110.725 -179.491 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' ASP . . . . . 0.524 ' OD1' ' N ' ' A' ' 94' ' ' SER . 2.8 p30 -68.5 -37.18 79.86 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 179.469 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 94' ' ' SER . . . . . 0.653 ' OG ' HG23 ' A' ' 69' ' ' ILE . 1.6 t -67.2 -38.45 85.36 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.08 179.337 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 95' ' ' ILE . . . . . 0.471 ' CG1' HG23 ' A' ' 90' ' ' ILE . 56.4 mt -58.65 -37.81 67.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.324 179.886 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -70.24 -40.66 74.32 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.158 -0.617 . . . . 0.0 111.195 -178.489 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 61.2 m-70 -61.66 -36.22 80.19 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 119.359 -0.936 . . . . 0.0 109.207 179.767 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.607 ' O ' HG23 ' A' ' 102' ' ' VAL . 35.6 mt -66.82 -34.13 77.14 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 177.651 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.14 -40.93 95.11 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 108.504 -0.924 . . . . 0.0 108.504 177.893 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 2.7 mmp_? -60.23 -45.28 93.78 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.157 -0.929 . . . . 0.0 110.31 178.776 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.458 HD21 HD12 ' A' ' 63' ' ' LEU . 5.3 mp -63.01 -36.23 82.88 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.988 -179.803 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 102' ' ' VAL . . . . . 0.607 HG23 ' O ' ' A' ' 98' ' ' LEU . 71.5 t -68.31 -47.3 78.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.527 179.749 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 26.8 tt0 -65.57 -40.48 92.82 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.947 -0.569 . . . . 0.0 111.486 -179.399 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 12.5 mt -75.44 -42.57 53.07 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.718 -0.393 . . . . 0.0 111.175 -179.066 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 105' ' ' ASN . . . . . 0.431 ' OD1' ' O ' ' A' ' 101' ' ' LEU . 16.9 m120 -61.29 -34.23 74.88 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 120.814 -0.354 . . . . 0.0 110.711 -179.714 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 17.8 tp -59.3 -39.7 83.86 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.335 179.883 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 82.98 31.11 29.78 Favored Glycine 0 CA--C 1.524 0.63 0 N-CA-C 111.001 -0.839 . . . . 0.0 111.001 179.903 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 108' ' ' ASP . . . . . 0.51 ' CG ' ' H ' ' A' ' 109' ' ' GLU . 23.0 t70 -165.85 -173.64 2.75 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.853 0.359 . . . . 0.0 110.427 179.954 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 109' ' ' GLU . . . . . 0.51 ' H ' ' CG ' ' A' ' 108' ' ' ASP . 0.2 OUTLIER -159.17 -167.88 2.19 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.425 179.875 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 24.6 mt-10 56.88 42.59 26.19 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.033 0.444 . . . . 0.0 110.085 -179.565 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 111' ' ' LEU . . . . . 0.492 HD22 ' HA ' ' A' ' 111' ' ' LEU . 0.2 OUTLIER -140.39 105.93 5.1 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.049 179.911 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.651 ' N ' HD22 ' A' ' 112' ' ' LEU . 3.4 mm? -78.07 -113.45 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.728 -179.696 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 113' ' ' GLU . . . . . 0.455 ' O ' ' O ' ' A' ' 114' ' ' ARG . 56.8 mt-10 -90.99 -119.15 0.07 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.73 -179.79 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 114' ' ' ARG . . . . . 0.455 ' O ' ' O ' ' A' ' 113' ' ' GLU . 2.4 mtm105 55.13 110.64 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.235 -179.713 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -96.83 -31.81 12.42 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.854 0.359 . . . . 0.0 110.823 -179.68 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -66.75 -38.49 86.74 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.915 -179.712 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 117' ' ' ALA . . . . . 0.635 ' O ' HG23 ' A' ' 120' ' ' VAL . . . -69.55 -23.92 63.64 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.64 179.481 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 80.8 mt -54.78 -37.49 66.09 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.446 -0.502 . . . . 0.0 111.167 -177.898 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 119' ' ' LEU . . . . . 0.587 ' C ' ' H ' ' A' ' 121' ' ' SER . 2.9 mm? -56.24 -15.74 4.34 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 120.123 -0.631 . . . . 0.0 110.001 -178.439 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 120' ' ' VAL . . . . . 0.635 HG23 ' O ' ' A' ' 117' ' ' ALA . 57.4 t -56.85 0.18 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 121.014 0.435 . . . . 0.0 110.446 179.805 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 121' ' ' SER . . . . . 0.587 ' H ' ' C ' ' A' ' 119' ' ' LEU . 11.2 p -101.9 -33.03 9.93 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.263 179.553 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -166.61 112.35 0.8 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.29 179.901 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 123' ' ' HIS . . . . . 0.688 ' CG ' ' N ' ' A' ' 124' ' ' ASP . 7.7 p80 -67.11 -56.95 7.84 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.811 -179.634 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 124' ' ' ASP . . . . . 0.688 ' N ' ' CG ' ' A' ' 123' ' ' HIS . 0.4 OUTLIER 55.62 -1.82 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.71 -179.667 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 125' ' ' ASP . . . . . 0.613 ' H ' ' C ' ' A' ' 123' ' ' HIS . 14.7 m-20 . . . . . 0 C--O 1.22 -0.488 0 CA-C-O 117.986 -1.007 . . . . 0.0 110.68 -179.853 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 501' ' ' C2E . . . . . 0.928 ' O21' " H4'" ' A' ' 501' ' ' C2E . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 502' ' ' C2E . . . . . 0.861 ' C61' ' H ' ' A' ' 8' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.407 ' C ' ' H ' ' A' ' 3' ' ' ASP . 12.1 mmt . . . . . 0 N--CA 1.491 1.582 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 37.3 m -78.6 35.54 0.24 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.322 179.864 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ASP . . . . . 0.407 ' H ' ' C ' ' A' ' 1' ' ' MET . 5.3 m-20 -80.66 20.74 0.71 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.446 179.886 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.716 ' O ' ' N ' ' A' ' 6' ' ' ASP . 1.5 tm0? -111.0 -11.94 14.26 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.112 179.968 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' HIS . . . . . 0.557 ' C ' ' O ' ' A' ' 4' ' ' GLN . 0.0 OUTLIER -14.48 73.3 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 115.564 -0.744 . . . . 0.0 111.705 179.41 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 6' ' ' ASP . . . . . 0.716 ' N ' ' O ' ' A' ' 4' ' ' GLN . 1.6 m-20 19.98 91.87 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.14 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.598 179.794 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.736 ' OE1' ' HB2' ' A' ' 122' ' ' ALA . 6.1 tt0 -95.68 125.69 40.44 Favored 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 110.093 -0.336 . . . . 0.0 110.093 179.792 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.694 ' NH2' ' N11' ' A' ' 501' ' ' C2E . 0.0 OUTLIER -125.26 -5.42 7.24 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.775 -178.947 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.525 ' O ' ' C ' ' A' ' 10' ' ' ARG . 1.1 ptt85 -111.61 84.53 1.96 Allowed 'General case' 0 N--CA 1.467 0.41 0 CA-C-O 121.119 0.485 . . . . 0.0 110.225 179.829 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.525 ' C ' ' O ' ' A' ' 9' ' ' ARG . 0.0 OUTLIER 17.33 -91.18 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 114.945 -1.025 . . . . 0.0 111.769 -179.892 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 5.2 m-85 -115.02 169.55 9.01 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-O 120.789 0.328 . . . . 0.0 110.464 -179.895 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' HIS . . . . . 0.536 ' ND1' ' N21' ' A' ' 502' ' ' C2E . 14.8 m-70 -63.39 143.13 58.07 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.499 179.964 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.525 ' NH1' ' C6 ' ' A' ' 501' ' ' C2E . 19.7 mtm180 -86.32 164.71 16.93 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.095 -179.997 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.752 ' N ' HD12 ' A' ' 14' ' ' ILE . 1.8 mp -73.17 97.25 0.81 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 N-CA-C 109.863 -0.421 . . . . 0.0 109.863 179.772 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -95.19 120.5 35.53 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.506 0.669 . . . . 0.0 111.623 -179.363 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -149.73 155.57 40.39 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 114.791 -1.095 . . . . 0.0 108.363 178.022 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -95.44 146.81 24.13 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 120.159 -0.616 . . . . 0.0 110.863 -178.919 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.538 ' O ' HD12 ' A' ' 32' ' ' LEU . . . -179.79 176.99 0.72 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.9 -0.591 . . . . 0.0 109.926 179.598 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -96.12 133.88 39.86 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.79 -179.855 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.583 ' O ' ' O ' ' A' ' 31' ' ' VAL . 13.0 t -133.8 152.86 52.0 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.186 0.517 . . . . 0.0 110.215 178.692 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.538 ' OE1' ' NH2' ' A' ' 28' ' ' ARG . 97.0 mt-10 -129.09 155.67 45.09 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 109.136 -0.691 . . . . 0.0 109.136 179.291 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.477 ' HA ' ' O ' ' A' ' 58' ' ' GLU . 34.2 mt -138.47 136.36 43.94 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.437 0 C-N-CA 120.005 -0.678 . . . . 0.0 111.263 -179.603 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.75 HD11 ' HE ' ' A' ' 60' ' ' ARG . 0.0 OUTLIER -125.29 127.79 47.23 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.419 -0.809 . . . . 0.0 111.261 -178.793 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.469 ' O ' ' OE1' ' A' ' 24' ' ' GLN . 1.6 tm0? -132.49 101.95 5.53 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.082 -0.963 . . . . 0.0 109.532 178.519 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 80.71 -126.51 7.43 Favored Glycine 0 CA--C 1.523 0.554 0 N-CA-C 110.111 -1.195 . . . . 0.0 110.111 -178.729 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.613 ' N ' ' OE1' ' A' ' 26' ' ' GLU . 6.0 pm0 -100.68 13.21 35.58 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 110.084 -0.339 . . . . 0.0 110.084 179.583 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.558 ' HB3' ' CZ2' ' A' ' 29' ' ' TRP . 33.5 mtt180 -114.54 135.83 53.69 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 112.755 0.65 . . . . 0.0 112.755 -178.312 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.538 ' NH2' ' OE1' ' A' ' 21' ' ' GLU . 26.7 ttt180 -128.74 148.7 50.87 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.174 179.206 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.558 ' CZ2' ' HB3' ' A' ' 27' ' ' ARG . 6.7 m-90 -147.2 156.13 42.7 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.655 -179.144 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 18.8 mt-10 -100.34 138.54 37.27 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 178.986 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.583 ' O ' ' O ' ' A' ' 20' ' ' SER . 12.0 m -148.06 157.96 8.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-O 121.223 0.535 . . . . 0.0 111.274 -179.454 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.538 HD12 ' O ' ' A' ' 18' ' ' ALA . 8.3 tp -98.31 130.03 45.0 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 108.301 -1.0 . . . . 0.0 108.301 178.816 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.537 ' N ' HD12 ' A' ' 32' ' ' LEU . 0.8 OUTLIER -92.12 125.96 37.01 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 120.334 -0.547 . . . . 0.0 109.881 179.895 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 73.3 m-70 -90.48 -28.74 18.36 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.418 -0.81 . . . . 0.0 111.742 -178.706 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -171.98 162.23 5.88 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 119.493 -0.883 . . . . 0.0 111.283 177.568 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.511 HG22 ' H ' ' A' ' 37' ' ' SER . 4.8 p -146.04 168.88 6.64 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.11 0 CA-C-N 115.782 -0.645 . . . . 0.0 111.193 -178.798 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.511 ' H ' HG22 ' A' ' 36' ' ' VAL . 23.0 t -142.11 168.46 19.69 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 107.632 -1.247 . . . . 0.0 107.632 178.513 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 3.6 tp -64.41 -0.6 1.36 Allowed 'General case' 0 C--N 1.322 -0.588 0 C-N-CA 119.555 -0.858 . . . . 0.0 110.795 -179.277 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 10.0 p-80 -162.25 43.16 0.13 Allowed 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 120.693 -0.403 . . . . 0.0 111.41 179.747 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' GLY . . . . . 0.457 ' HA3' ' N3 ' ' A' ' 501' ' ' C2E . . . 179.83 156.58 18.18 Favored Glycine 0 CA--C 1.528 0.898 0 N-CA-C 111.039 -0.824 . . . . 0.0 111.039 179.765 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.45 HG21 HG21 ' A' ' 73' ' ' ILE . 0.1 OUTLIER -148.57 148.76 15.69 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.355 0 CA-C-O 121.453 0.644 . . . . 0.0 111.664 -178.745 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.434 HD23 ' N ' ' A' ' 43' ' ' VAL . 0.9 OUTLIER -121.83 132.29 54.51 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 115.069 -0.969 . . . . 0.0 108.53 178.79 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.434 ' N ' HD23 ' A' ' 42' ' ' LEU . 31.7 m -136.62 174.84 11.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 121.316 0.579 . . . . 0.0 112.078 -179.172 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -98.57 144.56 17.3 Favored Glycine 0 CA--C 1.526 0.725 0 N-CA-C 109.263 -1.535 . . . . 0.0 109.263 178.109 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' GLN . . . . . 0.516 ' O ' ' CD ' ' A' ' 45' ' ' GLN . 0.0 OUTLIER -87.16 117.73 69.01 Favored Pre-proline 0 CA--C 1.534 0.33 0 CA-C-N 118.052 0.926 . . . . 0.0 111.862 -178.284 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 74.6 Cg_endo -85.85 160.16 10.43 Favored 'Trans proline' 0 C--N 1.306 -1.673 0 C-N-CA 121.772 1.648 . . . . 0.0 111.576 178.89 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 24.0 mm-40 -65.2 -25.33 67.66 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 112.291 0.478 . . . . 0.0 112.291 -178.888 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.532 ' O ' ' N ' ' A' ' 50' ' ' ASN . 3.3 m-20 -86.68 8.82 20.84 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 111.661 0.245 . . . . 0.0 111.661 -178.897 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' TRP . . . . . 0.463 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 59.3 t-105 -60.56 66.9 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 112.265 0.468 . . . . 0.0 112.265 -179.421 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' ASN . . . . . 0.584 ' C ' HD22 ' A' ' 50' ' ' ASN . 0.2 OUTLIER -93.16 78.66 4.54 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 120.047 -0.661 . . . . 0.0 109.246 178.105 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -145.65 146.25 16.24 Favored Glycine 0 CA--C 1.523 0.54 0 N-CA-C 111.601 -0.6 . . . . 0.0 111.601 -179.07 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -77.75 121.97 84.99 Favored Pre-proline 0 C--N 1.328 -0.365 0 CA-C-N 115.427 -0.386 . . . . 0.0 110.714 -179.969 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 21.5 Cg_endo -62.12 -22.41 74.16 Favored 'Trans proline' 0 N--CA 1.496 1.634 0 C-N-CA 122.61 2.207 . . . . 0.0 112.113 -179.757 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 78.6 mt-30 -77.19 -24.19 51.41 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 120.477 -0.489 . . . . 0.0 111.429 -179.2 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.535 ' O ' ' CE1' ' A' ' 57' ' ' PHE . 17.1 mtp85 -92.88 155.42 41.56 Favored Pre-proline 0 C--N 1.331 -0.223 0 C-N-CA 120.836 -0.345 . . . . 0.0 110.383 -179.955 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_endo -68.0 161.16 45.42 Favored 'Trans proline' 0 N--CA 1.497 1.694 0 C-N-CA 123.059 2.506 . . . . 0.0 113.03 -179.057 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.535 ' CE1' ' O ' ' A' ' 55' ' ' ARG . 43.5 m-85 -131.09 157.31 43.42 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.35 -0.841 . . . . 0.0 109.415 179.595 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.477 ' O ' ' HA ' ' A' ' 22' ' ' ILE . 42.0 mt-10 -123.13 139.23 54.28 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 109.095 -0.706 . . . . 0.0 109.095 178.319 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -124.92 142.08 51.7 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 112.817 0.673 . . . . 0.0 112.817 -177.531 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.75 ' HE ' HD11 ' A' ' 23' ' ' LEU . 0.0 OUTLIER -124.95 128.08 48.05 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.115 -0.948 . . . . 0.0 109.288 177.215 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.538 HD11 ' SD ' ' A' ' 71' ' ' MET . 7.4 mt -108.59 129.38 55.32 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 120.569 -0.452 . . . . 0.0 110.431 -179.658 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 62' ' ' TYR . . . . . 0.43 ' CD1' ' N ' ' A' ' 62' ' ' TYR . 19.9 m-85 -110.67 109.66 20.02 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.002 0.429 . . . . 0.0 110.742 -179.957 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.526 HD23 ' C ' ' A' ' 63' ' ' LEU . 3.5 tt -104.19 -85.03 0.47 Allowed 'General case' 0 C--N 1.333 -0.116 0 CA-C-N 115.76 -0.655 . . . . 0.0 109.545 179.476 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.467 ' H ' ' HB ' ' A' ' 67' ' ' VAL . . . -76.3 176.89 51.49 Favored Glycine 0 CA--C 1.523 0.585 0 N-CA-C 109.337 -1.505 . . . . 0.0 109.337 178.7 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.725 ' C ' HD13 ' A' ' 65' ' ' LEU . 3.0 tm? -71.93 -37.31 70.05 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 120.031 -0.668 . . . . 0.0 109.604 -179.636 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.427 ' O ' ' OD1' ' A' ' 66' ' ' ASP . 55.6 t0 -98.52 9.2 43.72 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.105 179.49 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.558 ' O ' HG12 ' A' ' 67' ' ' VAL . 8.7 t -106.06 96.15 4.37 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.305 0 CA-C-O 121.405 0.621 . . . . 0.0 111.741 -178.875 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 7.8 tp -113.24 117.55 32.18 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 108.102 -1.073 . . . . 0.0 108.102 178.221 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.763 HG23 ' OG ' ' A' ' 94' ' ' SER . 3.6 mt -112.64 144.76 19.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 120.798 0.333 . . . . 0.0 110.948 -178.974 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 9.8 ptt180 -128.16 130.98 48.92 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.835 179.214 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' MET . . . . . 0.538 ' SD ' HD11 ' A' ' 61' ' ' LEU . 2.0 mtp -140.18 148.14 41.16 Favored 'General case' 0 C--O 1.227 -0.117 0 CA-C-N 115.719 -0.673 . . . . 0.0 109.902 179.836 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -103.78 126.54 50.98 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 107.627 -1.249 . . . . 0.0 107.627 178.143 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.45 HG21 HG21 ' A' ' 41' ' ' ILE . 11.2 pt -134.83 157.68 41.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 N-CA-C 112.953 0.723 . . . . 0.0 112.953 -177.44 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -122.52 154.69 37.53 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.023 -0.99 . . . . 0.0 109.623 178.723 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.523 ' CD1' ' CZ ' ' A' ' 85' ' ' PHE . 5.2 tp -66.47 120.74 13.9 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.226 0.536 . . . . 0.0 110.558 -179.828 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -97.69 -41.75 7.96 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.422 177.927 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' TRP . . . . . 0.597 ' NE1' ' HA3' ' A' ' 84' ' ' GLY . 67.6 p-90 -170.45 168.52 7.81 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 115.485 -0.78 . . . . 0.0 109.898 -179.647 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -148.15 123.89 10.53 Favored 'General case' 0 N--CA 1.464 0.27 0 N-CA-C 109.932 -0.395 . . . . 0.0 109.932 178.795 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 38.4 ttt85 -152.37 133.68 14.41 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 113.215 0.82 . . . . 0.0 113.215 179.863 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 13.3 t70 56.92 47.15 18.3 Favored 'General case' 0 N--CA 1.464 0.246 0 N-CA-C 114.227 1.195 . . . . 0.0 114.227 176.405 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 83.77 -28.08 4.12 Favored Glycine 0 CA--C 1.524 0.656 0 C-N-CA 120.314 -0.946 . . . . 0.0 113.153 177.114 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 3.5 mt -89.69 157.89 17.8 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 117.637 0.719 . . . . 0.0 110.206 -179.283 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 36.5 mt -129.62 135.34 48.42 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.308 -179.078 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' GLY . . . . . 0.597 ' HA3' ' NE1' ' A' ' 77' ' ' TRP . . . -96.29 152.4 20.21 Favored Glycine 0 N--CA 1.451 -0.347 0 N-CA-C 109.894 -1.283 . . . . 0.0 109.894 178.935 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 85' ' ' PHE . . . . . 0.523 ' CZ ' ' CD1' ' A' ' 75' ' ' LEU . 23.8 m-85 -145.67 132.75 20.36 Favored 'General case' 0 C--N 1.318 -0.772 0 C-N-CA 120.79 -0.364 . . . . 0.0 110.892 -179.2 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -103.92 126.32 50.95 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 178.994 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 5.6 t -68.72 122.12 17.89 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.015 0.436 . . . . 0.0 112.007 -178.408 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 6.8 mm100 -95.14 -34.05 12.42 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.078 179.348 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' HIS . . . . . 0.442 ' ND1' ' C ' ' A' ' 89' ' ' HIS . 0.0 OUTLIER -161.5 141.69 10.65 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.031 179.66 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.41 HD11 ' OG ' ' A' ' 94' ' ' SER . 7.1 tt -143.36 139.33 26.52 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-O 121.169 0.509 . . . . 0.0 109.988 -179.045 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -57.21 142.69 42.0 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 115.508 -0.769 . . . . 0.0 112.057 -178.312 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 3.3 tp -54.1 -42.05 68.98 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.222 -0.899 . . . . 0.0 110.457 -179.337 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' ASP . . . . . 0.522 ' OD1' ' N ' ' A' ' 94' ' ' SER . 1.4 p30 -67.07 -39.07 86.79 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 179.273 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 94' ' ' SER . . . . . 0.763 ' OG ' HG23 ' A' ' 69' ' ' ILE . 6.7 t -66.24 -37.0 84.47 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.573 -0.74 . . . . 0.0 110.185 179.268 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 95' ' ' ILE . . . . . 0.41 ' CG1' HG23 ' A' ' 90' ' ' ILE . 38.5 mt -58.61 -38.3 70.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.137 179.973 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -70.88 -41.54 71.23 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.354 -0.538 . . . . 0.0 111.203 -179.003 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 60.7 m-70 -61.67 -35.4 77.86 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 119.408 -0.917 . . . . 0.0 109.303 179.791 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 5.5 mp -67.53 -34.04 76.29 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 177.475 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -64.3 -38.69 91.94 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 178.522 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 53.2 mtp85 -58.06 -37.93 75.36 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.943 179.131 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.471 ' O ' ' ND2' ' A' ' 105' ' ' ASN . 6.7 mp -69.91 -36.24 75.22 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.124 -179.657 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 86.5 t -68.67 -40.84 82.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.911 179.739 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 14.5 tt0 -64.94 -47.86 76.16 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.447 -179.269 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.468 ' N ' ' CD1' ' A' ' 104' ' ' LEU . 5.3 mp -69.24 -43.05 74.77 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 120.976 -0.29 . . . . 0.0 111.416 -179.668 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 105' ' ' ASN . . . . . 0.471 ' ND2' ' O ' ' A' ' 101' ' ' LEU . 18.6 m-80 -62.13 -26.24 68.2 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.684 -0.407 . . . . 0.0 110.596 -179.756 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 2.4 tp -55.9 -18.92 10.16 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.885 0.374 . . . . 0.0 110.016 179.803 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -132.02 171.31 21.42 Favored Glycine 0 CA--C 1.526 0.759 0 N-CA-C 110.81 -0.916 . . . . 0.0 110.81 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 108' ' ' ASP . . . . . 0.478 ' CG ' ' N ' ' A' ' 109' ' ' GLU . 4.5 p-10 -135.39 -54.69 0.79 Allowed 'General case' 0 C--N 1.333 -0.152 0 CA-C-O 120.703 0.287 . . . . 0.0 110.576 -179.942 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 109' ' ' GLU . . . . . 0.478 ' N ' ' CG ' ' A' ' 108' ' ' ASP . 2.3 tp10 -169.98 -34.56 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.378 -0.373 . . . . 0.0 110.942 179.991 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -144.66 -136.41 0.09 Allowed 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.576 -0.284 . . . . 0.0 110.677 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 2.4 mp -97.93 -94.57 0.23 Allowed 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 121.055 -0.258 . . . . 0.0 110.952 -179.696 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 2.3 tp 67.25 131.09 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.738 0.304 . . . . 0.0 110.55 -179.815 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 113' ' ' GLU . . . . . 0.4 ' O ' ' CG ' ' A' ' 113' ' ' GLU . 8.3 pt-20 -65.29 122.32 16.85 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.582 179.922 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 10.1 ttm180 -174.85 45.11 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.35 -179.913 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -150.51 -55.94 0.16 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.623 -179.875 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 1.2 tt -66.93 -37.11 83.71 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.79 -179.857 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -63.71 -22.69 67.04 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.167 0.508 . . . . 0.0 110.283 -179.123 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.417 ' O ' ' OG ' ' A' ' 121' ' ' SER . 46.9 mt -57.46 -35.81 70.63 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 108.195 -1.039 . . . . 0.0 108.195 178.32 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 119' ' ' LEU . . . . . 0.495 ' C ' ' H ' ' A' ' 121' ' ' SER . 36.2 mt -57.91 -48.92 78.45 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 114.935 -1.03 . . . . 0.0 108.24 179.075 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 120' ' ' VAL . . . . . 0.431 ' O ' HG12 ' A' ' 120' ' ' VAL . 18.6 t -59.14 -0.99 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.135 177.991 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 121' ' ' SER . . . . . 0.495 ' H ' ' C ' ' A' ' 119' ' ' LEU . 4.4 p -111.45 -41.66 4.06 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 108.555 -0.906 . . . . 0.0 108.555 177.237 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 122' ' ' ALA . . . . . 0.736 ' HB2' ' OE1' ' A' ' 7' ' ' GLU . . . -128.75 84.55 2.24 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.106 -0.952 . . . . 0.0 109.664 179.77 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 123' ' ' HIS . . . . . 0.741 ' CG ' ' N ' ' A' ' 124' ' ' ASP . 0.0 OUTLIER -83.74 -159.01 0.34 Allowed 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 120.559 -0.456 . . . . 0.0 111.162 -178.834 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 124' ' ' ASP . . . . . 0.741 ' N ' ' CG ' ' A' ' 123' ' ' HIS . 0.6 OUTLIER 158.91 -32.15 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.787 -0.642 . . . . 0.0 109.53 179.961 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 125' ' ' ASP . . . . . 0.42 ' O ' ' OD1' ' A' ' 125' ' ' ASP . 0.7 OUTLIER . . . . . 0 C--O 1.219 -0.518 0 CA-C-O 118.028 -0.987 . . . . 0.0 110.417 179.771 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 501' ' ' C2E . . . . . 0.889 ' O21' " H4'" ' A' ' 501' ' ' C2E . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 502' ' ' C2E . . . . . 0.536 ' N21' ' ND1' ' A' ' 12' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.0 mpt? . . . . . 0 N--CA 1.491 1.583 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 3.4 t -163.35 161.21 24.42 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.458 -179.914 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -99.66 21.04 12.94 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.16 -0.473 . . . . 0.0 109.89 178.475 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.501 ' C ' ' H ' ' A' ' 6' ' ' ASP . 8.9 mm-40 -114.41 -15.69 12.05 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 115.643 -0.708 . . . . 0.0 109.827 177.883 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 4.0 m-70 -74.8 29.99 0.09 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.214 179.512 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' ASP . . . . . 0.591 ' O ' ' NH2' ' A' ' 8' ' ' ARG . 6.3 m-20 -50.25 160.26 0.39 Allowed 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 -179.932 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -97.27 133.39 41.95 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.177 0.513 . . . . 0.0 110.391 -179.744 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.668 HH21 ' C81' ' A' ' 502' ' ' C2E . 0.2 OUTLIER -125.14 -14.17 6.61 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.501 -0.772 . . . . 0.0 111.289 -179.1 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.625 ' CZ ' HH21 ' A' ' 13' ' ' ARG . 2.5 ptt180 -105.47 93.66 4.79 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.112 179.365 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.536 ' C ' ' O ' ' A' ' 9' ' ' ARG . 0.0 OUTLIER 15.07 -89.23 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 115.215 -0.902 . . . . 0.0 111.945 -179.88 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 11' ' ' PHE . . . . . 0.4 ' N ' ' O ' ' A' ' 9' ' ' ARG . 0.3 OUTLIER -124.52 171.37 10.05 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-O 120.978 0.418 . . . . 0.0 110.707 -179.557 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 12' ' ' HIS . . . . . 0.569 ' ND1' ' N21' ' A' ' 502' ' ' C2E . 9.0 m-70 -64.74 132.88 50.8 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.643 -179.946 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.625 HH21 ' CZ ' ' A' ' 9' ' ' ARG . 2.2 mtm180 -81.24 -177.68 6.58 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.396 -0.366 . . . . 0.0 110.527 -179.905 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.567 ' N ' HD12 ' A' ' 14' ' ' ILE . 2.4 mp -91.56 104.49 15.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.043 -179.405 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -95.14 120.21 34.96 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.635 179.145 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 2.2 p90 -150.11 157.82 43.52 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 108.503 -0.925 . . . . 0.0 108.503 178.02 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -95.77 143.37 27.07 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 120.139 -0.624 . . . . 0.0 110.77 -179.372 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.559 ' O ' HD12 ' A' ' 32' ' ' LEU . . . -176.48 175.23 1.79 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.665 179.091 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -96.33 134.03 39.96 Favored 'General case' 0 C--N 1.326 -0.45 0 C-N-CA 120.647 -0.421 . . . . 0.0 111.141 -179.598 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.495 ' O ' ' O ' ' A' ' 31' ' ' VAL . 11.0 p -133.52 152.39 51.9 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.019 178.588 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.442 ' CG ' HH21 ' A' ' 28' ' ' ARG . 6.1 mm-40 -131.31 136.74 48.38 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 179.814 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 1.1 mm -117.45 135.37 58.08 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.552 0 C-N-CA 120.197 -0.601 . . . . 0.0 110.338 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -130.56 122.78 28.16 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.78 -179.321 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.535 ' OE1' ' CZ ' ' A' ' 57' ' ' PHE . 24.2 tt0 -124.64 101.78 7.28 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 114.735 -1.12 . . . . 0.0 109.823 179.097 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 82.14 -124.53 6.52 Favored Glycine 0 CA--C 1.523 0.557 0 N-CA-C 110.055 -1.218 . . . . 0.0 110.055 -178.952 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -100.53 10.64 40.91 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.776 0.322 . . . . 0.0 110.197 179.555 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.53 ' HB3' ' CZ2' ' A' ' 29' ' ' TRP . 17.5 mtt180 -112.58 133.57 54.56 Favored 'General case' 0 C--N 1.332 -0.158 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 -178.502 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.442 HH21 ' CG ' ' A' ' 21' ' ' GLU . 49.2 ttt180 -128.47 152.88 47.73 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.388 179.212 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.53 ' CZ2' ' HB3' ' A' ' 27' ' ' ARG . 6.6 m-90 -151.02 156.9 42.08 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.709 -178.691 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.538 ' H ' ' CD ' ' A' ' 30' ' ' GLU . 2.3 mp0 -99.94 136.18 40.24 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 179.159 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.495 ' O ' ' O ' ' A' ' 20' ' ' SER . 30.7 m -145.36 156.65 13.35 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-O 121.049 0.452 . . . . 0.0 111.001 -179.451 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.559 HD12 ' O ' ' A' ' 18' ' ' ALA . 10.7 tp -97.41 129.71 44.61 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 108.42 -0.956 . . . . 0.0 108.42 178.811 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.472 ' N ' HD12 ' A' ' 32' ' ' LEU . 0.5 OUTLIER -90.14 124.41 34.79 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.152 0.501 . . . . 0.0 110.111 -179.729 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 75.4 m-70 -91.02 -31.56 16.26 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.375 -0.829 . . . . 0.0 111.414 -178.87 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 1.9 p30 -170.8 161.87 7.4 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 119.577 -0.849 . . . . 0.0 111.125 177.387 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.512 HG22 ' N ' ' A' ' 37' ' ' SER . 5.4 p -146.78 169.11 5.16 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.168 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.307 -178.572 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.527 ' CB ' HN22 ' A' ' 501' ' ' C2E . 14.7 t -140.09 171.78 13.7 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 107.956 -1.127 . . . . 0.0 107.956 178.224 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 4.0 tp -68.18 0.79 3.35 Favored 'General case' 0 C--N 1.324 -0.514 0 C-N-CA 120.124 -0.63 . . . . 0.0 111.185 -179.091 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -160.78 35.21 0.15 Allowed 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.573 -0.451 . . . . 0.0 111.141 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' GLY . . . . . 0.578 ' HA3' ' N3 ' ' A' ' 501' ' ' C2E . . . -174.02 159.93 29.55 Favored Glycine 0 CA--C 1.524 0.656 0 N-CA-C 110.943 -0.863 . . . . 0.0 110.943 179.673 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -148.22 148.91 15.7 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.277 0 CA-C-O 121.46 0.648 . . . . 0.0 111.839 -178.664 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -121.57 134.84 55.02 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 114.839 -1.073 . . . . 0.0 108.612 178.662 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 33.3 m -139.63 175.05 7.79 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-O 121.234 0.54 . . . . 0.0 111.698 -179.444 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -99.47 143.7 16.66 Favored Glycine 0 N--CA 1.467 0.746 0 N-CA-C 108.774 -1.73 . . . . 0.0 108.774 177.987 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' GLN . . . . . 0.52 ' O ' ' CD ' ' A' ' 45' ' ' GLN . 4.0 pp0? -85.66 121.7 73.3 Favored Pre-proline 0 CA--C 1.534 0.332 0 CA-C-N 118.221 1.01 . . . . 0.0 111.659 -178.314 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 79.8 Cg_endo -86.6 161.74 9.38 Favored 'Trans proline' 0 C--N 1.303 -1.82 0 C-N-CA 121.766 1.644 . . . . 0.0 111.106 178.447 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.4 mm100 -65.72 -39.65 91.41 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 111.9 0.334 . . . . 0.0 111.9 -179.32 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.528 ' O ' ' N ' ' A' ' 50' ' ' ASN . 79.2 m-20 -72.48 8.7 1.29 Allowed 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 111.912 0.338 . . . . 0.0 111.912 -178.873 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' TRP . . . . . 0.462 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 64.8 t-105 -59.84 66.72 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 112.324 0.49 . . . . 0.0 112.324 -179.344 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' ASN . . . . . 0.538 ' O ' ' ND2' ' A' ' 50' ' ' ASN . 1.8 t30 -93.07 78.71 4.59 Favored 'General case' 0 C--N 1.326 -0.43 0 C-N-CA 119.947 -0.701 . . . . 0.0 109.302 178.176 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -144.39 144.23 13.11 Favored Glycine 0 CA--C 1.525 0.682 0 N-CA-C 111.578 -0.609 . . . . 0.0 111.578 -179.199 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -78.62 121.99 84.31 Favored Pre-proline 0 CA--C 1.534 0.357 0 CA-C-N 115.795 -0.203 . . . . 0.0 110.811 -179.898 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -60.93 -22.93 75.97 Favored 'Trans proline' 0 N--CA 1.495 1.59 0 C-N-CA 122.443 2.096 . . . . 0.0 112.433 -179.576 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.589 ' C ' ' HE ' ' A' ' 55' ' ' ARG . 28.2 mt-30 -75.5 -23.73 56.78 Favored 'General case' 0 C--N 1.323 -0.544 0 C-N-CA 120.36 -0.536 . . . . 0.0 111.059 -179.634 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.589 ' HE ' ' C ' ' A' ' 54' ' ' GLN . 0.0 OUTLIER -94.11 151.45 39.64 Favored Pre-proline 0 C--N 1.33 -0.252 0 CA-C-O 120.851 0.358 . . . . 0.0 110.043 179.981 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 56' ' ' PRO . . . . . 0.438 ' O ' ' OE1' ' A' ' 24' ' ' GLN . 33.2 Cg_endo -64.03 160.92 35.5 Favored 'Trans proline' 0 N--CA 1.495 1.615 0 C-N-CA 123.068 2.512 . . . . 0.0 113.532 -178.833 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.535 ' CZ ' ' OE1' ' A' ' 24' ' ' GLN . 58.7 m-85 -130.79 156.38 45.09 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 114.926 -1.034 . . . . 0.0 109.191 179.366 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -123.36 136.74 54.8 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 178.537 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' ALA . . . . . 0.605 ' HB2' HD13 ' A' ' 73' ' ' ILE . . . -115.33 135.42 54.16 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.971 0.415 . . . . 0.0 111.915 -178.545 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 3.7 mmm180 -122.91 127.42 48.92 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 108.547 -0.908 . . . . 0.0 108.547 177.725 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 13.5 mt -108.35 151.24 26.26 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.908 0.385 . . . . 0.0 111.001 -178.895 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' TYR . . . . . 0.407 ' CD1' ' N ' ' A' ' 62' ' ' TYR . 12.7 m-85 -134.61 110.68 9.47 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.62 179.809 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.472 HD23 ' C ' ' A' ' 63' ' ' LEU . 1.4 tt -106.01 -81.91 0.54 Allowed 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.625 179.608 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.464 ' H ' ' HB ' ' A' ' 67' ' ' VAL . . . -79.84 -177.88 50.96 Favored Glycine 0 CA--C 1.521 0.41 0 N-CA-C 109.343 -1.503 . . . . 0.0 109.343 178.678 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 5.5 mt -76.13 -33.42 59.43 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 119.806 -0.758 . . . . 0.0 110.478 -179.535 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -101.67 8.35 41.68 Favored 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 122.616 0.367 . . . . 0.0 110.849 179.886 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.563 ' O ' HG12 ' A' ' 67' ' ' VAL . 12.1 t -103.95 94.1 2.99 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.195 0 CA-C-O 121.336 0.589 . . . . 0.0 111.877 -178.769 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 5.4 tp -113.65 117.33 31.26 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 108.088 -1.079 . . . . 0.0 108.088 178.156 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.516 HG23 ' CB ' ' A' ' 94' ' ' SER . 3.9 mt -112.09 144.39 19.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-O 120.943 0.401 . . . . 0.0 111.174 -178.814 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.442 ' C ' ' HG2' ' A' ' 71' ' ' MET . 0.5 OUTLIER -128.2 130.1 47.49 Favored 'General case' 0 C--O 1.239 0.547 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.653 179.183 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 71' ' ' MET . . . . . 0.769 ' SD ' HD12 ' A' ' 90' ' ' ILE . 0.0 OUTLIER -138.54 146.83 42.37 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.771 -0.649 . . . . 0.0 109.829 179.551 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 72' ' ' GLU . . . . . 0.454 ' OE2' ' O ' ' A' ' 57' ' ' PHE . 15.4 tp10 -99.59 132.83 44.67 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 107.551 -1.277 . . . . 0.0 107.551 178.663 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.605 HD13 ' HB2' ' A' ' 59' ' ' ALA . 2.0 pt -143.16 157.17 17.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 C-N-CA 119.182 -1.007 . . . . 0.0 113.102 -177.732 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 7.2 m -123.11 155.87 36.1 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-N 115.111 -0.95 . . . . 0.0 110.022 179.043 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.587 HD22 ' CE1' ' A' ' 85' ' ' PHE . 0.2 OUTLIER -64.56 118.33 8.67 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.793 0.33 . . . . 0.0 110.698 -179.252 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 76' ' ' ALA . . . . . 0.556 ' N ' HD13 ' A' ' 75' ' ' LEU . . . -97.1 -43.32 7.45 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-O 121.136 0.493 . . . . 0.0 110.022 177.659 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 77' ' ' TRP . . . . . 0.569 ' NE1' ' HA3' ' A' ' 84' ' ' GLY . 67.5 p-90 -171.22 167.75 6.92 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.042 179.946 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -146.96 123.73 11.23 Favored 'General case' 0 N--CA 1.465 0.278 0 N-CA-C 109.878 -0.416 . . . . 0.0 109.878 178.575 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' ARG . . . . . 0.422 ' NH2' ' O21' ' A' ' 502' ' ' C2E . 10.9 ttp180 -152.48 134.23 14.69 Favored 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 113.163 0.801 . . . . 0.0 113.163 -179.98 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 56.97 47.18 18.12 Favored 'General case' 0 C--N 1.333 -0.15 0 N-CA-C 113.788 1.033 . . . . 0.0 113.788 176.487 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 82.39 -27.94 3.54 Favored Glycine 0 CA--C 1.523 0.58 0 C-N-CA 120.319 -0.943 . . . . 0.0 113.033 177.268 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 4.9 mt -89.39 154.0 20.4 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 117.381 0.59 . . . . 0.0 110.335 -179.004 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.427 HD11 ' CB ' ' A' ' 45' ' ' GLN . 70.1 mt -126.87 135.67 51.28 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.402 -178.969 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 84' ' ' GLY . . . . . 0.569 ' HA3' ' NE1' ' A' ' 77' ' ' TRP . . . -98.49 150.84 19.46 Favored Glycine 0 N--CA 1.45 -0.375 0 N-CA-C 109.546 -1.421 . . . . 0.0 109.546 178.64 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 85' ' ' PHE . . . . . 0.587 ' CE1' HD22 ' A' ' 75' ' ' LEU . 45.8 m-85 -145.57 134.85 22.95 Favored 'General case' 0 C--N 1.318 -0.766 0 C-N-CA 120.863 -0.335 . . . . 0.0 110.458 -179.542 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -103.97 125.73 50.57 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 179.646 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -70.38 125.44 26.8 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.979 0.419 . . . . 0.0 111.542 -178.744 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 8.2 mm100 -98.22 -31.94 11.82 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.302 179.468 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' HIS . . . . . 0.472 ' ND1' ' C ' ' A' ' 89' ' ' HIS . 0.0 OUTLIER -160.48 141.59 12.06 Favored 'General case' 0 C--O 1.222 -0.342 0 CA-C-N 116.043 -0.526 . . . . 0.0 109.842 179.617 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.769 HD12 ' SD ' ' A' ' 71' ' ' MET . 7.1 tt -145.26 140.72 22.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-O 121.381 0.61 . . . . 0.0 110.235 -179.13 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 91' ' ' ASP . . . . . 0.545 ' OD1' ' N ' ' A' ' 92' ' ' LEU . 12.9 t0 -56.88 142.42 41.29 Favored 'General case' 0 N--CA 1.462 0.131 0 CA-C-N 115.148 -0.933 . . . . 0.0 112.003 -178.294 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.545 ' N ' ' OD1' ' A' ' 91' ' ' ASP . 6.5 tt -53.87 -41.84 67.96 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 114.82 -1.082 . . . . 0.0 110.233 -179.051 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 93' ' ' ASP . . . . . 0.43 ' N ' ' OD1' ' A' ' 91' ' ' ASP . 0.6 OUTLIER -67.52 -42.46 82.76 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.815 -0.439 . . . . 0.0 109.815 179.254 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 94' ' ' SER . . . . . 0.516 ' CB ' HG23 ' A' ' 69' ' ' ILE . 6.4 m -60.79 -37.8 83.17 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.176 179.615 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 95' ' ' ILE . . . . . 0.403 ' CG1' HG23 ' A' ' 90' ' ' ILE . 61.4 mt -58.62 -38.32 70.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.243 -179.991 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -70.97 -40.81 71.72 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.206 -0.597 . . . . 0.0 111.337 -179.131 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 68.7 m-70 -62.35 -37.24 84.89 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 119.503 -0.879 . . . . 0.0 109.316 179.945 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.43 -33.92 76.15 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 178.374 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 6.3 mtt-85 -60.46 -36.77 79.04 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 120.166 -0.613 . . . . 0.0 109.347 178.628 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' ARG . . . . . 0.462 ' CG ' HH11 ' A' ' 100' ' ' ARG . 0.1 OUTLIER -57.89 -46.18 85.3 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.511 179.108 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 7.1 mp -65.56 -35.4 80.73 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.39 -179.65 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 2.5 t -68.63 -47.7 75.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.496 -0.32 . . . . 0.0 110.437 179.64 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 93.4 mt-10 -65.72 -42.05 91.55 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.702 -179.552 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 48.1 mt -68.3 -41.33 81.1 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.949 -0.3 . . . . 0.0 111.639 -178.582 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 105' ' ' ASN . . . . . 0.478 ' CG ' HG23 ' A' ' 14' ' ' ILE . 1.8 m-80 -68.91 -40.56 79.04 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.445 -0.502 . . . . 0.0 110.709 -179.871 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 2.1 tp -56.23 -47.29 78.74 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.781 0.324 . . . . 0.0 110.348 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 107' ' ' GLY . . . . . 0.582 ' O ' ' N ' ' A' ' 109' ' ' GLU . . . 64.66 94.67 0.02 OUTLIER Glycine 0 CA--C 1.523 0.565 0 N-CA-C 110.508 -1.037 . . . . 0.0 110.508 -179.855 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -44.37 86.3 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.844 0.354 . . . . 0.0 110.824 -179.805 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 109' ' ' GLU . . . . . 0.582 ' N ' ' O ' ' A' ' 107' ' ' GLY . 61.3 mt-10 -99.88 -81.14 0.47 Allowed 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.346 179.965 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 25.0 tt0 -174.77 -67.06 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.489 -179.879 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 111' ' ' LEU . . . . . 0.552 ' N ' HD12 ' A' ' 111' ' ' LEU . 8.1 mp 43.11 49.01 5.48 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.796 179.917 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.405 ' O ' ' O ' ' A' ' 113' ' ' GLU . 0.2 OUTLIER -78.03 74.86 4.57 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.989 0.423 . . . . 0.0 110.145 179.885 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 113' ' ' GLU . . . . . 0.405 ' O ' ' O ' ' A' ' 112' ' ' LEU . 21.0 tt0 56.39 108.35 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.353 -179.781 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 114' ' ' ARG . . . . . 0.427 ' HD2' HH11 ' A' ' 114' ' ' ARG . 5.6 ttm180 -109.37 -118.96 0.28 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.877 -179.713 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 115' ' ' GLU . . . . . 0.425 ' N ' ' HG2' ' A' ' 114' ' ' ARG . 6.0 tp10 -63.16 147.03 52.06 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.026 0.441 . . . . 0.0 110.845 -179.387 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 41.4 mt -67.12 -46.98 72.5 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.319 -179.95 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 117' ' ' ALA . . . . . 0.546 ' O ' ' N ' ' A' ' 121' ' ' SER . . . -59.76 -47.52 85.34 Favored 'General case' 0 C--N 1.332 -0.158 0 N-CA-C 112.849 0.685 . . . . 0.0 112.849 -178.169 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 25.4 mt -55.76 -48.8 74.65 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.267 -0.573 . . . . 0.0 111.362 -177.569 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 14.7 mt -73.56 -50.14 22.8 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 120.185 -0.606 . . . . 0.0 110.693 179.74 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 60.2 t -71.32 -20.29 21.19 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.306 0 N-CA-C 112.6 0.592 . . . . 0.0 112.6 -178.336 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 121' ' ' SER . . . . . 0.546 ' N ' ' O ' ' A' ' 117' ' ' ALA . 10.9 t -64.75 -41.33 95.99 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 119.403 -0.919 . . . . 0.0 110.179 -179.062 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -170.17 161.34 8.39 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.629 -0.428 . . . . 0.0 111.075 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 123' ' ' HIS . . . . . 0.407 ' CD2' ' C ' ' A' ' 123' ' ' HIS . 0.0 OUTLIER -160.18 158.25 29.77 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.004 -0.544 . . . . 0.0 109.778 179.058 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 124' ' ' ASP . . . . . 0.45 ' O ' ' OD1' ' A' ' 124' ' ' ASP . 15.0 t0 -160.85 69.38 0.36 Allowed 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 120.815 -0.354 . . . . 0.0 111.215 -178.899 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 . . . . . 0 C--O 1.22 -0.476 0 CA-C-O 117.963 -1.018 . . . . 0.0 110.526 -179.985 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 501' ' ' C2E . . . . . 0.959 ' O21' " H4'" ' A' ' 501' ' ' C2E . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 502' ' ' C2E . . . . . 0.668 ' C81' HH21 ' A' ' 8' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 11.1 mmt . . . . . 0 N--CA 1.491 1.578 0 N-CA-C 109.419 -0.586 . . . . 0.0 109.419 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 29.9 m -98.41 79.11 2.48 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.717 -179.908 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ASP . . . . . 0.474 ' C ' ' H ' ' A' ' 5' ' ' HIS . 1.5 p30 -99.62 -30.37 12.16 Favored 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 178.337 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.434 ' O ' ' CD ' ' A' ' 4' ' ' GLN . 0.3 OUTLIER -71.37 7.93 1.2 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.784 -0.644 . . . . 0.0 109.672 179.922 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 5' ' ' HIS . . . . . 0.474 ' H ' ' C ' ' A' ' 3' ' ' ASP . 24.8 m170 -100.95 28.37 5.32 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.679 -0.691 . . . . 0.0 109.918 179.462 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 50.5 m-20 -41.08 144.05 0.33 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.857 -179.298 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.457 ' OE1' ' N21' ' A' ' 502' ' ' C2E . 4.3 tt0 -80.74 134.14 35.78 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.69 179.938 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.825 ' H ' ' C61' ' A' ' 502' ' ' C2E . 0.0 OUTLIER -121.99 -13.82 8.14 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.451 179.824 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.714 ' O ' ' N ' ' A' ' 11' ' ' PHE . 1.7 mtt180 -96.05 69.54 2.79 Favored 'General case' 0 N--CA 1.469 0.487 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 179.47 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.501 ' C ' ' O ' ' A' ' 9' ' ' ARG . 0.0 OUTLIER 26.31 -79.65 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.836 -179.438 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 11' ' ' PHE . . . . . 0.714 ' N ' ' O ' ' A' ' 9' ' ' ARG . 0.3 OUTLIER -139.73 142.93 36.81 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 109.893 -0.41 . . . . 0.0 109.893 179.313 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 12' ' ' HIS . . . . . 0.427 ' C ' ' O ' ' A' ' 11' ' ' PHE . 64.2 m-70 -32.68 151.39 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.468 -179.354 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.448 ' NH1' ' N1 ' ' A' ' 501' ' ' C2E . 24.2 mtm180 -103.3 173.91 6.1 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.558 -179.732 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 40.5 mm -72.25 98.88 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.412 179.786 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -95.58 119.86 34.82 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.33 0.586 . . . . 0.0 111.663 -179.861 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -149.93 154.64 38.62 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.036 -0.983 . . . . 0.0 108.433 177.816 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -95.57 147.03 24.0 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 120.013 -0.675 . . . . 0.0 111.478 -178.328 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.508 ' O ' HD12 ' A' ' 32' ' ' LEU . . . -179.11 176.8 0.85 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.698 -0.683 . . . . 0.0 109.846 179.375 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 22.2 t0 -96.11 134.26 39.39 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.95 -179.737 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.594 ' O ' ' O ' ' A' ' 31' ' ' VAL . 21.5 p -134.37 154.06 51.55 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.135 0.493 . . . . 0.0 110.263 179.002 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 18.7 mt-10 -135.29 143.16 46.08 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 109.041 -0.726 . . . . 0.0 109.041 179.487 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -122.35 136.3 59.64 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 C-N-CA 120.21 -0.596 . . . . 0.0 110.986 -179.023 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.47 ' H ' HD12 ' A' ' 23' ' ' LEU . 0.2 OUTLIER -123.89 123.32 40.17 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.927 -179.44 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.696 ' NE2' ' CZ ' ' A' ' 57' ' ' PHE . 13.3 tt0 -131.15 102.7 6.11 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.32 -0.855 . . . . 0.0 109.635 178.858 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 78.56 -128.38 8.64 Favored Glycine 0 CA--C 1.522 0.524 0 N-CA-C 109.77 -1.332 . . . . 0.0 109.77 -178.94 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -98.89 11.24 39.42 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.675 0.274 . . . . 0.0 110.456 179.612 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.586 ' HB3' ' CZ2' ' A' ' 29' ' ' TRP . 0.6 OUTLIER -111.78 132.5 54.62 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 121.007 0.432 . . . . 0.0 112.011 -179.056 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.417 ' HG2' ' N ' ' A' ' 29' ' ' TRP . 4.5 ttt85 -126.79 147.43 50.01 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.8 -0.637 . . . . 0.0 109.947 178.931 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.623 ' HE1' ' CG ' ' A' ' 48' ' ' ASP . 6.5 m-90 -145.85 155.44 42.9 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.497 -179.0 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.52 ' OE1' ' N ' ' A' ' 30' ' ' GLU . 0.0 OUTLIER -99.33 138.53 36.3 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 178.982 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.594 ' O ' ' O ' ' A' ' 20' ' ' SER . 17.7 m -149.12 157.82 6.67 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-O 121.226 0.536 . . . . 0.0 110.947 -179.335 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.544 HD12 ' N ' ' A' ' 33' ' ' LEU . 8.2 tp -98.24 129.84 44.97 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 107.975 -1.12 . . . . 0.0 107.975 178.511 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.544 ' N ' HD12 ' A' ' 32' ' ' LEU . 1.9 tt -92.17 126.46 37.26 Favored 'General case' 0 C--N 1.325 -0.489 0 C-N-CA 120.271 -0.572 . . . . 0.0 109.61 -179.922 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 73.4 m-70 -90.46 -28.16 18.78 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.428 -0.805 . . . . 0.0 111.732 -178.299 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -172.44 161.46 5.11 Favored 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 119.635 -0.826 . . . . 0.0 111.205 177.578 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.532 HG22 ' H ' ' A' ' 37' ' ' SER . 4.8 p -144.92 168.99 8.57 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.165 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.949 -179.026 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.532 ' H ' HG22 ' A' ' 36' ' ' VAL . 9.4 t -141.88 170.55 15.5 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 107.924 -1.139 . . . . 0.0 107.924 178.717 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.916 ' O ' HD23 ' A' ' 38' ' ' LEU . 4.0 tt -67.13 -1.08 3.85 Favored 'General case' 0 C--N 1.322 -0.611 0 C-N-CA 119.691 -0.804 . . . . 0.0 110.58 -179.243 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' HIS . . . . . 0.539 ' CE1' ' O ' ' A' ' 87' ' ' CYS . 26.1 t60 -159.86 35.4 0.18 Allowed 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 120.642 -0.423 . . . . 0.0 111.609 179.926 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' GLY . . . . . 0.466 ' HA3' ' N3 ' ' A' ' 501' ' ' C2E . . . -171.83 155.59 24.17 Favored Glycine 0 CA--C 1.528 0.862 0 N-CA-C 111.135 -0.786 . . . . 0.0 111.135 179.79 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -147.33 149.09 15.89 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.454 0 CA-C-O 121.368 0.604 . . . . 0.0 111.774 -179.182 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -122.7 139.58 53.8 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 115.205 -0.907 . . . . 0.0 109.185 178.984 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.0 m -144.1 175.29 3.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 121.178 0.514 . . . . 0.0 111.709 -179.474 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -97.18 145.47 17.87 Favored Glycine 0 CA--C 1.531 1.073 0 N-CA-C 109.692 -1.363 . . . . 0.0 109.692 178.545 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' GLN . . . . . 0.541 ' NE2' ' O ' ' A' ' 46' ' ' PRO . 17.9 tm0? -87.65 114.3 58.32 Favored Pre-proline 0 N--CA 1.467 0.411 0 CA-C-N 117.954 0.877 . . . . 0.0 112.06 -178.467 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.541 ' O ' ' NE2' ' A' ' 45' ' ' GLN . 83.7 Cg_endo -84.24 161.5 13.26 Favored 'Trans proline' 0 C--N 1.308 -1.557 0 C-N-CA 121.569 1.513 . . . . 0.0 110.97 178.524 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -65.26 -40.17 93.62 Favored 'General case' 0 N--CA 1.465 0.317 0 N-CA-C 112.7 0.629 . . . . 0.0 112.7 -178.621 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.623 ' CG ' ' HE1' ' A' ' 29' ' ' TRP . 38.5 t0 -73.95 8.84 1.79 Allowed 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 112.068 0.396 . . . . 0.0 112.068 -178.571 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' TRP . . . . . 0.475 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 65.2 t-105 -59.17 69.32 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 111.636 0.235 . . . . 0.0 111.636 -179.781 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' ASN . . . . . 0.547 ' N ' ' O ' ' A' ' 48' ' ' ASP . 62.4 t-20 -93.41 78.82 4.4 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 120.203 -0.599 . . . . 0.0 110.019 178.913 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -142.52 159.48 27.22 Favored Glycine 0 CA--C 1.526 0.731 0 N-CA-C 111.22 -0.752 . . . . 0.0 111.22 -179.765 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 45.3 t0 -95.26 109.05 42.85 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-N 115.759 -0.22 . . . . 0.0 111.022 -179.544 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 78.1 Cg_exo -47.27 -22.69 2.59 Favored 'Trans proline' 0 N--CA 1.493 1.485 0 C-N-CA 122.358 2.039 . . . . 0.0 112.077 179.532 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.51 -23.84 53.7 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.285 -179.386 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.487 ' O ' ' CE1' ' A' ' 57' ' ' PHE . 26.6 mtm180 -95.26 155.22 39.1 Favored Pre-proline 0 N--CA 1.463 0.207 0 C-N-CA 120.616 -0.434 . . . . 0.0 110.22 179.635 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' PRO . . . . . 0.535 ' O ' ' NE2' ' A' ' 24' ' ' GLN . 9.3 Cg_exo -66.92 160.73 45.63 Favored 'Trans proline' 0 N--CA 1.493 1.49 0 C-N-CA 122.685 2.256 . . . . 0.0 113.305 -178.864 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.696 ' CZ ' ' NE2' ' A' ' 24' ' ' GLN . 49.3 m-85 -130.76 155.31 46.86 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 114.851 -1.068 . . . . 0.0 108.937 179.313 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -122.16 139.17 54.06 Favored 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 178.326 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -119.77 137.69 53.8 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 112.217 0.451 . . . . 0.0 112.217 -178.059 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 13.0 mtt180 -123.17 127.6 48.88 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 108.623 -0.88 . . . . 0.0 108.623 177.385 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.478 HD11 ' SD ' ' A' ' 71' ' ' MET . 9.7 mt -109.39 150.98 27.25 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.942 0.401 . . . . 0.0 110.757 -178.966 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' TYR . . . . . 0.425 ' CD1' ' N ' ' A' ' 62' ' ' TYR . 20.1 m-85 -132.61 109.68 9.91 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.438 179.73 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.484 HD23 ' C ' ' A' ' 63' ' ' LEU . 1.9 tt -104.55 -82.48 0.51 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.731 -0.668 . . . . 0.0 109.398 179.501 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.471 ' H ' ' HB ' ' A' ' 67' ' ' VAL . . . -78.68 179.01 52.82 Favored Glycine 0 CA--C 1.522 0.497 0 N-CA-C 109.156 -1.578 . . . . 0.0 109.156 178.423 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.698 ' N ' HD22 ' A' ' 65' ' ' LEU . 3.1 mm? -74.22 -33.06 63.25 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 119.827 -0.749 . . . . 0.0 110.118 -179.498 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -101.96 9.32 40.61 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.95 179.929 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.564 ' O ' HG12 ' A' ' 67' ' ' VAL . 8.9 t -106.08 95.91 4.18 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.242 0 CA-C-O 121.309 0.576 . . . . 0.0 111.807 -178.621 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 6.5 tp -113.1 117.46 32.03 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 108.169 -1.049 . . . . 0.0 108.169 178.176 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.502 HG23 ' HB3' ' A' ' 94' ' ' SER . 3.5 mt -111.04 142.92 22.02 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-O 120.97 0.414 . . . . 0.0 110.836 -178.962 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 5.7 ttp180 -128.2 130.97 48.83 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.734 179.572 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' MET . . . . . 0.478 ' SD ' HD11 ' A' ' 61' ' ' LEU . 0.0 OUTLIER -139.64 147.4 40.98 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.643 179.846 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -106.38 123.74 48.53 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 107.52 -1.289 . . . . 0.0 107.52 178.257 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.713 HD12 ' CB ' ' A' ' 85' ' ' PHE . 3.8 pt -134.47 162.35 39.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 N-CA-C 113.348 0.87 . . . . 0.0 113.348 -176.923 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 1.9 t -119.0 148.58 42.84 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 114.808 -1.087 . . . . 0.0 108.71 178.251 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.429 ' HA ' ' CD1' ' A' ' 85' ' ' PHE . 2.3 tt -66.46 126.74 29.79 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.569 0.7 . . . . 0.0 110.119 -179.127 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -98.2 -41.39 7.92 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 114.923 -1.035 . . . . 0.0 110.928 178.284 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' TRP . . . . . 0.548 ' CZ3' " H1'" ' A' ' 502' ' ' C2E . 69.2 p-90 -169.59 171.94 7.24 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.096 -179.409 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -149.19 123.13 9.37 Favored 'General case' 0 N--CA 1.465 0.301 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 177.725 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 20.4 ttt-85 -152.91 134.66 14.59 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 119.775 -0.77 . . . . 0.0 113.033 -179.882 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 56.54 46.84 19.78 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 113.372 0.878 . . . . 0.0 113.372 176.586 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 80.82 -25.22 3.53 Favored Glycine 0 CA--C 1.524 0.632 0 C-N-CA 120.485 -0.864 . . . . 0.0 113.082 177.479 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 7.6 mt -89.76 161.41 16.05 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 117.882 0.841 . . . . 0.0 110.825 -178.948 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 54.3 mt -136.37 136.24 39.48 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.278 -179.308 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' GLY . . . . . 0.545 ' HA3' ' NE1' ' A' ' 77' ' ' TRP . . . -109.61 156.2 15.72 Favored Glycine 0 N--CA 1.451 -0.316 0 N-CA-C 109.294 -1.522 . . . . 0.0 109.294 178.169 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 85' ' ' PHE . . . . . 0.713 ' CB ' HD12 ' A' ' 73' ' ' ILE . 81.4 m-85 -145.46 143.3 29.94 Favored 'General case' 0 C--N 1.318 -0.788 0 C-N-CA 120.829 -0.348 . . . . 0.0 110.214 -179.655 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.485 ' OE2' ' CD2' ' A' ' 39' ' ' HIS . 14.5 tm-20 -103.37 128.74 50.4 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 179.276 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 87' ' ' CYS . . . . . 0.539 ' O ' ' CE1' ' A' ' 39' ' ' HIS . 41.0 t -78.28 127.14 31.8 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 112.267 0.469 . . . . 0.0 112.267 -178.236 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 1.5 pt20 -102.98 -27.99 12.28 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.462 179.367 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' HIS . . . . . 0.558 ' ND1' ' N ' ' A' ' 90' ' ' ILE . 0.0 OUTLIER -160.46 141.28 11.88 Favored 'General case' 0 C--O 1.227 -0.104 0 CA-C-O 121.019 0.438 . . . . 0.0 110.55 179.433 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.558 ' N ' ' ND1' ' A' ' 89' ' ' HIS . 9.3 tt -145.74 141.16 21.99 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.966 -179.843 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 5.5 t0 -54.67 141.9 30.38 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 115.334 -0.848 . . . . 0.0 112.23 -178.248 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.434 ' HA ' HD12 ' A' ' 95' ' ' ILE . 57.3 tp -54.12 -41.97 68.93 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 114.929 -1.032 . . . . 0.0 109.979 -179.704 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -68.89 -41.53 78.15 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 109.558 -0.534 . . . . 0.0 109.558 179.228 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' SER . . . . . 0.502 ' HB3' HG23 ' A' ' 69' ' ' ILE . 13.4 m -61.39 -37.3 82.93 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.863 -0.608 . . . . 0.0 109.878 179.325 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 95' ' ' ILE . . . . . 0.457 ' CG1' HG23 ' A' ' 90' ' ' ILE . 47.6 mt -58.62 -38.03 68.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 115.635 -0.712 . . . . 0.0 110.011 179.74 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -70.86 -37.79 73.11 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 120.266 -0.574 . . . . 0.0 110.686 -179.465 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 97' ' ' HIS . . . . . 0.448 ' O ' ' HB2' ' A' ' 100' ' ' ARG . 73.5 m-70 -66.47 -37.97 86.3 Favored 'General case' 0 C--N 1.326 -0.448 0 C-N-CA 119.657 -0.817 . . . . 0.0 109.235 179.491 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 1.9 mp -67.85 -34.09 76.02 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 177.906 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 15.3 mtp-105 -65.24 -37.1 86.21 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 178.489 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' ARG . . . . . 0.448 ' HB2' ' O ' ' A' ' 97' ' ' HIS . 2.8 mmt180 -57.59 -37.84 73.88 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.626 178.635 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.428 ' O ' ' OD1' ' A' ' 105' ' ' ASN . 15.6 mt -68.86 -37.4 79.07 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.38 -179.448 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 102' ' ' VAL . . . . . 0.419 ' O ' ' CB ' ' A' ' 106' ' ' LEU . 72.6 t -68.5 -47.35 77.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.095 -179.909 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -65.14 -44.44 88.63 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.484 -179.248 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.469 ' CD2' ' N ' ' A' ' 104' ' ' LEU . 1.3 mm? -70.93 -42.82 69.34 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.519 -0.309 . . . . 0.0 111.345 -179.282 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 105' ' ' ASN . . . . . 0.428 ' OD1' ' O ' ' A' ' 101' ' ' LEU . 1.5 m-20 -74.16 -34.68 63.91 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 120.741 -0.384 . . . . 0.0 110.827 -179.554 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.481 HD23 ' C ' ' A' ' 106' ' ' LEU . 6.5 tt -61.69 -23.45 66.11 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.323 179.781 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -52.7 -91.81 0.01 OUTLIER Glycine 0 CA--C 1.522 0.495 0 N-CA-C 110.667 -0.973 . . . . 0.0 110.667 -179.855 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 174.73 38.15 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.913 0.387 . . . . 0.0 110.699 179.851 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -67.21 -75.74 0.09 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.447 179.858 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 110' ' ' GLU . . . . . 0.484 ' CD ' ' N ' ' A' ' 111' ' ' LEU . 0.0 OUTLIER -51.78 -19.72 1.8 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.942 0.401 . . . . 0.0 110.076 179.779 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 111' ' ' LEU . . . . . 0.506 ' C ' ' H ' ' A' ' 113' ' ' GLU . 0.5 OUTLIER 68.58 -55.96 0.52 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.667 179.802 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER 72.86 -17.78 0.39 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.215 -179.992 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 113' ' ' GLU . . . . . 0.506 ' H ' ' C ' ' A' ' 111' ' ' LEU . 17.1 tt0 47.7 36.83 6.05 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.595 179.902 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 114' ' ' ARG . . . . . 0.462 ' HA ' HH11 ' A' ' 114' ' ' ARG . 3.7 tpt85 -174.81 155.62 2.13 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.44 179.949 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 16.9 tp10 -168.33 -51.55 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.384 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.424 ' O ' ' HB2' ' A' ' 119' ' ' LEU . 17.2 mt -67.38 -34.12 76.62 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.112 -179.856 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 117' ' ' ALA . . . . . 0.543 ' O ' HG23 ' A' ' 120' ' ' VAL . . . -67.58 -24.29 65.49 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 120.037 -0.665 . . . . 0.0 109.316 -179.608 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.464 ' C ' ' N ' ' A' ' 120' ' ' VAL . 18.1 mt -63.59 -31.01 72.04 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 114.858 -1.065 . . . . 0.0 109.823 178.24 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 119' ' ' LEU . . . . . 0.505 ' HA ' HD22 ' A' ' 119' ' ' LEU . 0.3 OUTLIER -55.28 -11.27 0.73 Allowed 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 -179.14 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 120' ' ' VAL . . . . . 0.543 HG23 ' O ' ' A' ' 117' ' ' ALA . 55.6 t -64.74 -8.08 4.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.544 -0.753 . . . . 0.0 109.809 175.307 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 22.1 p -92.64 -22.54 19.4 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.063 -178.92 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -89.33 -102.51 0.09 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.937 0.398 . . . . 0.0 110.346 179.777 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 123' ' ' HIS . . . . . 0.422 ' ND1' ' C ' ' A' ' 123' ' ' HIS . 0.0 OUTLIER 179.89 150.17 0.36 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.391 179.75 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 6.4 p30 -139.94 35.17 1.95 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.782 0.325 . . . . 0.0 110.556 -179.823 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 25.2 m-20 . . . . . 0 C--O 1.22 -0.456 0 CA-C-O 118.074 -0.965 . . . . 0.0 110.448 -179.833 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 501' ' ' C2E . . . . . 0.58 ' C21' HH21 ' A' ' 8' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 502' ' ' C2E . . . . . 0.825 ' C61' ' H ' ' A' ' 8' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.536 ' O ' ' CB ' ' A' ' 2' ' ' SER . 3.3 mmt . . . . . 0 N--CA 1.491 1.596 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.536 ' CB ' ' O ' ' A' ' 1' ' ' MET . 0.9 OUTLIER 91.67 -6.37 0.23 Allowed 'General case' 0 N--CA 1.463 0.22 0 CA-C-O 120.929 0.395 . . . . 0.0 109.967 -179.277 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -99.8 36.62 1.77 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.863 -0.608 . . . . 0.0 109.73 178.054 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.511 ' O ' ' NH1' ' A' ' 8' ' ' ARG . 38.3 mm-40 -114.84 -21.76 9.98 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.493 178.005 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' HIS . . . . . 0.418 ' O ' ' C ' ' A' ' 6' ' ' ASP . 10.7 m170 -60.76 -4.45 0.97 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.924 0.393 . . . . 0.0 110.094 179.651 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' ASP . . . . . 0.44 ' H ' ' C ' ' A' ' 4' ' ' GLN . 3.0 m-20 -36.27 143.32 0.07 Allowed 'General case' 0 C--N 1.333 -0.118 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.833 179.673 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.423 ' CD ' ' O ' ' A' ' 121' ' ' SER . 9.4 tt0 -82.17 130.88 35.2 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.65 -179.877 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.754 ' H ' ' C61' ' A' ' 502' ' ' C2E . 0.0 OUTLIER -124.51 -8.65 7.44 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.662 -179.609 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.822 ' O ' ' N ' ' A' ' 11' ' ' PHE . 3.6 mtt180 -99.05 75.98 2.08 Favored 'General case' 0 N--CA 1.464 0.232 0 N-CA-C 109.91 -0.404 . . . . 0.0 109.91 179.963 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.54 ' C ' ' O ' ' A' ' 9' ' ' ARG . 0.0 OUTLIER 16.74 -68.91 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.63 0 O-C-N 123.858 0.724 . . . . 0.0 111.427 -179.441 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 11' ' ' PHE . . . . . 0.822 ' N ' ' O ' ' A' ' 9' ' ' ARG . 0.1 OUTLIER -135.48 141.44 45.34 Favored 'General case' 0 CA--C 1.53 0.207 0 N-CA-C 109.751 -0.463 . . . . 0.0 109.751 179.615 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 5.8 p80 -41.01 151.29 0.06 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.824 0.345 . . . . 0.0 111.03 -179.652 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.706 HH12 ' NH1' ' A' ' 9' ' ' ARG . 3.4 mtm-85 -97.19 -172.13 2.36 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.498 -179.82 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 42.2 mm -94.82 98.05 7.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.887 -179.684 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -93.75 120.39 33.96 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.315 0.579 . . . . 0.0 111.19 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 2.3 p90 -149.76 157.66 43.42 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.164 -0.926 . . . . 0.0 108.683 178.045 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -95.6 146.21 24.65 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 120.343 -0.543 . . . . 0.0 110.502 -179.472 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . 179.32 174.45 0.76 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.367 179.703 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -96.15 133.84 39.94 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.544 179.924 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.531 ' O ' ' O ' ' A' ' 31' ' ' VAL . 3.3 p -134.64 154.11 51.66 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.976 0.417 . . . . 0.0 110.18 179.076 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -132.93 143.67 49.63 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.172 -0.677 . . . . 0.0 109.172 179.427 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 53.3 mt -124.33 136.41 60.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 C-N-CA 120.176 -0.61 . . . . 0.0 111.184 -179.477 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.596 ' H ' HD12 ' A' ' 23' ' ' LEU . 0.0 OUTLIER -121.11 123.39 42.2 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.659 -179.34 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.555 HE22 ' HA2' ' A' ' 51' ' ' GLY . 0.0 OUTLIER -130.78 101.9 5.86 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.135 -0.939 . . . . 0.0 109.551 179.361 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 78.37 -129.08 9.1 Favored Glycine 0 CA--C 1.523 0.553 0 N-CA-C 109.785 -1.326 . . . . 0.0 109.785 -178.668 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 19.2 pt-20 -98.81 11.49 38.56 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.903 0.382 . . . . 0.0 110.21 179.367 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.486 ' HB3' ' CZ2' ' A' ' 29' ' ' TRP . 1.1 mpt_? -112.42 133.79 54.31 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.074 -0.512 . . . . 0.0 112.01 -178.922 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 17.2 ttt180 -127.12 149.58 49.88 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.873 -0.603 . . . . 0.0 109.764 178.777 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.566 ' NE1' ' O ' ' A' ' 48' ' ' ASP . 6.1 m-90 -147.74 156.45 42.76 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.769 -178.927 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 78.1 mt-10 -99.3 131.3 45.42 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.693 -0.685 . . . . 0.0 109.212 178.81 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.531 ' O ' ' O ' ' A' ' 20' ' ' SER . 14.4 m -137.15 154.7 31.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-O 121.256 0.551 . . . . 0.0 111.214 -179.504 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 13.0 tp -95.23 126.57 40.64 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 108.531 -0.914 . . . . 0.0 108.531 178.987 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.471 ' HG ' ' N ' ' A' ' 34' ' ' HIS . 2.3 tt -83.02 150.75 26.15 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 179.631 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' HIS . . . . . 0.471 ' N ' ' HG ' ' A' ' 33' ' ' LEU . 64.7 m-70 -123.01 -28.33 4.08 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.155 179.604 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.543 ' CG ' HH21 ' A' ' 13' ' ' ARG . 2.3 p30 -173.83 160.62 3.65 Favored 'General case' 0 C--N 1.327 -0.413 0 C-N-CA 119.802 -0.759 . . . . 0.0 111.109 176.953 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.538 HG22 ' N ' ' A' ' 37' ' ' SER . 6.5 p -145.24 169.08 7.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.146 -179.06 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.538 ' N ' HG22 ' A' ' 36' ' ' VAL . 29.8 t -142.17 167.68 21.55 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 107.985 -1.117 . . . . 0.0 107.985 178.6 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 2.7 pp -62.99 -0.16 0.65 Allowed 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 119.758 -0.777 . . . . 0.0 110.963 -179.157 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' HIS . . . . . 0.427 ' H ' ' C ' ' A' ' 37' ' ' SER . 0.4 OUTLIER -165.61 43.04 0.07 Allowed 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 120.793 -0.363 . . . . 0.0 111.467 -179.91 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 40' ' ' GLY . . . . . 0.428 ' HA3' ' N3 ' ' A' ' 501' ' ' C2E . . . -178.85 154.95 15.09 Favored Glycine 0 CA--C 1.528 0.881 0 N-CA-C 110.816 -0.914 . . . . 0.0 110.816 179.812 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.426 ' CG2' HG21 ' A' ' 73' ' ' ILE . 0.1 OUTLIER -148.21 148.77 15.84 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.238 0 CA-C-O 121.469 0.652 . . . . 0.0 111.873 -178.9 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.458 HD23 ' N ' ' A' ' 43' ' ' VAL . 0.9 OUTLIER -120.79 132.42 55.02 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 114.813 -1.085 . . . . 0.0 108.187 178.355 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.458 ' N ' HD23 ' A' ' 42' ' ' LEU . 5.4 m -139.26 175.9 6.88 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-O 121.368 0.604 . . . . 0.0 111.821 -178.737 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -98.0 143.87 16.94 Favored Glycine 0 CA--C 1.529 0.968 0 N-CA-C 109.758 -1.337 . . . . 0.0 109.758 178.148 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' GLN . . . . . 0.483 ' O ' ' OE1' ' A' ' 45' ' ' GLN . 1.7 tm0? -85.78 117.73 69.26 Favored Pre-proline 0 N--CA 1.466 0.345 0 CA-C-N 117.625 0.713 . . . . 0.0 111.686 -178.78 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_endo -86.79 161.76 9.1 Favored 'Trans proline' 0 C--N 1.311 -1.446 0 C-N-CA 121.628 1.552 . . . . 0.0 111.037 178.687 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.579 ' CD ' ' H ' ' A' ' 47' ' ' GLN . 1.2 mp0 -65.49 -40.63 93.31 Favored 'General case' 0 N--CA 1.467 0.407 0 N-CA-C 112.604 0.594 . . . . 0.0 112.604 -178.877 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.566 ' O ' ' NE1' ' A' ' 29' ' ' TRP . 1.2 m-20 -72.2 8.56 1.27 Allowed 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 111.866 0.321 . . . . 0.0 111.866 -178.371 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' TRP . . . . . 0.463 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 63.5 t-105 -60.13 68.9 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.55 -0.295 . . . . 0.0 111.717 -179.521 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' ASN . . . . . 0.533 ' N ' ' O ' ' A' ' 48' ' ' ASP . 30.8 t-20 -93.35 78.76 4.44 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 120.074 -0.651 . . . . 0.0 109.806 178.737 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' GLY . . . . . 0.555 ' HA2' HE22 ' A' ' 24' ' ' GLN . . . -143.93 151.22 23.19 Favored Glycine 0 CA--C 1.525 0.707 0 N-CA-C 110.896 -0.882 . . . . 0.0 110.896 -179.729 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 11.0 t0 -88.17 114.18 58.29 Favored Pre-proline 0 CA--C 1.536 0.415 0 CA-C-O 120.339 0.114 . . . . 0.0 111.014 -179.677 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_exo -46.93 -22.42 2.0 Favored 'Trans proline' 0 N--CA 1.497 1.694 0 C-N-CA 122.735 2.29 . . . . 0.0 112.671 179.618 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -78.27 -24.12 46.94 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 120.571 -0.452 . . . . 0.0 111.894 -178.632 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.553 ' O ' ' CE1' ' A' ' 57' ' ' PHE . 12.7 mtp85 -93.9 152.59 40.69 Favored Pre-proline 0 C--N 1.33 -0.247 0 C-N-CA 120.598 -0.441 . . . . 0.0 110.177 179.839 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_endo -65.01 160.57 40.89 Favored 'Trans proline' 0 N--CA 1.495 1.565 0 C-N-CA 122.734 2.289 . . . . 0.0 112.93 -178.912 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.553 ' CE1' ' O ' ' A' ' 55' ' ' ARG . 43.1 m-85 -130.41 156.43 44.76 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.094 -0.957 . . . . 0.0 109.17 179.469 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.428 ' O ' HD12 ' A' ' 23' ' ' LEU . 35.8 mt-10 -123.1 136.8 54.95 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 178.357 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' ALA . . . . . 0.602 ' HB2' ' CD1' ' A' ' 73' ' ' ILE . . . -116.66 136.08 53.26 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.097 0.475 . . . . 0.0 111.931 -178.152 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 16.1 mmm-85 -123.02 127.56 48.95 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 177.864 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 6.9 mt -105.99 151.06 25.1 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.063 0.458 . . . . 0.0 111.243 -178.43 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' TYR . . . . . 0.478 ' N ' ' CD1' ' A' ' 62' ' ' TYR . 13.6 m-85 -135.88 108.9 7.66 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.002 179.291 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -105.34 -81.3 0.54 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.681 -0.69 . . . . 0.0 109.589 179.911 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.472 ' H ' ' HB ' ' A' ' 67' ' ' VAL . . . -78.82 -176.44 47.93 Favored Glycine 0 CA--C 1.521 0.428 0 N-CA-C 109.254 -1.538 . . . . 0.0 109.254 178.421 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.616 HD23 ' H ' ' A' ' 65' ' ' LEU . 0.3 OUTLIER -76.39 -33.34 58.88 Favored 'General case' 0 C--N 1.329 -0.326 0 C-N-CA 119.918 -0.713 . . . . 0.0 110.59 -179.62 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.41 ' O ' ' OD1' ' A' ' 66' ' ' ASP . 48.2 t0 -103.06 9.21 38.64 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 122.753 0.421 . . . . 0.0 111.075 -179.789 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.472 ' HB ' ' H ' ' A' ' 64' ' ' GLY . 28.7 t -103.33 95.21 3.66 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.249 0 CA-C-O 121.288 0.566 . . . . 0.0 111.698 -178.652 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.661 HD12 ' N ' ' A' ' 69' ' ' ILE . 1.3 tp -114.2 117.6 31.65 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 178.917 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.661 ' N ' HD12 ' A' ' 68' ' ' LEU . 18.7 mm -113.15 145.24 19.35 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.252 0 CA-C-O 121.012 0.434 . . . . 0.0 111.726 -178.422 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 3.2 ptm180 -128.51 133.42 48.44 Favored 'General case' 0 C--O 1.239 0.502 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.078 179.133 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -146.16 150.42 35.84 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.273 -0.876 . . . . 0.0 110.144 -179.765 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -103.81 128.2 51.25 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 107.851 -1.166 . . . . 0.0 107.851 178.335 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.602 ' CD1' ' HB2' ' A' ' 59' ' ' ALA . 14.5 pt -135.97 156.98 38.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 C-N-CA 119.995 -0.682 . . . . 0.0 112.757 -177.594 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 31.3 t -122.41 151.35 41.34 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 114.781 -1.1 . . . . 0.0 109.903 179.195 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.56 HD12 ' CE1' ' A' ' 85' ' ' PHE . 7.1 tp -66.21 121.2 14.66 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.184 0.516 . . . . 0.0 110.365 -179.68 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -97.57 -42.57 7.62 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 115.454 -0.793 . . . . 0.0 110.522 178.175 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' TRP . . . . . 0.586 ' NE1' ' HA3' ' A' ' 84' ' ' GLY . 66.8 p-90 -168.52 167.37 11.69 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 115.419 -0.809 . . . . 0.0 110.084 -179.357 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -147.51 123.77 10.89 Favored 'General case' 0 N--CA 1.465 0.325 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 178.612 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 33.9 ttt85 -152.4 134.29 14.81 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 119.789 -0.764 . . . . 0.0 113.043 179.87 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 57.05 47.3 17.7 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 113.781 1.03 . . . . 0.0 113.781 176.839 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 82.78 -27.48 3.82 Favored Glycine 0 CA--C 1.522 0.495 0 C-N-CA 120.292 -0.956 . . . . 0.0 113.28 177.075 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 3.9 mt -89.67 158.85 17.4 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 117.744 0.772 . . . . 0.0 110.153 -179.096 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 63.4 mt -130.68 135.44 47.83 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.387 -179.119 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' GLY . . . . . 0.586 ' HA3' ' NE1' ' A' ' 77' ' ' TRP . . . -93.93 151.69 20.38 Favored Glycine 0 N--CA 1.448 -0.561 0 N-CA-C 109.477 -1.449 . . . . 0.0 109.477 178.434 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 85' ' ' PHE . . . . . 0.56 ' CE1' HD12 ' A' ' 75' ' ' LEU . 26.8 m-85 -145.81 131.3 18.73 Favored 'General case' 0 C--N 1.317 -0.823 0 C-N-CA 120.647 -0.421 . . . . 0.0 110.692 -179.234 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.527 ' OE1' ' NE2' ' A' ' 88' ' ' GLN . 4.0 tt0 -103.76 127.56 51.23 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 179.664 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 87' ' ' CYS . . . . . 0.531 ' HA ' HG22 ' A' ' 73' ' ' ILE . 4.9 t -70.67 122.77 20.42 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.929 0.395 . . . . 0.0 111.907 -178.616 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 88' ' ' GLN . . . . . 0.527 ' NE2' ' OE1' ' A' ' 86' ' ' GLU . 32.0 mm-40 -94.74 -32.43 13.33 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.898 -0.592 . . . . 0.0 109.774 179.16 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 89' ' ' HIS . . . . . 0.498 ' ND1' ' N ' ' A' ' 90' ' ' ILE . 0.0 OUTLIER -163.38 143.72 8.93 Favored 'General case' 0 C--O 1.223 -0.316 0 CA-C-N 115.74 -0.664 . . . . 0.0 109.984 179.751 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.498 ' N ' ' ND1' ' A' ' 89' ' ' HIS . 10.7 tt -144.89 141.06 23.32 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-O 121.379 0.609 . . . . 0.0 109.918 -179.83 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 91' ' ' ASP . . . . . 0.553 ' O ' ' OG ' ' A' ' 94' ' ' SER . 4.7 t0 -56.43 142.11 39.8 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-N 115.209 -0.905 . . . . 0.0 112.1 -177.903 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 3.7 tp -54.44 -41.56 69.55 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 114.885 -1.052 . . . . 0.0 109.895 -179.635 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -70.51 -37.71 74.2 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.208 179.45 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' SER . . . . . 0.553 ' OG ' ' O ' ' A' ' 91' ' ' ASP . 2.2 p -63.16 -35.18 79.44 Favored 'General case' 0 C--N 1.333 -0.149 0 N-CA-C 109.841 -0.429 . . . . 0.0 109.841 179.706 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 36.2 mt -62.08 -39.16 82.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.209 179.539 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -70.53 -42.73 70.83 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.386 -0.526 . . . . 0.0 111.785 -178.371 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 97' ' ' HIS . . . . . 0.488 ' O ' ' HB2' ' A' ' 100' ' ' ARG . 57.4 m-70 -62.7 -40.17 96.31 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 119.153 -1.019 . . . . 0.0 109.264 -179.778 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 3.4 tp -66.46 -33.61 76.09 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 177.996 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 11.3 mtt-85 -57.74 -35.76 71.15 Favored 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 119.871 -0.732 . . . . 0.0 109.439 178.385 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' ARG . . . . . 0.488 ' HB2' ' O ' ' A' ' 97' ' ' HIS . 11.2 mmt180 -58.39 -47.69 83.04 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 121.178 0.513 . . . . 0.0 110.596 178.973 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -66.84 -34.35 77.62 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.381 -179.803 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 71.8 t -68.63 -47.06 78.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-O 120.929 0.395 . . . . 0.0 110.555 179.512 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.2 tm-20 -65.42 -42.63 92.29 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.386 -179.436 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 28.2 mt -65.04 -42.38 94.34 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 120.796 -0.362 . . . . 0.0 110.487 -179.714 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 49.8 m-80 -74.59 -50.79 16.57 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.21 179.399 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 52.0 tp -57.6 -18.69 21.27 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 179.398 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -91.67 140.82 15.37 Favored Glycine 0 CA--C 1.52 0.378 0 N-CA-C 110.711 -0.955 . . . . 0.0 110.711 179.875 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -93.33 150.07 20.75 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 120.92 -0.312 . . . . 0.0 110.458 -179.927 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 16.6 tt0 -89.79 -142.16 0.15 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.263 179.973 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 110' ' ' GLU . . . . . 0.408 ' O ' ' CD ' ' A' ' 110' ' ' GLU . 2.2 tm-20 -66.55 -34.59 78.25 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.354 179.79 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 111' ' ' LEU . . . . . 0.588 HD23 ' N ' ' A' ' 112' ' ' LEU . 0.8 OUTLIER -48.23 136.0 12.65 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.382 179.942 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.588 ' N ' HD23 ' A' ' 111' ' ' LEU . 3.7 mt -38.82 129.58 1.51 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.743 179.996 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 9.7 mt-10 -76.75 134.61 39.11 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.193 179.72 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 114' ' ' ARG . . . . . 0.578 ' C ' ' H ' ' A' ' 116' ' ' LEU . 2.8 ttm180 -146.11 -76.56 0.2 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.745 -179.958 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 62.6 tt0 63.48 -9.0 0.14 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.079 0.466 . . . . 0.0 110.397 -179.921 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.578 ' H ' ' C ' ' A' ' 114' ' ' ARG . 55.3 tp -67.6 -35.67 79.41 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.877 -0.601 . . . . 0.0 112.531 -179.096 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -62.77 -23.02 67.0 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.26 -0.576 . . . . 0.0 110.826 -177.854 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.433 ' O ' ' CB ' ' A' ' 121' ' ' SER . 13.0 mt -58.54 -32.89 69.31 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.234 -0.894 . . . . 0.0 109.546 178.47 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -56.92 -43.6 81.61 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 107.926 -1.139 . . . . 0.0 107.926 179.708 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 20.1 t -57.39 -9.71 0.87 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 178.199 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 121' ' ' SER . . . . . 0.607 ' O ' ' HB2' ' A' ' 122' ' ' ALA . 1.0 OUTLIER -87.49 22.05 2.32 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 178.052 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 122' ' ' ALA . . . . . 0.607 ' HB2' ' O ' ' A' ' 121' ' ' SER . . . 164.94 -162.65 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.236 -0.893 . . . . 0.0 109.908 -179.736 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 123' ' ' HIS . . . . . 0.644 ' CG ' ' N ' ' A' ' 124' ' ' ASP . 0.0 OUTLIER 76.95 -52.04 0.57 Allowed 'General case' 0 C--N 1.333 -0.114 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 -178.883 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 124' ' ' ASP . . . . . 0.644 ' N ' ' CG ' ' A' ' 123' ' ' HIS . 24.3 m-20 2.32 84.41 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 115.747 -0.66 . . . . 0.0 112.026 179.656 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 17.7 p-10 . . . . . 0 C--O 1.221 -0.447 0 CA-C-O 118.042 -0.98 . . . . 0.0 110.415 179.786 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 501' ' ' C2E . . . . . 0.562 ' N71' ' CG ' ' A' ' 9' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 502' ' ' C2E . . . . . 0.754 ' C61' ' H ' ' A' ' 8' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.557 ' O ' ' CB ' ' A' ' 2' ' ' SER . 5.6 mmt . . . . . 0 N--CA 1.491 1.595 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.557 ' CB ' ' O ' ' A' ' 1' ' ' MET . 6.6 p 92.2 34.0 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.395 -179.526 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 10.1 p30 -100.07 22.11 11.81 Favored 'General case' 0 C--N 1.332 -0.179 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 177.73 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.472 ' C ' ' H ' ' A' ' 6' ' ' ASP . 2.1 mm-40 -113.84 -21.6 10.58 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 115.531 -0.759 . . . . 0.0 109.9 178.395 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' HIS . . . . . 0.418 ' O ' ' C ' ' A' ' 6' ' ' ASP . 5.8 m-70 -66.69 3.95 0.91 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.102 179.305 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' ASP . . . . . 0.472 ' H ' ' C ' ' A' ' 4' ' ' GLN . 42.5 m-20 -37.77 147.05 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.123 179.961 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -80.4 134.2 35.98 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.149 0.5 . . . . 0.0 110.998 -179.358 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.619 HH21 ' C21' ' A' ' 501' ' ' C2E . 0.0 OUTLIER -121.27 -13.73 8.44 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.732 -179.952 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.751 ' O ' ' N ' ' A' ' 11' ' ' PHE . 3.8 ptt85 -110.19 69.63 0.7 Allowed 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 121.104 0.478 . . . . 0.0 109.938 179.794 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.611 ' CG ' HH11 ' A' ' 10' ' ' ARG . 0.0 OUTLIER 37.78 -72.65 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.044 -0.98 . . . . 0.0 111.799 -179.865 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 11' ' ' PHE . . . . . 0.751 ' N ' ' O ' ' A' ' 9' ' ' ARG . 6.0 m-85 -148.23 170.31 18.15 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 120.824 0.345 . . . . 0.0 110.571 -179.613 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 4.2 p-80 -61.81 141.58 57.84 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.298 179.795 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.742 ' HE ' ' H ' ' A' ' 13' ' ' ARG . 0.5 OUTLIER -88.4 -174.38 4.58 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.592 -179.69 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.782 ' N ' HD12 ' A' ' 14' ' ' ILE . 1.9 mp -81.12 97.6 3.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.276 179.778 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -93.0 120.57 33.43 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.297 0.57 . . . . 0.0 111.402 -179.524 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 2.0 p90 -149.68 157.06 42.88 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.135 -0.939 . . . . 0.0 108.565 178.134 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -95.55 147.22 23.8 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 120.341 -0.544 . . . . 0.0 110.62 -179.223 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . 178.94 176.2 0.57 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.241 179.795 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -96.43 134.51 39.51 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.933 -179.608 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.654 ' O ' ' O ' ' A' ' 31' ' ' VAL . 11.5 p -136.48 159.93 40.29 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.07 179.092 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.474 ' OE2' HD21 ' A' ' 23' ' ' LEU . 0.3 OUTLIER -148.29 145.2 28.07 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 108.717 -0.845 . . . . 0.0 108.717 178.772 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.471 ' N ' ' OE1' ' A' ' 21' ' ' GLU . 61.6 mt -119.58 136.73 55.77 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.323 0 CA-C-O 121.237 0.542 . . . . 0.0 112.056 -177.776 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.758 ' H ' HD12 ' A' ' 23' ' ' LEU . 0.0 OUTLIER -117.8 123.24 45.46 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.492 -0.776 . . . . 0.0 110.443 179.678 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.433 ' HG3' ' O ' ' A' ' 56' ' ' PRO . 38.1 tt0 -129.26 101.42 5.99 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.446 -0.797 . . . . 0.0 109.823 179.101 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 78.09 -126.78 7.84 Favored Glycine 0 CA--C 1.521 0.418 0 N-CA-C 109.877 -1.289 . . . . 0.0 109.877 -179.089 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.457 ' OE1' ' O ' ' A' ' 26' ' ' GLU . 0.0 OUTLIER -100.24 9.82 42.16 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.894 0.378 . . . . 0.0 110.084 179.53 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.496 ' HB3' ' CZ2' ' A' ' 29' ' ' TRP . 36.7 mtt85 -112.37 134.62 53.81 Favored 'General case' 0 CA--C 1.521 -0.15 0 CA-C-N 116.06 -0.518 . . . . 0.0 112.066 -178.806 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.405 ' HG2' ' N ' ' A' ' 29' ' ' TRP . 60.1 ttt-85 -129.24 150.15 50.74 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.346 179.852 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.528 ' NE1' ' O ' ' A' ' 48' ' ' ASP . 6.5 m-90 -147.49 155.01 41.48 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.171 -179.169 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.608 ' H ' ' CD ' ' A' ' 30' ' ' GLU . 1.4 mp0 -101.23 140.32 35.69 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 179.517 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.654 ' O ' ' O ' ' A' ' 20' ' ' SER . 18.9 m -148.89 157.11 7.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-O 121.149 0.499 . . . . 0.0 111.121 -179.466 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 1.093 ' H ' HD23 ' A' ' 32' ' ' LEU . 1.2 pt? -95.71 129.82 42.81 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 108.456 -0.942 . . . . 0.0 108.456 178.294 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.423 HD13 HD21 ' A' ' 61' ' ' LEU . 1.4 tt -93.57 126.11 38.54 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.403 0.62 . . . . 0.0 110.239 -179.255 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 50.2 m-70 -90.65 -25.75 19.95 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.009 -0.996 . . . . 0.0 111.863 -178.375 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -175.2 161.78 2.89 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 119.721 -0.792 . . . . 0.0 111.341 177.78 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.528 HG22 ' H ' ' A' ' 37' ' ' SER . 4.3 p -143.42 168.37 12.47 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.157 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.871 -179.472 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.528 ' H ' HG22 ' A' ' 36' ' ' VAL . 25.3 t -142.92 167.06 22.97 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 107.789 -1.189 . . . . 0.0 107.789 178.399 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.488 ' C ' ' CG ' ' A' ' 39' ' ' HIS . 1.0 OUTLIER -63.28 -1.32 1.04 Allowed 'General case' 0 C--N 1.322 -0.588 0 C-N-CA 119.602 -0.839 . . . . 0.0 110.31 -179.811 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 39' ' ' HIS . . . . . 0.488 ' CG ' ' C ' ' A' ' 38' ' ' LEU . 0.0 OUTLIER -163.3 46.31 0.13 Allowed 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 120.713 -0.395 . . . . 0.0 111.301 179.995 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 177.14 153.58 11.05 Favored Glycine 0 CA--C 1.528 0.86 0 N-CA-C 111.221 -0.752 . . . . 0.0 111.221 179.568 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -148.77 149.36 15.08 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.255 0 CA-C-O 121.33 0.586 . . . . 0.0 111.64 -179.198 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -121.18 136.47 54.97 Favored 'General case' 0 N--CA 1.464 0.27 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 178.685 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 19.3 m -140.22 175.29 6.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 C-N-CA 120.226 -0.589 . . . . 0.0 111.887 -179.561 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -97.3 144.36 17.28 Favored Glycine 0 CA--C 1.527 0.829 0 N-CA-C 109.247 -1.541 . . . . 0.0 109.247 177.938 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 60.4 tt0 -86.82 114.66 59.23 Favored Pre-proline 0 N--CA 1.466 0.349 0 CA-C-N 117.938 0.869 . . . . 0.0 111.839 -178.504 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 93.8 Cg_endo -84.85 162.7 12.03 Favored 'Trans proline' 0 C--N 1.31 -1.488 0 C-N-CA 121.81 1.674 . . . . 0.0 111.774 178.938 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.705 ' NE2' ' H ' ' A' ' 48' ' ' ASP . 0.4 OUTLIER -65.54 -40.1 92.5 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 112.438 0.532 . . . . 0.0 112.438 -178.981 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.705 ' H ' ' NE2' ' A' ' 47' ' ' GLN . 37.6 m-20 -74.21 8.79 1.93 Allowed 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 111.895 0.331 . . . . 0.0 111.895 -178.645 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' TRP . . . . . 0.48 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 62.3 t-105 -60.79 69.01 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 112.006 0.373 . . . . 0.0 112.006 -179.525 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' ASN . . . . . 0.579 HD22 ' C ' ' A' ' 50' ' ' ASN . 0.2 OUTLIER -92.96 80.07 4.61 Favored 'General case' 0 C--N 1.326 -0.43 0 C-N-CA 119.84 -0.744 . . . . 0.0 109.439 178.476 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -143.17 146.08 16.53 Favored Glycine 0 CA--C 1.524 0.596 0 N-CA-C 111.341 -0.703 . . . . 0.0 111.341 -179.301 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 53.9 t0 -84.42 113.95 51.92 Favored Pre-proline 0 CA--C 1.533 0.305 0 CA-C-N 115.96 -0.12 . . . . 0.0 110.705 179.817 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_exo -48.0 -22.33 3.41 Favored 'Trans proline' 0 N--CA 1.497 1.716 0 C-N-CA 122.517 2.144 . . . . 0.0 112.194 179.854 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 34.5 mm-40 -77.63 -24.11 49.6 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.132 -0.485 . . . . 0.0 112.044 -178.703 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.564 ' O ' ' CE1' ' A' ' 57' ' ' PHE . 39.1 mtp85 -95.15 151.64 38.91 Favored Pre-proline 0 N--CA 1.464 0.245 0 C-N-CA 120.573 -0.451 . . . . 0.0 110.436 -179.703 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' PRO . . . . . 0.433 ' O ' ' HG3' ' A' ' 24' ' ' GLN . 38.3 Cg_endo -65.59 161.09 40.09 Favored 'Trans proline' 0 N--CA 1.498 1.751 0 C-N-CA 123.156 2.571 . . . . 0.0 113.072 -178.855 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.564 ' CE1' ' O ' ' A' ' 55' ' ' ARG . 42.7 m-85 -131.59 156.29 46.04 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.344 -0.843 . . . . 0.0 109.572 179.587 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.508 ' O ' HD12 ' A' ' 23' ' ' LEU . 29.2 mt-10 -120.35 133.95 55.35 Favored 'General case' 0 N--CA 1.469 0.475 0 N-CA-C 108.913 -0.773 . . . . 0.0 108.913 178.043 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' ALA . . . . . 0.687 ' HB2' HD11 ' A' ' 73' ' ' ILE . . . -114.36 136.28 53.16 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.149 0.5 . . . . 0.0 111.998 -178.332 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.663 ' HG3' HD11 ' A' ' 23' ' ' LEU . 12.1 mmt180 -123.12 127.86 49.29 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 108.352 -0.981 . . . . 0.0 108.352 177.644 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.568 HD12 ' C ' ' A' ' 60' ' ' ARG . 10.7 mp -108.16 147.14 31.7 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 120.33 -0.548 . . . . 0.0 110.683 -179.316 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 62' ' ' TYR . . . . . 0.513 ' N ' ' CD1' ' A' ' 62' ' ' TYR . 4.2 m-85 -130.6 111.1 11.91 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.353 179.77 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 1.8 tt -106.57 -79.33 0.57 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.852 -0.613 . . . . 0.0 109.938 179.781 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.451 ' H ' ' HB ' ' A' ' 67' ' ' VAL . . . -80.99 -177.33 51.58 Favored Glycine 0 CA--C 1.52 0.404 0 N-CA-C 109.372 -1.491 . . . . 0.0 109.372 178.643 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 12.1 mt -76.07 -32.62 59.35 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 119.725 -0.79 . . . . 0.0 110.452 -179.441 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -104.16 8.91 36.38 Favored 'General case' 0 C--N 1.332 -0.185 0 C-N-CA 122.656 0.382 . . . . 0.0 111.222 -179.825 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.451 ' HB ' ' H ' ' A' ' 64' ' ' GLY . 37.6 t -104.8 96.29 4.48 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.294 0 CA-C-O 121.37 0.605 . . . . 0.0 111.654 -179.072 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.503 HD12 ' N ' ' A' ' 69' ' ' ILE . 3.1 tp -116.06 117.52 30.33 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 107.95 -1.13 . . . . 0.0 107.95 178.659 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.503 ' N ' HD12 ' A' ' 68' ' ' LEU . 20.9 mm -111.8 146.3 16.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.639 -178.29 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.426 ' C ' ' HG2' ' A' ' 71' ' ' MET . 0.0 OUTLIER -128.36 130.49 47.82 Favored 'General case' 0 C--O 1.238 0.481 0 CA-C-O 121.25 0.548 . . . . 0.0 111.134 178.817 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 71' ' ' MET . . . . . 0.802 ' SD ' HD12 ' A' ' 90' ' ' ILE . 1.2 mtm -140.66 148.2 40.46 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.494 -0.775 . . . . 0.0 110.002 179.629 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 72' ' ' GLU . . . . . 0.457 ' OE2' ' O ' ' A' ' 57' ' ' PHE . 10.6 tp10 -100.74 128.47 46.77 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 107.678 -1.23 . . . . 0.0 107.678 178.666 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.687 HD11 ' HB2' ' A' ' 59' ' ' ALA . 9.2 pt -138.83 157.23 29.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 C-N-CA 119.601 -0.84 . . . . 0.0 112.965 -177.644 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -121.82 150.99 41.11 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 114.787 -1.097 . . . . 0.0 109.613 178.765 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.526 HD12 ' CE1' ' A' ' 85' ' ' PHE . 7.3 tp -66.48 123.46 20.08 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.425 0.631 . . . . 0.0 110.457 -179.666 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -98.18 -43.63 6.92 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 114.959 -1.019 . . . . 0.0 111.115 178.168 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' TRP . . . . . 0.589 ' NE1' ' HA3' ' A' ' 84' ' ' GLY . 68.7 p-90 -167.56 171.21 10.52 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.436 -179.124 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -151.09 123.87 8.58 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 116.541 -0.3 . . . . 0.0 110.305 178.776 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 8.1 ttt85 -152.33 133.6 14.38 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 112.821 0.674 . . . . 0.0 112.821 179.494 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' ASP . . . . . 0.414 ' O ' ' OD1' ' A' ' 80' ' ' ASP . 8.3 t70 56.4 47.41 19.02 Favored 'General case' 0 N--CA 1.464 0.26 0 N-CA-C 113.528 0.936 . . . . 0.0 113.528 176.506 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 69.43 12.72 66.93 Favored Glycine 0 CA--C 1.523 0.558 0 C-N-CA 120.305 -0.95 . . . . 0.0 111.931 178.188 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 49.5 mt -117.65 139.67 50.7 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 108.739 -0.837 . . . . 0.0 108.739 178.665 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 44.9 mt -122.72 135.06 54.46 Favored 'General case' 0 CA--C 1.513 -0.455 0 C-N-CA 120.359 -0.536 . . . . 0.0 111.179 -179.311 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' GLY . . . . . 0.589 ' HA3' ' NE1' ' A' ' 77' ' ' TRP . . . -97.81 153.63 20.14 Favored Glycine 0 N--CA 1.448 -0.558 0 N-CA-C 109.474 -1.451 . . . . 0.0 109.474 178.868 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 85' ' ' PHE . . . . . 0.537 ' CG ' HD12 ' A' ' 73' ' ' ILE . 27.8 m-85 -145.44 132.16 19.99 Favored 'General case' 0 C--N 1.314 -0.966 0 C-N-CA 120.788 -0.365 . . . . 0.0 110.668 -179.183 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 55.9 tt0 -103.92 127.88 51.44 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 179.726 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' CYS . . . . . 0.519 ' HA ' HG22 ' A' ' 73' ' ' ILE . 0.5 OUTLIER -76.62 125.86 29.98 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.065 0.459 . . . . 0.0 111.626 -178.715 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -103.46 -29.26 11.29 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.236 179.701 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 89' ' ' HIS . . . . . 0.459 ' ND1' ' C ' ' A' ' 89' ' ' HIS . 0.0 OUTLIER -160.35 141.2 11.97 Favored 'General case' 0 C--O 1.223 -0.318 0 CA-C-O 120.947 0.403 . . . . 0.0 110.462 179.542 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.802 HD12 ' SD ' ' A' ' 71' ' ' MET . 7.5 tt -146.01 141.06 21.6 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.131 -179.619 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -56.75 138.82 52.42 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 115.194 -0.912 . . . . 0.0 111.864 -178.321 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 1.8 tt -54.09 -41.46 68.28 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 115.078 -0.965 . . . . 0.0 110.304 -179.849 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -67.88 -36.1 79.67 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 179.321 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 3.9 m -68.62 -37.39 79.72 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.869 179.355 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 95' ' ' ILE . . . . . 0.405 ' CG1' HG23 ' A' ' 90' ' ' ILE . 54.7 mt -58.9 -38.75 75.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.721 -179.757 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -70.67 -41.21 72.38 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 120.332 -0.547 . . . . 0.0 111.502 -178.385 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 97' ' ' HIS . . . . . 0.416 ' O ' ' HB2' ' A' ' 100' ' ' ARG . 58.5 m-70 -62.02 -37.58 85.42 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 119.272 -0.971 . . . . 0.0 109.216 179.875 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 6.5 tt -67.66 -34.1 76.26 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 110.059 -0.348 . . . . 0.0 110.059 178.095 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 8.1 mtp85 -59.22 -38.01 78.92 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.255 -0.578 . . . . 0.0 109.467 178.646 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 100' ' ' ARG . . . . . 0.416 ' HB2' ' O ' ' A' ' 97' ' ' HIS . 3.5 mmt180 -58.06 -45.66 86.68 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.736 178.758 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.449 HD22 ' N ' ' A' ' 101' ' ' LEU . 3.2 mm? -65.31 -37.96 88.71 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.628 -179.415 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 102' ' ' VAL . . . . . 0.401 ' O ' ' OD1' ' A' ' 105' ' ' ASN . 55.1 t -65.73 -47.55 85.55 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-O 120.941 0.401 . . . . 0.0 110.28 179.838 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 14.8 tm-20 -66.08 -39.27 89.91 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.459 179.803 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 13.8 mt -73.26 -42.53 62.39 Favored 'General case' 0 CA--C 1.532 0.28 0 N-CA-C 112.143 0.423 . . . . 0.0 112.143 -178.327 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 105' ' ' ASN . . . . . 0.401 ' OD1' ' O ' ' A' ' 102' ' ' VAL . 0.6 OUTLIER -70.61 -37.53 73.87 Favored 'General case' 0 N--CA 1.464 0.274 0 C-N-CA 120.589 -0.444 . . . . 0.0 111.131 -179.137 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 2.2 mt -56.07 -28.47 57.72 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.555 -179.696 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 107' ' ' GLY . . . . . 0.426 ' O ' ' C ' ' A' ' 108' ' ' ASP . . . 52.15 54.37 26.6 Favored Glycine 0 CA--C 1.523 0.567 0 N-CA-C 110.257 -1.137 . . . . 0.0 110.257 -179.498 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 108' ' ' ASP . . . . . 0.426 ' C ' ' O ' ' A' ' 107' ' ' GLY . 8.0 t0 -35.69 -69.19 0.11 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.779 0.323 . . . . 0.0 111.018 -179.612 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 109' ' ' GLU . . . . . 0.443 ' OE1' ' O ' ' A' ' 109' ' ' GLU . 0.0 OUTLIER -71.98 102.18 2.88 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.762 -179.649 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 58.43 -130.64 1.29 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.921 179.646 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 111' ' ' LEU . . . . . 0.479 ' O ' ' C ' ' A' ' 112' ' ' LEU . 4.0 mm? 59.04 94.8 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.384 -179.78 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.496 ' CG ' ' H ' ' A' ' 113' ' ' GLU . 0.4 OUTLIER 24.54 -113.69 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.837 179.826 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 113' ' ' GLU . . . . . 0.511 ' O ' ' O ' ' A' ' 114' ' ' ARG . 0.7 OUTLIER 70.43 -73.74 0.09 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.226 -179.663 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 114' ' ' ARG . . . . . 0.511 ' O ' ' O ' ' A' ' 113' ' ' GLU . 1.6 ptt180 36.6 99.64 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.987 179.781 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 115' ' ' GLU . . . . . 0.41 ' HG3' ' H ' ' A' ' 115' ' ' GLU . 8.9 mt-10 -50.09 -15.4 0.21 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.965 -0.562 . . . . 0.0 111.064 -179.936 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.542 ' O ' HG23 ' A' ' 120' ' ' VAL . 10.8 mp -54.14 -45.46 71.97 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.01 0.433 . . . . 0.0 110.36 -179.645 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -58.09 -52.29 66.16 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.969 179.791 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 11.7 mt -60.3 -48.42 81.83 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.958 -0.564 . . . . 0.0 112.291 -178.357 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -72.72 -50.51 24.23 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 119.886 -0.725 . . . . 0.0 111.002 -179.107 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 120' ' ' VAL . . . . . 0.542 HG23 ' O ' ' A' ' 116' ' ' LEU . 91.5 t -56.71 -8.64 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 C-N-CA 120.341 -0.544 . . . . 0.0 111.577 -175.602 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 11.1 t -83.25 -40.14 19.98 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 178.413 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 122' ' ' ALA . . . . . 0.566 ' O ' ' HB3' ' A' ' 123' ' ' HIS . . . -131.24 -144.66 0.26 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.347 -0.842 . . . . 0.0 109.848 179.431 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 123' ' ' HIS . . . . . 0.566 ' HB3' ' O ' ' A' ' 122' ' ' ALA . 0.0 OUTLIER 162.92 -154.22 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.288 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 179.496 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 124' ' ' ASP . . . . . 0.401 ' OD1' ' N ' ' A' ' 124' ' ' ASP . 1.0 OUTLIER -116.34 31.21 6.87 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-O 120.628 0.251 . . . . 0.0 110.821 179.958 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 125' ' ' ASP . . . . . 0.482 ' C ' ' CE1' ' A' ' 123' ' ' HIS . 50.0 m-20 . . . . . 0 C--O 1.22 -0.458 0 CA-C-O 118.025 -0.988 . . . . 0.0 110.625 -179.854 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 501' ' ' C2E . . . . . 0.985 ' O21' " H4'" ' A' ' 501' ' ' C2E . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 502' ' ' C2E . . . . . 0.568 ' C2 ' ' CD1' ' A' ' 77' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.4 ' C ' ' H ' ' A' ' 3' ' ' ASP . 45.9 mtt . . . . . 0 N--CA 1.491 1.589 0 N-CA-C 109.395 -0.595 . . . . 0.0 109.395 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 38.2 m -75.45 40.79 0.18 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.699 -179.784 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ASP . . . . . 0.429 ' O ' ' OG ' ' A' ' 121' ' ' SER . 79.6 m-20 -85.21 21.37 1.71 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.044 179.595 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.614 ' O ' ' N ' ' A' ' 6' ' ' ASP . 1.9 tm0? -112.16 -24.51 9.82 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.232 179.993 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' HIS . . . . . 0.579 ' C ' ' O ' ' A' ' 4' ' ' GLN . 0.0 OUTLIER 3.19 64.51 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 115.59 -0.732 . . . . 0.0 111.781 179.487 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 6' ' ' ASP . . . . . 0.614 ' N ' ' O ' ' A' ' 4' ' ' GLN . 8.1 m-20 25.89 92.58 0.01 OUTLIER 'General case' 0 N--CA 1.461 0.121 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.889 179.74 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.405 ' HA ' ' C61' ' A' ' 502' ' ' C2E . 5.2 tt0 -98.26 127.61 44.28 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 120.695 -0.402 . . . . 0.0 110.358 -179.574 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.744 ' NH2' ' N11' ' A' ' 501' ' ' C2E . 0.0 OUTLIER -125.0 -3.83 7.57 Favored 'General case' 0 N--CA 1.462 0.135 0 CA-C-N 115.972 -0.558 . . . . 0.0 112.113 -178.977 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.584 ' NH1' ' CZ ' ' A' ' 13' ' ' ARG . 1.7 ptt180 -109.28 84.46 1.93 Allowed 'General case' 0 N--CA 1.467 0.402 0 CA-C-O 121.11 0.481 . . . . 0.0 110.241 179.799 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.529 ' C ' ' O ' ' A' ' 9' ' ' ARG . 0.0 OUTLIER 18.23 -87.92 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 114.979 -1.01 . . . . 0.0 111.689 -179.846 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 11' ' ' PHE . . . . . 0.45 ' N ' ' O ' ' A' ' 9' ' ' ARG . 0.5 OUTLIER -119.64 154.59 33.78 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.873 0.368 . . . . 0.0 110.174 -179.943 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 12' ' ' HIS . . . . . 0.466 ' N ' ' ND1' ' A' ' 12' ' ' HIS . 2.0 m-70 -46.64 172.37 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.067 -179.577 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.584 ' CZ ' ' NH1' ' A' ' 9' ' ' ARG . 2.3 mtm180 -118.24 -179.5 3.79 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.404 -179.875 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.806 ' N ' HD12 ' A' ' 14' ' ' ILE . 1.8 mp -91.46 94.16 4.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.944 179.727 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -93.35 120.4 33.6 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.358 0.599 . . . . 0.0 111.435 -179.493 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -149.7 156.19 41.46 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.029 -0.987 . . . . 0.0 108.509 178.01 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -95.38 148.04 22.87 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 120.271 -0.571 . . . . 0.0 110.646 -178.888 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.502 ' O ' HD12 ' A' ' 32' ' ' LEU . . . 178.73 178.69 0.42 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.695 -0.684 . . . . 0.0 109.852 179.565 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 63.1 t0 -96.63 133.78 40.7 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.76 179.946 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.573 ' O ' ' O ' ' A' ' 31' ' ' VAL . 13.0 p -134.11 154.03 51.45 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.013 0.435 . . . . 0.0 110.164 178.818 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -135.36 145.99 47.93 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 179.519 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.489 ' CD1' HD11 ' A' ' 73' ' ' ILE . 1.1 mm -124.83 136.28 61.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-O 121.278 0.561 . . . . 0.0 110.865 -179.092 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.475 HD13 ' NE ' ' A' ' 60' ' ' ARG . 0.3 OUTLIER -123.0 124.1 42.38 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.85 -179.615 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.523 ' O ' ' OE1' ' A' ' 24' ' ' GLN . 1.7 tm0? -130.92 102.2 5.95 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.418 -0.81 . . . . 0.0 109.459 178.774 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 79.04 -128.03 8.34 Favored Glycine 0 CA--C 1.525 0.659 0 N-CA-C 110.016 -1.234 . . . . 0.0 110.016 -178.705 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -99.75 12.07 37.6 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.732 0.301 . . . . 0.0 110.373 179.567 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.505 ' HB3' ' CZ2' ' A' ' 29' ' ' TRP . 0.0 OUTLIER -112.68 133.56 54.64 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.25 -0.432 . . . . 0.0 112.04 -178.815 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.44 ' HG2' ' N ' ' A' ' 29' ' ' TRP . 2.5 ttt85 -126.98 147.45 50.12 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.967 -0.56 . . . . 0.0 109.896 179.146 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.55 ' NE1' ' O ' ' A' ' 48' ' ' ASP . 6.6 m-90 -146.13 155.64 42.88 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.538 -0.755 . . . . 0.0 110.541 -179.214 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -100.19 137.49 38.55 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 179.144 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.573 ' O ' ' O ' ' A' ' 20' ' ' SER . 16.7 m -146.14 156.65 12.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-O 121.2 0.524 . . . . 0.0 111.077 -179.429 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.502 HD12 ' O ' ' A' ' 18' ' ' ALA . 10.2 tp -95.67 129.95 42.71 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 108.042 -1.096 . . . . 0.0 108.042 178.421 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.479 ' N ' HD12 ' A' ' 32' ' ' LEU . 1.3 tt -92.35 124.89 36.74 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.334 0.587 . . . . 0.0 109.99 -179.89 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 72.6 m-70 -90.29 -27.86 19.16 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.287 -0.87 . . . . 0.0 111.864 -178.429 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.5 ' OD2' ' NH2' ' A' ' 13' ' ' ARG . 2.8 p30 -172.91 161.91 4.62 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 119.531 -0.867 . . . . 0.0 111.331 177.732 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.533 HG22 ' H ' ' A' ' 37' ' ' SER . 4.6 p -144.95 168.76 8.8 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.161 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.121 -179.186 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.533 ' H ' HG22 ' A' ' 36' ' ' VAL . 26.4 t -141.97 168.32 20.02 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 107.919 -1.141 . . . . 0.0 107.919 178.73 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 22.4 tp -64.92 -1.61 2.12 Favored 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 119.64 -0.824 . . . . 0.0 110.281 -179.495 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 3.2 p-80 -161.1 41.24 0.15 Allowed 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 120.569 -0.452 . . . . 0.0 111.857 179.655 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' GLY . . . . . 0.455 ' HA3' ' N3 ' ' A' ' 501' ' ' C2E . . . -178.76 155.96 17.65 Favored Glycine 0 CA--C 1.528 0.863 0 N-CA-C 111.255 -0.738 . . . . 0.0 111.255 179.635 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.461 ' CG2' HG21 ' A' ' 73' ' ' ILE . 0.1 OUTLIER -147.29 148.72 16.26 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.321 0 CA-C-O 121.332 0.587 . . . . 0.0 111.991 -178.995 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.465 HD23 ' N ' ' A' ' 43' ' ' VAL . 1.0 OUTLIER -121.76 133.53 54.92 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 114.941 -1.027 . . . . 0.0 108.498 178.735 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.465 ' N ' HD23 ' A' ' 42' ' ' LEU . 32.2 m -138.76 175.19 8.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-O 121.278 0.561 . . . . 0.0 111.891 -179.036 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -97.58 144.18 17.15 Favored Glycine 0 CA--C 1.527 0.842 0 N-CA-C 109.161 -1.575 . . . . 0.0 109.161 177.986 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' GLN . . . . . 0.495 ' O ' ' CD ' ' A' ' 45' ' ' GLN . 0.0 OUTLIER -87.34 118.63 70.17 Favored Pre-proline 0 CA--C 1.534 0.342 0 CA-C-N 118.159 0.98 . . . . 0.0 111.941 -178.339 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 95.6 Cg_endo -86.45 162.19 9.61 Favored 'Trans proline' 0 C--N 1.307 -1.608 0 C-N-CA 121.586 1.524 . . . . 0.0 111.196 178.649 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 4.0 mm100 -65.45 -40.23 92.98 Favored 'General case' 0 CA--C 1.533 0.322 0 N-CA-C 112.347 0.499 . . . . 0.0 112.347 -178.959 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.55 ' O ' ' NE1' ' A' ' 29' ' ' TRP . 7.7 m-20 -71.78 8.83 1.04 Allowed 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.059 0.392 . . . . 0.0 112.059 -178.677 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' TRP . . . . . 0.471 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 64.0 t-105 -60.28 67.77 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 112.054 0.39 . . . . 0.0 112.054 -179.425 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' ASN . . . . . 0.521 ' N ' ' O ' ' A' ' 48' ' ' ASP . 10.8 t30 -93.29 78.56 4.48 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 120.195 -0.602 . . . . 0.0 109.394 178.395 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -144.6 145.41 14.84 Favored Glycine 0 CA--C 1.527 0.822 0 C-N-CA 121.165 -0.541 . . . . 0.0 111.807 -179.326 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 45.7 t0 -78.02 122.41 85.39 Favored Pre-proline 0 CA--C 1.536 0.419 0 CA-C-N 115.505 -0.348 . . . . 0.0 110.824 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 20.6 Cg_endo -60.96 -22.3 74.05 Favored 'Trans proline' 0 N--CA 1.498 1.769 0 C-N-CA 122.805 2.336 . . . . 0.0 112.079 -179.576 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 32.1 mt-30 -78.72 -23.53 45.45 Favored 'General case' 0 C--N 1.324 -0.54 0 C-N-CA 120.633 -0.427 . . . . 0.0 111.374 -179.264 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.567 ' O ' ' CE1' ' A' ' 57' ' ' PHE . 34.3 mtp85 -93.85 147.31 33.3 Favored Pre-proline 0 C--N 1.332 -0.186 0 C-N-CA 120.876 -0.33 . . . . 0.0 110.492 -179.741 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -60.71 160.96 22.8 Favored 'Trans proline' 0 N--CA 1.496 1.67 0 C-N-CA 123.041 2.494 . . . . 0.0 113.399 -178.817 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.567 ' CE1' ' O ' ' A' ' 55' ' ' ARG . 39.1 m-85 -130.44 157.14 43.44 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 115.162 -0.927 . . . . 0.0 109.117 179.414 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -124.02 137.62 54.57 Favored 'General case' 0 N--CA 1.469 0.523 0 N-CA-C 109.486 -0.561 . . . . 0.0 109.486 178.683 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -118.55 136.7 53.7 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 112.41 0.522 . . . . 0.0 112.41 -178.093 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.475 ' NE ' HD13 ' A' ' 23' ' ' LEU . 0.6 OUTLIER -121.55 127.43 50.95 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 108.075 -1.083 . . . . 0.0 108.075 176.631 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.494 HD11 ' SD ' ' A' ' 71' ' ' MET . 12.6 mt -110.11 151.18 27.55 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.93 0.395 . . . . 0.0 110.977 -178.63 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 55.6 m-85 -132.31 108.58 9.3 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.528 179.938 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.555 HD23 ' C ' ' A' ' 63' ' ' LEU . 3.9 tt -104.17 -82.83 0.5 Allowed 'General case' 0 C--N 1.333 -0.121 0 CA-C-N 115.65 -0.705 . . . . 0.0 109.359 179.238 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.453 ' H ' ' HB ' ' A' ' 67' ' ' VAL . . . -77.59 176.11 53.85 Favored Glycine 0 CA--C 1.521 0.418 0 N-CA-C 109.094 -1.602 . . . . 0.0 109.094 178.279 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.718 ' C ' HD13 ' A' ' 65' ' ' LEU . 3.1 tm? -72.2 -35.91 69.06 Favored 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 119.852 -0.739 . . . . 0.0 109.768 -179.693 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.478 ' O ' ' OD1' ' A' ' 66' ' ' ASP . 15.2 t0 -98.55 9.51 43.05 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.15 179.608 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.539 ' O ' HG12 ' A' ' 67' ' ' VAL . 15.0 t -107.1 96.47 4.66 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.296 0 CA-C-O 121.453 0.644 . . . . 0.0 112.069 -178.719 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -112.53 118.19 34.44 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 108.173 -1.047 . . . . 0.0 108.173 178.208 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.792 HG23 ' OG ' ' A' ' 94' ' ' SER . 3.3 mt -113.37 144.21 21.48 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.233 0 CA-C-O 121.065 0.46 . . . . 0.0 111.373 -178.694 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.43 ' HD3' ' N ' ' A' ' 70' ' ' ARG . 0.0 OUTLIER -128.14 131.53 48.96 Favored 'General case' 0 C--O 1.239 0.508 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.868 179.407 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 71' ' ' MET . . . . . 0.494 ' SD ' HD11 ' A' ' 61' ' ' LEU . 0.0 OUTLIER -143.26 149.74 38.31 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.11 -179.628 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -104.88 127.24 52.63 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 107.945 -1.131 . . . . 0.0 107.945 178.307 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.656 HD12 ' CG ' ' A' ' 85' ' ' PHE . 14.0 pt -134.9 157.91 41.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 N-CA-C 112.888 0.699 . . . . 0.0 112.888 -177.507 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 9.2 p -122.69 156.06 35.14 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.045 -0.98 . . . . 0.0 109.911 179.032 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.447 HD12 ' HA ' ' A' ' 75' ' ' LEU . 7.2 tp -65.42 119.05 10.3 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.885 0.374 . . . . 0.0 111.054 -179.447 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -97.63 -41.98 7.87 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.554 177.614 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' TRP . . . . . 0.597 ' NE1' ' HA3' ' A' ' 84' ' ' GLY . 67.7 p-90 -171.01 170.02 6.39 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 115.828 -0.624 . . . . 0.0 109.894 -179.741 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -151.32 124.02 8.52 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 110.017 -0.364 . . . . 0.0 110.017 178.84 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' ARG . . . . . 0.45 ' NE ' " O2'" ' A' ' 502' ' ' C2E . 1.0 OUTLIER -152.15 133.64 14.58 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 119.833 -0.747 . . . . 0.0 112.91 179.67 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 80' ' ' ASP . . . . . 0.448 ' OD2' ' NH1' ' A' ' 79' ' ' ARG . 61.5 m-20 56.75 47.43 18.16 Favored 'General case' 0 N--CA 1.462 0.168 0 N-CA-C 114.131 1.16 . . . . 0.0 114.131 176.357 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 84.97 -28.35 4.59 Favored Glycine 0 CA--C 1.524 0.649 0 C-N-CA 120.425 -0.893 . . . . 0.0 113.311 177.043 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 4.5 mt -89.84 158.03 17.65 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 117.705 0.752 . . . . 0.0 110.567 -178.915 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 58.4 mt -129.95 135.59 48.49 Favored 'General case' 0 CA--C 1.517 -0.301 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.443 -179.13 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' GLY . . . . . 0.597 ' HA3' ' NE1' ' A' ' 77' ' ' TRP . . . -96.86 151.77 19.93 Favored Glycine 0 N--CA 1.451 -0.323 0 N-CA-C 109.517 -1.433 . . . . 0.0 109.517 178.522 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 85' ' ' PHE . . . . . 0.656 ' CG ' HD12 ' A' ' 73' ' ' ILE . 25.2 m-85 -145.56 132.32 20.03 Favored 'General case' 0 C--N 1.318 -0.804 0 C-N-CA 120.711 -0.396 . . . . 0.0 110.884 -179.205 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.464 ' O ' ' NE2' ' A' ' 88' ' ' GLN . 34.3 tt0 -104.04 126.58 51.27 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 179.614 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 87' ' ' CYS . . . . . 0.573 ' HA ' HG22 ' A' ' 73' ' ' ILE . 39.1 t -69.23 122.2 18.37 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.005 0.431 . . . . 0.0 112.083 -178.486 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 88' ' ' GLN . . . . . 0.464 ' NE2' ' O ' ' A' ' 86' ' ' GLU . 51.6 mm-40 -95.28 -33.31 12.61 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.14 179.113 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -162.11 141.92 9.88 Favored 'General case' 0 C--O 1.223 -0.313 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.067 179.974 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.617 HD11 ' OG ' ' A' ' 94' ' ' SER . 10.5 tt -145.05 141.17 23.01 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-O 121.237 0.541 . . . . 0.0 110.049 -179.467 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -59.44 141.52 54.48 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 115.319 -0.855 . . . . 0.0 112.382 -177.987 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.508 ' HA ' HD12 ' A' ' 95' ' ' ILE . 14.6 tp -54.21 -41.71 68.94 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 114.963 -1.017 . . . . 0.0 110.669 -179.549 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -65.49 -40.13 92.74 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 179.339 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 94' ' ' SER . . . . . 0.792 ' OG ' HG23 ' A' ' 69' ' ' ILE . 2.3 t -69.54 -35.01 75.06 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.149 179.392 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 95' ' ' ILE . . . . . 0.508 HD12 ' HA ' ' A' ' 92' ' ' LEU . 36.1 mt -58.37 -38.35 68.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.802 -0.636 . . . . 0.0 109.821 -179.906 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -70.75 -37.98 73.46 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 120.383 -0.527 . . . . 0.0 111.051 -179.202 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 61.9 m-70 -63.75 -35.85 81.94 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 119.381 -0.927 . . . . 0.0 109.112 179.772 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.444 ' O ' HG23 ' A' ' 102' ' ' VAL . 6.4 mp -67.33 -33.82 76.05 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 177.872 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 3.8 mtt-85 -61.6 -39.02 89.73 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 178.732 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 38.2 mtp180 -57.92 -45.73 86.08 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.549 179.0 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.42 ' HB3' HG21 ' A' ' 14' ' ' ILE . 7.3 mp -63.84 -34.75 78.64 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.692 -0.685 . . . . 0.0 109.697 179.97 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 102' ' ' VAL . . . . . 0.444 HG23 ' O ' ' A' ' 98' ' ' LEU . 85.1 t -68.74 -40.51 81.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 116.037 -0.528 . . . . 0.0 110.151 178.97 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -65.5 -48.6 72.01 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.828 -0.623 . . . . 0.0 111.552 -179.35 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 6.5 mp -67.81 -43.01 80.64 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 120.702 -0.399 . . . . 0.0 111.211 -179.037 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 105' ' ' ASN . . . . . 0.697 ' CG ' HG23 ' A' ' 14' ' ' ILE . 6.7 m-80 -64.41 -34.34 77.95 Favored 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 120.685 -0.406 . . . . 0.0 110.905 -179.704 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 8.1 mt -56.26 -18.82 11.64 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.778 -0.453 . . . . 0.0 109.778 179.686 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -104.26 -14.2 24.81 Favored Glycine 0 CA--C 1.524 0.6 0 N-CA-C 110.661 -0.976 . . . . 0.0 110.661 179.766 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 72.3 m-20 54.97 -169.3 0.07 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.803 0.335 . . . . 0.0 110.549 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 109' ' ' GLU . . . . . 0.637 ' CD ' ' H ' ' A' ' 109' ' ' GLU . 5.6 mp0 -67.84 -123.47 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.131 179.717 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 110' ' ' GLU . . . . . 0.415 ' O ' ' O ' ' A' ' 109' ' ' GLU . 45.3 mt-10 -47.99 -96.36 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.217 179.699 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 111' ' ' LEU . . . . . 0.447 ' O ' ' O ' ' A' ' 112' ' ' LEU . 44.3 tp -173.22 -90.62 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.225 -0.443 . . . . 0.0 109.984 179.664 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.447 ' O ' ' O ' ' A' ' 111' ' ' LEU . 0.7 OUTLIER 58.78 137.36 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.808 179.544 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 -47.08 102.16 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.519 179.916 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 114' ' ' ARG . . . . . 0.462 ' O ' ' CB ' ' A' ' 115' ' ' GLU . 18.1 ttm180 -161.37 118.32 2.24 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.667 179.946 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 115' ' ' GLU . . . . . 0.462 ' CB ' ' O ' ' A' ' 114' ' ' ARG . 7.5 tt0 162.15 -48.22 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.81 -0.632 . . . . 0.0 109.517 -179.854 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 6.3 tt -67.33 -35.11 78.73 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.472 -0.786 . . . . 0.0 111.025 179.678 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -65.59 -23.16 66.77 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-O 121.173 0.511 . . . . 0.0 110.727 -178.687 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.417 ' O ' ' CB ' ' A' ' 121' ' ' SER . 34.2 mt -57.21 -40.38 77.37 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 178.695 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 119' ' ' LEU . . . . . 0.54 ' C ' ' H ' ' A' ' 121' ' ' SER . 3.9 mm? -57.22 -47.37 81.5 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 107.634 -1.247 . . . . 0.0 107.634 179.118 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 120' ' ' VAL . . . . . 0.48 ' O ' HG12 ' A' ' 120' ' ' VAL . 24.1 t -58.72 1.0 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.847 177.344 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 121' ' ' SER . . . . . 0.54 ' H ' ' C ' ' A' ' 119' ' ' LEU . 1.5 t -98.98 -41.85 7.39 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 108.429 -0.952 . . . . 0.0 108.429 177.155 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 122' ' ' ALA . . . . . 0.434 ' O ' ' O ' ' A' ' 123' ' ' HIS . . . -131.12 63.72 1.59 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.171 -0.922 . . . . 0.0 110.484 -179.941 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 123' ' ' HIS . . . . . 0.754 ' CG ' ' N ' ' A' ' 124' ' ' ASP . 0.0 OUTLIER -56.37 -158.3 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 120.714 -0.394 . . . . 0.0 111.181 -178.687 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 124' ' ' ASP . . . . . 0.754 ' N ' ' CG ' ' A' ' 123' ' ' HIS . 9.0 t70 157.44 -24.41 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.865 179.639 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 . . . . . 0 C--O 1.221 -0.427 0 CA-C-O 117.938 -1.029 . . . . 0.0 110.587 179.985 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 501' ' ' C2E . . . . . 0.9 ' O21' " H4'" ' A' ' 501' ' ' C2E . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 502' ' ' C2E . . . . . 0.582 ' N71' ' NH2' ' A' ' 8' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.5 mtt . . . . . 0 N--CA 1.491 1.578 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 59.5 p -105.48 86.18 2.37 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.651 -179.968 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ASP . . . . . 0.48 ' N ' ' OD1' ' A' ' 3' ' ' ASP . 0.4 OUTLIER -99.81 103.84 15.49 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 109.157 -0.683 . . . . 0.0 109.157 177.942 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.503 ' H ' ' CD ' ' A' ' 4' ' ' GLN . 0.0 OUTLIER -108.13 -34.12 6.96 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.725 -0.67 . . . . 0.0 111.09 -179.149 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 5' ' ' HIS . . . . . 0.55 ' O ' ' NH1' ' A' ' 8' ' ' ARG . 5.5 m-70 -111.48 -106.35 0.37 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.44 -0.346 . . . . 0.0 111.012 -179.242 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' ASP . . . . . 0.477 ' O ' ' N71' ' A' ' 502' ' ' C2E . 24.7 m-20 54.57 163.77 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.998 -0.371 . . . . 0.0 109.998 -179.499 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -104.32 127.75 52.03 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 120.888 0.375 . . . . 0.0 111.43 -179.418 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.654 ' NH2' ' C21' ' A' ' 501' ' ' C2E . 0.0 OUTLIER -123.9 -12.57 7.52 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.476 -179.794 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.649 ' HG2' ' O61' ' A' ' 502' ' ' C2E . 8.0 ptt85 -116.14 83.72 1.99 Allowed 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 120.831 0.348 . . . . 0.0 110.251 179.654 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.549 ' C ' ' O ' ' A' ' 9' ' ' ARG . 0.0 OUTLIER 18.86 -83.03 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.381 -0.827 . . . . 0.0 111.39 -179.938 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 11' ' ' PHE . . . . . 0.588 ' N ' ' O ' ' A' ' 9' ' ' ARG . 0.1 OUTLIER -117.68 171.16 8.21 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-O 120.947 0.403 . . . . 0.0 110.609 179.969 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 12' ' ' HIS . . . . . 0.526 ' C ' ' HE ' ' A' ' 13' ' ' ARG . 0.0 OUTLIER -73.45 -0.39 14.77 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.471 -179.409 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.526 ' HE ' ' C ' ' A' ' 12' ' ' HIS . 9.8 mtm180 67.85 178.28 0.24 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.835 0.35 . . . . 0.0 110.277 -179.656 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.644 ' N ' HD12 ' A' ' 14' ' ' ILE . 1.4 mp -84.6 105.64 13.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.455 -179.901 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -95.46 119.72 34.46 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.459 0.647 . . . . 0.0 111.55 -179.883 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -150.02 155.12 39.35 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 114.904 -1.044 . . . . 0.0 108.293 177.891 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' ASP . . . . . 0.53 ' OD1' ' N ' ' A' ' 17' ' ' ASP . 17.9 p-10 -95.6 146.22 24.64 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 120.09 -0.644 . . . . 0.0 111.005 -178.626 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -178.65 174.9 1.14 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.244 179.588 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 3.5 t0 -96.07 133.91 39.75 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.854 -179.669 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.539 ' O ' ' O ' ' A' ' 31' ' ' VAL . 27.7 p -133.71 152.51 51.9 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.253 0.549 . . . . 0.0 110.358 178.729 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.482 ' OE1' ' NH2' ' A' ' 28' ' ' ARG . 6.7 mm-40 -131.34 151.96 51.04 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 108.976 -0.75 . . . . 0.0 108.976 179.533 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.428 ' HA ' ' O ' ' A' ' 58' ' ' GLU . 22.6 mt -134.44 136.25 53.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 C-N-CA 120.053 -0.659 . . . . 0.0 111.304 -179.376 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -124.16 123.27 39.93 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.473 -0.785 . . . . 0.0 111.402 -179.142 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.685 ' NE2' ' CZ ' ' A' ' 57' ' ' PHE . 12.0 tt0 -128.12 102.07 6.56 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.538 -0.755 . . . . 0.0 109.811 178.61 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 80.97 -125.8 7.06 Favored Glycine 0 CA--C 1.522 0.528 0 N-CA-C 109.974 -1.25 . . . . 0.0 109.974 -178.894 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -100.55 12.19 37.86 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.954 0.407 . . . . 0.0 110.014 179.489 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.595 ' HB3' ' CZ2' ' A' ' 29' ' ' TRP . 24.1 mtt85 -114.27 135.84 53.62 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 112.968 0.729 . . . . 0.0 112.968 -178.062 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.482 ' NH2' ' OE1' ' A' ' 21' ' ' GLU . 72.0 ttt-85 -128.69 151.38 49.59 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.017 178.77 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.595 ' CZ2' ' HB3' ' A' ' 27' ' ' ARG . 6.5 m-90 -149.25 156.56 42.31 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.59 -179.249 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -100.83 140.07 35.64 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.09 -0.504 . . . . 0.0 109.676 179.321 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.539 ' O ' ' O ' ' A' ' 20' ' ' SER . 12.5 m -149.92 158.45 5.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-O 121.324 0.583 . . . . 0.0 111.19 -179.267 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 1.049 ' H ' HD23 ' A' ' 32' ' ' LEU . 1.0 OUTLIER -99.02 129.95 45.33 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 108.577 -0.897 . . . . 0.0 108.577 178.556 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.2 tt -95.18 125.51 39.87 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 120.306 -0.558 . . . . 0.0 109.787 -179.62 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 20.3 m-70 -90.62 -26.17 19.77 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.402 -0.817 . . . . 0.0 111.714 -178.455 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -172.16 161.31 5.42 Favored 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 119.544 -0.862 . . . . 0.0 111.271 177.403 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.545 HG22 ' N ' ' A' ' 37' ' ' SER . 8.4 p -145.17 168.59 8.59 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.823 -178.792 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.545 ' N ' HG22 ' A' ' 36' ' ' VAL . 6.4 t -141.77 169.66 17.17 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 108.045 -1.094 . . . . 0.0 108.045 178.801 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.476 ' O ' HD23 ' A' ' 38' ' ' LEU . 5.7 tt -67.69 -1.97 6.13 Favored 'General case' 0 C--N 1.323 -0.556 0 C-N-CA 119.872 -0.731 . . . . 0.0 110.69 -179.325 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' HIS . . . . . 0.436 ' O ' ' CG ' ' A' ' 39' ' ' HIS . 53.1 t-80 -156.98 35.42 0.29 Allowed 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 120.777 -0.369 . . . . 0.0 111.501 -179.756 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' GLY . . . . . 0.45 ' HA3' ' N3 ' ' A' ' 501' ' ' C2E . . . -175.96 158.98 26.17 Favored Glycine 0 CA--C 1.527 0.787 0 N-CA-C 111.241 -0.744 . . . . 0.0 111.241 179.811 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -149.36 149.58 14.65 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.388 0 CA-C-O 121.104 0.478 . . . . 0.0 111.532 -178.963 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.803 HD23 ' N ' ' A' ' 43' ' ' VAL . 2.7 tt -122.09 141.86 50.96 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 115.527 -0.761 . . . . 0.0 109.105 178.519 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.803 ' N ' HD23 ' A' ' 42' ' ' LEU . 20.0 m -145.26 174.98 2.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-O 121.263 0.554 . . . . 0.0 111.684 -179.562 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -98.72 145.63 17.8 Favored Glycine 0 CA--C 1.528 0.846 0 N-CA-C 109.808 -1.317 . . . . 0.0 109.808 178.811 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 47.5 tt0 -87.22 113.27 53.0 Favored Pre-proline 0 N--CA 1.463 0.22 0 CA-C-N 117.611 0.706 . . . . 0.0 111.699 -178.654 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 96.9 Cg_endo -83.96 161.35 13.82 Favored 'Trans proline' 0 C--N 1.306 -1.682 0 C-N-CA 121.56 1.507 . . . . 0.0 111.372 179.031 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.612 ' CD ' ' H ' ' A' ' 47' ' ' GLN . 0.0 OUTLIER -65.12 -26.24 68.11 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 112.388 0.514 . . . . 0.0 112.388 -178.797 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.534 ' O ' ' N ' ' A' ' 50' ' ' ASN . 1.3 p30 -86.65 8.42 22.45 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 112.085 0.402 . . . . 0.0 112.085 -178.619 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' TRP . . . . . 0.435 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 58.9 t-105 -60.52 68.56 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 111.786 0.291 . . . . 0.0 111.786 -179.69 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' ASN . . . . . 0.534 ' N ' ' O ' ' A' ' 48' ' ' ASP . 0.3 OUTLIER -93.15 78.77 4.54 Favored 'General case' 0 C--N 1.324 -0.509 0 C-N-CA 120.129 -0.628 . . . . 0.0 109.763 178.607 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -145.02 160.17 27.99 Favored Glycine 0 CA--C 1.525 0.708 0 N-CA-C 111.047 -0.821 . . . . 0.0 111.047 -179.611 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 30.1 t0 -95.31 110.89 52.98 Favored Pre-proline 0 CA--C 1.533 0.296 0 C-N-CA 121.267 -0.173 . . . . 0.0 110.924 -179.646 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_exo -47.79 -22.35 3.13 Favored 'Trans proline' 0 N--CA 1.493 1.485 0 C-N-CA 122.362 2.041 . . . . 0.0 112.357 179.614 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 83.7 mt-30 -76.77 -23.85 52.93 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.382 -179.411 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.521 ' O ' ' CE1' ' A' ' 57' ' ' PHE . 15.9 mtp180 -95.46 151.88 38.89 Favored Pre-proline 0 CA--C 1.531 0.227 0 N-CA-C 110.08 -0.341 . . . . 0.0 110.08 179.987 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' PRO . . . . . 0.57 ' O ' ' NE2' ' A' ' 24' ' ' GLN . 35.4 Cg_endo -64.85 160.87 38.8 Favored 'Trans proline' 0 N--CA 1.495 1.579 0 C-N-CA 122.852 2.368 . . . . 0.0 113.331 -178.497 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.685 ' CZ ' ' NE2' ' A' ' 24' ' ' GLN . 57.8 m-85 -130.71 154.66 47.72 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 114.997 -1.001 . . . . 0.0 109.192 179.486 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.428 ' O ' ' HA ' ' A' ' 22' ' ' ILE . 16.5 mt-10 -119.31 136.01 54.44 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 108.863 -0.792 . . . . 0.0 108.863 178.667 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' ALA . . . . . 0.533 ' C ' ' HE ' ' A' ' 60' ' ' ARG . . . -120.47 139.43 52.88 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.281 0.563 . . . . 0.0 112.507 -177.871 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.533 ' HE ' ' C ' ' A' ' 59' ' ' ALA . 2.4 mmp_? -123.96 127.67 48.29 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 108.418 -0.956 . . . . 0.0 108.418 177.304 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.422 HD12 ' C ' ' A' ' 60' ' ' ARG . 9.6 mp -105.78 150.36 25.61 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 120.701 -0.4 . . . . 0.0 110.386 -179.234 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 62' ' ' TYR . . . . . 0.446 ' N ' ' CD1' ' A' ' 62' ' ' TYR . 18.3 m-85 -133.9 108.99 8.75 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.46 179.643 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.54 HD23 ' C ' ' A' ' 63' ' ' LEU . 2.4 tt -104.97 -84.7 0.49 Allowed 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.582 -0.736 . . . . 0.0 109.207 179.382 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.436 ' H ' ' HB ' ' A' ' 67' ' ' VAL . . . -75.72 178.11 48.69 Favored Glycine 0 CA--C 1.52 0.384 0 N-CA-C 109.23 -1.548 . . . . 0.0 109.23 178.508 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 11.6 mt -73.34 -33.8 65.31 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 119.949 -0.7 . . . . 0.0 110.31 -179.588 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -100.87 9.31 42.48 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.822 179.913 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.579 ' O ' HG12 ' A' ' 67' ' ' VAL . 8.7 t -104.94 94.97 3.43 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-O 121.334 0.588 . . . . 0.0 111.901 -178.824 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 6.1 tp -112.37 117.46 32.51 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 177.972 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.716 HG23 ' OG ' ' A' ' 94' ' ' SER . 3.4 mt -112.63 144.78 19.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 120.946 0.403 . . . . 0.0 111.148 -178.942 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 5.9 mtt85 -127.98 131.6 49.24 Favored 'General case' 0 C--O 1.239 0.506 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.75 179.344 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -142.95 149.03 37.85 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.211 -179.822 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 17.6 tp10 -100.44 134.2 43.74 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 107.635 -1.246 . . . . 0.0 107.635 178.123 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.59 HD12 ' CB ' ' A' ' 85' ' ' PHE . 4.5 pt -144.1 157.34 15.63 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.157 0 C-N-CA 119.084 -1.046 . . . . 0.0 113.138 -177.707 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 29.7 m -122.06 152.86 39.36 Favored 'General case' 0 N--CA 1.463 0.225 0 CA-C-N 115.012 -0.995 . . . . 0.0 109.965 178.877 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.589 HD22 ' CE1' ' A' ' 85' ' ' PHE . 0.2 OUTLIER -65.31 120.31 12.55 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-O 120.964 0.411 . . . . 0.0 110.398 -179.197 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 76' ' ' ALA . . . . . 0.575 ' N ' HD13 ' A' ' 75' ' ' LEU . . . -97.31 -37.63 9.97 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.166 177.53 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 77' ' ' TRP . . . . . 0.728 ' NE1' ' HA3' ' A' ' 84' ' ' GLY . 69.6 p-90 -171.12 169.91 6.33 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.745 179.725 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -151.45 123.9 8.37 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.178 178.459 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 21.6 ttm-85 -152.36 131.44 12.66 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 120.308 -0.557 . . . . 0.0 112.35 179.441 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 19.5 t70 55.95 47.28 20.31 Favored 'General case' 0 N--CA 1.466 0.325 0 N-CA-C 113.634 0.976 . . . . 0.0 113.634 176.257 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 68.74 12.28 64.2 Favored Glycine 0 CA--C 1.523 0.549 0 C-N-CA 120.325 -0.941 . . . . 0.0 111.594 178.603 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 32.4 mt -114.36 139.93 49.07 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 178.156 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 27.6 mt -128.45 135.28 49.26 Favored 'General case' 0 CA--C 1.512 -0.515 0 C-N-CA 120.298 -0.561 . . . . 0.0 111.51 -178.805 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' GLY . . . . . 0.728 ' HA3' ' NE1' ' A' ' 77' ' ' TRP . . . -103.49 155.39 17.92 Favored Glycine 0 N--CA 1.446 -0.667 0 N-CA-C 109.179 -1.568 . . . . 0.0 109.179 178.436 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 85' ' ' PHE . . . . . 0.59 ' CB ' HD12 ' A' ' 73' ' ' ILE . 49.6 m-85 -145.75 136.79 24.66 Favored 'General case' 0 C--N 1.311 -1.093 0 C-N-CA 120.792 -0.363 . . . . 0.0 110.417 -179.535 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.444 ' O ' ' NE2' ' A' ' 88' ' ' GLN . 4.6 pt-20 -103.89 127.76 51.4 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 179.232 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 87' ' ' CYS . . . . . 0.433 ' O ' ' CE1' ' A' ' 39' ' ' HIS . 4.8 t -75.73 126.08 30.3 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.889 0.376 . . . . 0.0 111.985 -178.305 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 88' ' ' GLN . . . . . 0.444 ' NE2' ' O ' ' A' ' 86' ' ' GLU . 0.0 OUTLIER -102.1 -28.5 12.3 Favored 'General case' 0 N--CA 1.462 0.143 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.49 179.318 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 89' ' ' HIS . . . . . 0.554 ' ND1' ' N ' ' A' ' 90' ' ' ILE . 0.1 OUTLIER -161.0 141.26 11.1 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.958 0.409 . . . . 0.0 110.377 179.712 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.826 HD11 ' OG ' ' A' ' 94' ' ' SER . 7.9 tt -146.01 141.34 21.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.186 -179.422 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 91' ' ' ASP . . . . . 0.526 ' N ' ' OD1' ' A' ' 91' ' ' ASP . 0.3 OUTLIER -55.24 143.15 28.88 Favored 'General case' 0 N--CA 1.462 0.139 0 CA-C-N 115.381 -0.827 . . . . 0.0 111.98 -178.293 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.509 ' HA ' HD12 ' A' ' 95' ' ' ILE . 59.2 tp -54.08 -41.66 68.46 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.066 -0.97 . . . . 0.0 109.705 -179.579 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -67.88 -38.33 82.91 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.001 -0.545 . . . . 0.0 109.554 179.081 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' SER . . . . . 0.826 ' OG ' HD11 ' A' ' 90' ' ' ILE . 5.6 t -68.25 -35.14 77.45 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.946 179.368 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 95' ' ' ILE . . . . . 0.509 HD12 ' HA ' ' A' ' 92' ' ' LEU . 44.2 mt -58.74 -38.26 70.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.786 -0.643 . . . . 0.0 109.702 179.507 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -71.42 -42.11 68.7 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.947 -179.728 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 97' ' ' HIS . . . . . 0.42 ' O ' ' HB2' ' A' ' 100' ' ' ARG . 61.3 m-70 -61.79 -37.52 84.68 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 119.745 -0.782 . . . . 0.0 109.718 -179.996 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 2.6 mp -67.54 -34.05 76.31 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 177.711 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 8.8 mtt85 -66.31 -37.11 84.63 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 177.551 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' ARG . . . . . 0.42 ' HB2' ' O ' ' A' ' 97' ' ' HIS . 56.1 mtp180 -61.67 -44.2 97.41 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.105 -0.952 . . . . 0.0 110.969 178.916 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.408 HD23 ' HA ' ' A' ' 101' ' ' LEU . 5.0 mt -62.16 -39.61 93.24 Favored 'General case' 0 C--N 1.332 -0.174 0 C-N-CA 120.608 -0.437 . . . . 0.0 109.824 -179.318 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 102' ' ' VAL . . . . . 0.478 ' O ' ' N ' ' A' ' 106' ' ' LEU . 72.6 t -68.5 -43.2 83.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.57 179.72 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -59.06 -48.74 80.51 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.017 -179.609 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 8.7 mt -67.44 -42.21 83.51 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.741 -0.383 . . . . 0.0 110.421 -179.629 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -72.38 -29.01 63.37 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.435 179.88 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.478 ' N ' ' O ' ' A' ' 102' ' ' VAL . 41.7 tp -63.84 -21.77 66.6 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.756 -0.461 . . . . 0.0 109.756 179.614 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -172.91 138.6 4.77 Favored Glycine 0 CA--C 1.525 0.714 0 N-CA-C 110.949 -0.86 . . . . 0.0 110.949 179.767 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 29.4 m-20 -126.14 -62.35 1.17 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.778 0.323 . . . . 0.0 110.505 -179.89 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 109' ' ' GLU . . . . . 0.53 ' O ' ' N ' ' A' ' 111' ' ' LEU . 1.4 pm0 -146.04 127.32 14.84 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.254 179.559 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -38.67 90.73 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.907 -179.844 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 111' ' ' LEU . . . . . 0.53 ' N ' ' O ' ' A' ' 109' ' ' GLU . 0.6 OUTLIER -92.46 -163.16 1.01 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.247 179.678 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 33.2 tp -88.67 -78.54 0.34 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.261 179.901 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 30.1 mt-10 -57.19 -171.34 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.451 179.794 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 114' ' ' ARG . . . . . 0.439 ' CZ ' ' O ' ' A' ' 114' ' ' ARG . 19.7 ttp85 -159.68 46.09 0.26 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.655 179.592 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 115' ' ' GLU . . . . . 0.418 ' HB3' HD12 ' A' ' 118' ' ' LEU . 5.3 mp0 56.81 20.8 5.45 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.675 179.695 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 23.9 mt -67.74 -39.95 84.2 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.631 -179.68 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -58.24 -22.58 52.81 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-O 121.54 0.686 . . . . 0.0 110.236 -178.852 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.418 HD12 ' HB3' ' A' ' 115' ' ' GLU . 11.3 mt -58.37 -31.38 67.57 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 114.742 -1.117 . . . . 0.0 108.892 177.668 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 11.9 mt -55.97 -45.93 78.77 Favored 'General case' 0 C--N 1.332 -0.167 0 N-CA-C 108.428 -0.953 . . . . 0.0 108.428 -179.899 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 120' ' ' VAL . . . . . 0.429 ' O ' HG12 ' A' ' 120' ' ' VAL . 61.9 t -57.47 -8.75 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.055 178.603 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 121' ' ' SER . . . . . 0.676 ' O ' ' O ' ' A' ' 122' ' ' ALA . 0.0 OUTLIER -109.4 -38.82 5.38 Favored 'General case' 0 C--N 1.332 -0.164 0 N-CA-C 108.45 -0.945 . . . . 0.0 108.45 177.799 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 122' ' ' ALA . . . . . 0.676 ' O ' ' O ' ' A' ' 121' ' ' SER . . . -46.1 -143.75 0.0 OUTLIER 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 114.974 -1.012 . . . . 0.0 111.657 179.832 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 123' ' ' HIS . . . . . 0.553 ' O ' ' N ' ' A' ' 125' ' ' ASP . 3.4 p-80 -25.25 -42.19 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.551 -179.594 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 124' ' ' ASP . . . . . 0.553 ' N ' ' O ' ' A' ' 122' ' ' ALA . 11.5 t0 61.72 -68.18 0.06 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.17 -179.484 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 125' ' ' ASP . . . . . 0.553 ' N ' ' O ' ' A' ' 123' ' ' HIS . 21.6 t0 . . . . . 0 C--O 1.22 -0.455 0 CA-C-O 117.985 -1.007 . . . . 0.0 111.438 -179.528 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 501' ' ' C2E . . . . . 0.654 ' C21' ' NH2' ' A' ' 8' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 502' ' ' C2E . . . . . 0.649 ' O61' ' HG2' ' A' ' 9' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.1 mtp . . . . . 0 N--CA 1.49 1.555 0 N-CA-C 109.4 -0.592 . . . . 0.0 109.4 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.682 ' O ' ' N ' ' A' ' 4' ' ' GLN . 3.3 p 176.32 52.61 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.446 179.964 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -58.58 62.47 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.182 0.515 . . . . 0.0 110.449 -179.622 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.682 ' N ' ' O ' ' A' ' 2' ' ' SER . 14.4 mm100 -71.1 -3.14 18.31 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.474 -0.784 . . . . 0.0 110.576 -179.178 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 5' ' ' HIS . . . . . 0.444 ' O ' ' C ' ' A' ' 6' ' ' ASP . 0.9 OUTLIER -80.74 -16.83 52.85 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 178.352 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 6' ' ' ASP . . . . . 0.444 ' C ' ' O ' ' A' ' 5' ' ' HIS . 99.3 m-20 -31.38 147.84 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 115.166 -0.925 . . . . 0.0 110.963 178.94 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -81.36 133.35 35.41 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.149 0.499 . . . . 0.0 110.099 179.888 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.678 ' H ' ' C61' ' A' ' 502' ' ' C2E . 0.0 OUTLIER -123.44 -10.14 7.97 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.332 -179.679 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.737 ' O ' ' N ' ' A' ' 11' ' ' PHE . 3.4 mtt180 -97.79 74.99 2.38 Favored 'General case' 0 CA--C 1.516 -0.33 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 -179.903 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.523 ' C ' ' O ' ' A' ' 9' ' ' ARG . 0.0 OUTLIER 22.71 -78.12 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.662 -179.5 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 11' ' ' PHE . . . . . 0.737 ' N ' ' O ' ' A' ' 9' ' ' ARG . 9.9 m-85 -129.27 152.42 48.86 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.622 -0.51 . . . . 0.0 109.622 178.945 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 2.1 p-80 -47.17 157.24 0.19 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.812 0.339 . . . . 0.0 110.75 -179.505 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.618 ' NH1' ' N1 ' ' A' ' 501' ' ' C2E . 0.1 OUTLIER -103.61 -165.37 1.15 Allowed 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.499 -179.821 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.528 HG13 HG22 ' A' ' 102' ' ' VAL . 41.8 mm -102.77 96.25 4.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.491 179.982 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -93.83 119.96 33.46 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.274 0.559 . . . . 0.0 110.95 179.834 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 5.0 p90 -149.99 158.08 43.8 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 108.522 -0.918 . . . . 0.0 108.522 178.07 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 17.8 p-10 -95.6 145.92 24.87 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 120.185 -0.606 . . . . 0.0 110.746 -179.126 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -178.94 177.08 0.86 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.99 -0.55 . . . . 0.0 109.81 179.52 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 37.3 t0 -96.39 133.27 41.01 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 120.763 -0.375 . . . . 0.0 110.783 -179.679 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.56 ' O ' ' O ' ' A' ' 31' ' ' VAL . 2.9 p -132.97 150.61 52.15 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.371 0.605 . . . . 0.0 110.106 178.734 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 28.9 mm-40 -129.44 135.74 49.05 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.453 -0.794 . . . . 0.0 108.962 179.82 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -117.59 136.13 55.76 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.438 0 C-N-CA 120.227 -0.589 . . . . 0.0 110.376 -179.66 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.506 ' H ' HD12 ' A' ' 23' ' ' LEU . 0.1 OUTLIER -125.38 123.2 38.81 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.518 -0.764 . . . . 0.0 111.08 -179.167 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.677 ' NE2' ' CZ ' ' A' ' 57' ' ' PHE . 12.1 tt0 -130.05 102.71 6.38 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.382 -0.826 . . . . 0.0 109.493 178.419 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 78.31 -127.93 8.44 Favored Glycine 0 CA--C 1.522 0.476 0 N-CA-C 109.672 -1.371 . . . . 0.0 109.672 -178.69 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.47 ' OE1' ' O ' ' A' ' 26' ' ' GLU . 2.5 pp20? -99.77 11.25 39.72 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.627 0.251 . . . . 0.0 110.387 179.468 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.562 ' HB3' ' CZ2' ' A' ' 29' ' ' TRP . 2.5 mpt_? -110.89 132.08 54.51 Favored 'General case' 0 CA--C 1.522 -0.134 0 CA-C-O 121.032 0.444 . . . . 0.0 111.872 -179.536 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.597 ' NH2' ' NH2' ' A' ' 60' ' ' ARG . 5.9 ttt180 -126.88 146.49 50.27 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.767 -0.651 . . . . 0.0 109.776 179.227 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.562 ' CZ2' ' HB3' ' A' ' 27' ' ' ARG . 6.5 m-90 -144.63 155.1 43.45 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.464 -179.097 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -100.24 128.62 46.27 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.785 -0.643 . . . . 0.0 109.934 179.734 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.56 ' O ' ' O ' ' A' ' 20' ' ' SER . 35.3 m -140.83 155.83 22.36 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-O 121.109 0.481 . . . . 0.0 111.202 -179.703 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.571 ' H ' HD23 ' A' ' 32' ' ' LEU . 0.3 OUTLIER -94.03 131.34 39.62 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 108.553 -0.906 . . . . 0.0 108.553 178.375 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.5 tt -89.91 127.22 35.97 Favored 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 120.298 -0.561 . . . . 0.0 109.852 -179.735 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' HIS . . . . . 0.417 ' NE2' HD12 ' A' ' 32' ' ' LEU . 74.0 m-70 -92.45 -27.32 17.54 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.501 -0.772 . . . . 0.0 111.581 -178.634 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 -175.16 162.32 2.99 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 119.693 -0.803 . . . . 0.0 111.536 177.599 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.5 HG22 ' H ' ' A' ' 37' ' ' SER . 4.5 p -145.29 168.55 8.4 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.179 0 CA-C-N 115.503 -0.771 . . . . 0.0 111.094 -179.182 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.5 ' H ' HG22 ' A' ' 36' ' ' VAL . 20.1 t -142.08 169.71 17.07 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 107.738 -1.208 . . . . 0.0 107.738 178.474 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.611 HD23 ' H ' ' A' ' 38' ' ' LEU . 0.3 OUTLIER -66.31 -0.72 2.78 Favored 'General case' 0 C--N 1.322 -0.598 0 C-N-CA 119.552 -0.859 . . . . 0.0 110.874 -179.256 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 39' ' ' HIS . . . . . 0.448 ' CE1' ' O ' ' A' ' 87' ' ' CYS . 38.4 t-80 -158.9 38.16 0.22 Allowed 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 120.639 -0.424 . . . . 0.0 111.566 -179.828 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 40' ' ' GLY . . . . . 0.538 ' HA3' ' N3 ' ' A' ' 501' ' ' C2E . . . -177.46 158.16 23.33 Favored Glycine 0 CA--C 1.528 0.906 0 C-N-CA 120.606 -0.807 . . . . 0.0 111.422 179.871 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -148.49 148.95 15.56 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.374 0 CA-C-O 121.421 0.629 . . . . 0.0 111.768 -178.736 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.49 HD12 ' NH2' ' A' ' 13' ' ' ARG . 0.6 OUTLIER -122.39 138.5 54.51 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 115.01 -0.996 . . . . 0.0 108.947 178.96 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 23.6 m -142.83 174.58 5.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-O 121.16 0.505 . . . . 0.0 111.491 -179.695 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -95.13 144.9 17.47 Favored Glycine 0 CA--C 1.529 0.923 0 N-CA-C 109.528 -1.429 . . . . 0.0 109.528 178.285 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' GLN . . . . . 0.557 ' NE2' ' O ' ' A' ' 46' ' ' PRO . 18.0 tm0? -87.58 115.5 63.07 Favored Pre-proline 0 N--CA 1.464 0.264 0 CA-C-N 118.121 0.96 . . . . 0.0 112.099 -178.523 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.557 ' O ' ' NE2' ' A' ' 45' ' ' GLN . 96.1 Cg_endo -85.97 161.96 10.31 Favored 'Trans proline' 0 C--N 1.308 -1.588 0 C-N-CA 121.562 1.508 . . . . 0.0 111.213 178.587 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.2 mt-30 -65.14 -40.36 94.29 Favored 'General case' 0 N--CA 1.466 0.37 0 N-CA-C 112.585 0.587 . . . . 0.0 112.585 -178.709 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.572 ' O ' ' N ' ' A' ' 50' ' ' ASN . 6.4 m-20 -72.89 8.88 1.33 Allowed 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 112.035 0.383 . . . . 0.0 112.035 -178.479 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 49' ' ' TRP . . . . . 0.46 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 64.5 t-105 -58.97 69.06 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.729 -0.214 . . . . 0.0 111.531 -179.878 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' ASN . . . . . 0.572 ' N ' ' O ' ' A' ' 48' ' ' ASP . 15.8 t-20 -93.25 78.55 4.5 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 120.201 -0.6 . . . . 0.0 109.531 178.812 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -142.54 160.16 27.3 Favored Glycine 0 CA--C 1.52 0.401 0 N-CA-C 111.295 -0.722 . . . . 0.0 111.295 -179.557 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -95.02 121.97 61.21 Favored Pre-proline 0 C--N 1.325 -0.465 0 CA-C-N 115.367 -0.416 . . . . 0.0 110.662 -179.637 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 17.4 Cg_endo -60.15 -22.48 70.17 Favored 'Trans proline' 0 N--CA 1.494 1.519 0 C-N-CA 122.259 1.973 . . . . 0.0 111.564 -179.742 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 6.4 mm-40 -77.73 -21.68 51.52 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.472 179.927 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.511 ' O ' ' CE1' ' A' ' 57' ' ' PHE . 72.2 mtt-85 -97.65 149.86 36.17 Favored Pre-proline 0 CA--C 1.53 0.208 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.108 179.74 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 56' ' ' PRO . . . . . 0.53 ' O ' ' NE2' ' A' ' 24' ' ' GLN . 37.5 Cg_endo -65.56 160.93 40.74 Favored 'Trans proline' 0 N--CA 1.497 1.683 0 C-N-CA 123.116 2.544 . . . . 0.0 113.476 -179.093 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.677 ' CZ ' ' NE2' ' A' ' 24' ' ' GLN . 26.9 m-85 -129.58 156.61 43.91 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 114.905 -1.043 . . . . 0.0 108.599 179.076 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.403 ' O ' HD12 ' A' ' 23' ' ' LEU . 58.6 mt-10 -122.54 139.67 53.63 Favored 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 109.238 -0.652 . . . . 0.0 109.238 178.604 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -121.06 137.4 54.67 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.117 0.484 . . . . 0.0 111.74 -178.223 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.597 ' NH2' ' NH2' ' A' ' 28' ' ' ARG . 51.9 mtm-85 -123.19 127.84 49.2 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 177.524 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.487 HD11 ' SD ' ' A' ' 71' ' ' MET . 0.1 OUTLIER -107.9 151.1 26.23 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 120.493 -0.483 . . . . 0.0 111.066 -178.614 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 28.9 m-85 -134.0 109.67 9.15 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.17 179.527 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 1.6 tt -104.63 -82.7 0.51 Allowed 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 115.838 -0.619 . . . . 0.0 109.398 179.529 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.464 ' H ' ' HB ' ' A' ' 67' ' ' VAL . . . -77.76 179.27 51.3 Favored Glycine 0 CA--C 1.523 0.533 0 N-CA-C 109.416 -1.474 . . . . 0.0 109.416 178.568 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.812 ' N ' HD22 ' A' ' 65' ' ' LEU . 1.9 mm? -73.78 -31.89 63.52 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 119.925 -0.71 . . . . 0.0 110.129 -179.752 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.9 p30 -103.44 9.22 37.83 Favored 'General case' 0 C--N 1.332 -0.17 0 C-N-CA 122.775 0.43 . . . . 0.0 111.198 -179.927 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.538 ' O ' HG12 ' A' ' 67' ' ' VAL . 8.7 t -105.07 96.37 4.54 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.37 0 CA-C-O 121.2 0.524 . . . . 0.0 111.807 -178.78 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.443 HD12 ' N ' ' A' ' 69' ' ' ILE . 1.8 tp -114.37 118.48 33.98 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 178.678 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.443 ' N ' HD12 ' A' ' 68' ' ' LEU . 2.9 mt -113.9 145.0 20.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.339 -0.392 . . . . 0.0 111.353 -178.791 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 8.4 ptm180 -128.41 131.06 48.48 Favored 'General case' 0 C--O 1.24 0.562 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.078 179.033 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' MET . . . . . 0.487 ' SD ' HD11 ' A' ' 61' ' ' LEU . 0.4 OUTLIER -139.59 147.98 41.88 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.607 -0.724 . . . . 0.0 109.953 179.451 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -112.57 118.46 35.16 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 107.661 -1.237 . . . . 0.0 107.661 178.077 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.702 HD12 ' CB ' ' A' ' 85' ' ' PHE . 3.3 pt -129.32 168.02 23.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 N-CA-C 113.466 0.913 . . . . 0.0 113.466 -176.146 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 58.7 m -121.94 150.74 41.58 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 114.961 -1.018 . . . . 0.0 109.807 178.837 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.537 HD12 ' CE1' ' A' ' 85' ' ' PHE . 14.3 tp -66.6 123.58 20.47 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 121.268 0.556 . . . . 0.0 110.175 -179.837 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -98.15 -45.1 6.34 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 115.448 -0.796 . . . . 0.0 111.306 178.533 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' TRP . . . . . 0.507 ' CE2' ' HA3' ' A' ' 84' ' ' GLY . 66.5 p-90 -167.82 167.41 13.05 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.224 -178.965 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -146.4 123.85 11.7 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 109.824 -0.435 . . . . 0.0 109.824 178.622 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 41.4 ttt180 -152.11 133.54 14.54 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 119.917 -0.713 . . . . 0.0 112.804 179.843 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 56.77 46.91 19.1 Favored 'General case' 0 N--CA 1.464 0.233 0 N-CA-C 114.034 1.124 . . . . 0.0 114.034 176.763 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 83.16 -26.82 4.21 Favored Glycine 0 CA--C 1.523 0.569 0 C-N-CA 120.417 -0.897 . . . . 0.0 113.01 177.166 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 4.7 mt -89.56 153.34 20.85 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 117.528 0.664 . . . . 0.0 110.514 -179.06 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 79.4 mt -126.88 135.62 51.21 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.995 -179.256 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' GLY . . . . . 0.507 ' HA3' ' CE2' ' A' ' 77' ' ' TRP . . . -106.07 149.14 16.61 Favored Glycine 0 N--CA 1.454 -0.123 0 N-CA-C 109.75 -1.34 . . . . 0.0 109.75 178.906 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 85' ' ' PHE . . . . . 0.702 ' CB ' HD12 ' A' ' 73' ' ' ILE . 78.7 m-85 -142.05 142.93 32.89 Favored 'General case' 0 C--N 1.32 -0.697 0 C-N-CA 120.824 -0.35 . . . . 0.0 110.626 -179.748 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 23.9 tt0 -103.73 128.59 51.08 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 179.246 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' CYS . . . . . 0.503 ' HA ' HG22 ' A' ' 73' ' ' ILE . 14.7 t -68.43 120.85 15.17 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.087 0.47 . . . . 0.0 111.84 -178.463 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 6.1 tp60 -95.52 -36.98 11.08 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.366 179.561 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' HIS . . . . . 0.569 ' ND1' ' N ' ' A' ' 90' ' ' ILE . 0.0 OUTLIER -161.74 141.92 10.43 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.185 179.981 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.569 ' N ' ' ND1' ' A' ' 89' ' ' HIS . 6.3 tt -145.22 140.87 22.74 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-O 121.239 0.543 . . . . 0.0 110.058 -179.251 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -55.44 143.62 28.41 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-N 115.244 -0.889 . . . . 0.0 112.109 -178.325 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 3.8 tt -54.49 -42.07 70.31 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.166 -0.925 . . . . 0.0 109.956 -179.686 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -68.89 -38.7 79.8 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.604 -0.517 . . . . 0.0 109.604 179.206 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 94' ' ' SER . . . . . 0.421 ' HB3' HG23 ' A' ' 69' ' ' ILE . 7.4 m -64.75 -36.2 83.52 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.779 -0.646 . . . . 0.0 109.59 179.14 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 24.1 mt -59.0 -38.36 73.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.648 -0.705 . . . . 0.0 109.998 179.677 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -71.25 -42.29 69.0 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 120.312 -0.555 . . . . 0.0 111.283 -179.189 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 97' ' ' HIS . . . . . 0.45 ' O ' ' HB2' ' A' ' 100' ' ' ARG . 62.0 m-70 -61.94 -38.41 88.35 Favored 'General case' 0 C--N 1.325 -0.486 0 C-N-CA 119.638 -0.825 . . . . 0.0 109.49 -179.757 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.42 -34.18 76.71 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 178.139 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 48.1 mtt-85 -65.36 -38.06 88.93 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 108.362 -0.977 . . . . 0.0 108.362 177.719 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 100' ' ' ARG . . . . . 0.45 ' HB2' ' O ' ' A' ' 97' ' ' HIS . 1.6 mtp180 -61.44 -45.96 92.08 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 115.102 -0.954 . . . . 0.0 110.659 178.06 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -59.08 -37.9 78.19 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 -179.503 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 102' ' ' VAL . . . . . 0.528 HG22 HG13 ' A' ' 14' ' ' ILE . 70.0 t -68.6 -47.79 75.13 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 115.648 -0.706 . . . . 0.0 111.278 -179.955 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -65.67 -42.12 91.7 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.757 -179.079 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.455 ' CD2' ' N ' ' A' ' 104' ' ' LEU . 2.4 mm? -73.37 -40.31 64.46 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.611 -0.268 . . . . 0.0 111.179 -179.534 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 105' ' ' ASN . . . . . 0.434 ' OD1' ' CG2' ' A' ' 14' ' ' ILE . 2.2 m120 -69.02 -47.72 64.75 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 120.844 -0.342 . . . . 0.0 110.599 -179.866 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.628 HD21 ' HB1' ' A' ' 117' ' ' ALA . 8.5 tp -55.96 -30.64 62.03 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.491 -179.895 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 125.89 134.33 4.07 Favored Glycine 0 CA--C 1.524 0.627 0 N-CA-C 110.786 -0.926 . . . . 0.0 110.786 179.903 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 108' ' ' ASP . . . . . 0.704 ' O ' HD21 ' A' ' 111' ' ' LEU . 7.1 m-20 -71.82 -13.07 61.58 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.871 0.367 . . . . 0.0 110.274 179.812 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 109' ' ' GLU . . . . . 0.512 ' OE1' ' N ' ' A' ' 109' ' ' GLU . 30.6 mp0 -93.95 10.31 33.94 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.699 -179.849 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 80.7 mm-40 -140.6 67.75 1.36 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.624 179.915 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 111' ' ' LEU . . . . . 0.962 ' H ' HD22 ' A' ' 111' ' ' LEU . 0.4 OUTLIER -84.5 -12.97 53.24 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.268 179.753 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.449 ' O ' ' HB2' ' A' ' 117' ' ' ALA . 1.5 mt -52.67 98.16 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.579 -179.852 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 113' ' ' GLU . . . . . 0.551 ' H ' ' CD ' ' A' ' 113' ' ' GLU . 0.1 OUTLIER -68.74 171.54 7.65 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.384 179.706 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 114' ' ' ARG . . . . . 0.496 ' CB ' ' O ' ' A' ' 113' ' ' GLU . 0.1 OUTLIER 83.58 -174.56 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.456 179.957 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 115' ' ' GLU . . . . . 0.478 ' H ' ' HG3' ' A' ' 114' ' ' ARG . 7.7 pt-20 -54.38 -7.44 0.15 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.852 -179.834 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.475 ' O ' HG23 ' A' ' 120' ' ' VAL . 8.0 mp -65.14 -49.43 69.95 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.119 0.485 . . . . 0.0 110.464 -179.886 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 117' ' ' ALA . . . . . 0.628 ' HB1' HD21 ' A' ' 106' ' ' LEU . . . -62.0 -50.43 72.09 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.456 -0.793 . . . . 0.0 112.897 -178.9 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.57 HD22 ' CG ' ' A' ' 11' ' ' PHE . 2.4 mt -57.0 -48.62 78.03 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.033 -0.531 . . . . 0.0 112.149 -177.464 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 17.6 mt -73.6 -50.47 20.99 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 119.716 -0.794 . . . . 0.0 110.401 179.615 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 120' ' ' VAL . . . . . 0.485 ' O ' HG12 ' A' ' 120' ' ' VAL . 55.0 t -66.57 -13.91 16.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 N-CA-C 112.644 0.609 . . . . 0.0 112.644 -178.325 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 121' ' ' SER . . . . . 0.481 ' OG ' ' O ' ' A' ' 118' ' ' LEU . 7.3 p -64.81 -39.81 94.2 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 120.167 -0.613 . . . . 0.0 111.276 -178.389 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -165.71 159.82 16.68 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.388 -0.525 . . . . 0.0 111.257 179.729 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 123' ' ' HIS . . . . . 0.849 ' CG ' ' H ' ' A' ' 124' ' ' ASP . 12.2 p80 -171.2 -72.15 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.392 -179.726 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 124' ' ' ASP . . . . . 0.849 ' H ' ' CG ' ' A' ' 123' ' ' HIS . 31.4 t0 -116.38 45.99 1.68 Allowed 'General case' 0 C--N 1.334 -0.099 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.668 -179.61 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 125' ' ' ASP . . . . . 0.466 ' CB ' ' O ' ' A' ' 124' ' ' ASP . 0.5 OUTLIER . . . . . 0 C--O 1.22 -0.453 0 CA-C-O 117.945 -1.026 . . . . 0.0 110.071 -179.879 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 501' ' ' C2E . . . . . 0.967 ' O21' " H4'" ' A' ' 501' ' ' C2E . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 502' ' ' C2E . . . . . 0.678 ' C61' ' H ' ' A' ' 8' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.637 ' O ' ' CB ' ' A' ' 2' ' ' SER . 4.4 ptt? . . . . . 0 N--CA 1.491 1.578 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.637 ' CB ' ' O ' ' A' ' 1' ' ' MET . 16.5 m 112.28 -166.73 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.665 0 O-C-N 123.806 0.691 . . . . 0.0 110.683 179.922 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 11.1 p-10 -99.54 42.09 1.12 Allowed 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.125 178.811 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 2.9 tp-100 -115.25 14.36 16.87 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.241 177.841 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' HIS . . . . . 0.589 ' NE2' ' N ' ' A' ' 1' ' ' MET . 2.7 m170 -92.19 -4.3 54.37 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.801 179.946 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -47.88 152.45 0.76 Allowed 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 179.864 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -91.27 132.44 36.13 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 120.173 -0.611 . . . . 0.0 111.384 -179.277 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.7 HH21 ' C21' ' A' ' 501' ' ' C2E . 0.0 OUTLIER -121.52 -5.89 9.25 Favored 'General case' 0 CA--C 1.529 0.137 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.968 -179.573 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.554 ' O ' ' C ' ' A' ' 10' ' ' ARG . 1.6 ptt85 -105.56 133.94 49.48 Favored 'General case' 0 N--CA 1.465 0.289 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 179.136 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.554 ' C ' ' O ' ' A' ' 9' ' ' ARG . 0.4 OUTLIER -22.67 -67.66 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.607 -179.516 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 11' ' ' PHE . . . . . 0.41 ' O ' ' O ' ' A' ' 12' ' ' HIS . 7.2 p90 -151.03 158.83 44.61 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.823 0.344 . . . . 0.0 110.698 179.076 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' HIS . . . . . 0.433 ' HE2' ' CD ' ' A' ' 115' ' ' GLU . 0.0 OUTLIER -43.35 167.59 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.294 179.635 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -117.93 166.34 12.62 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 120.9 0.381 . . . . 0.0 110.799 -179.99 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.522 HG13 HG22 ' A' ' 102' ' ' VAL . 39.5 mm -71.09 97.51 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.02 179.424 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -95.07 120.04 34.6 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.513 0.673 . . . . 0.0 111.649 -179.351 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 2.2 p90 -149.99 158.05 43.77 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 108.146 -1.057 . . . . 0.0 108.146 177.659 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' ASP . . . . . 0.482 ' OD1' ' N ' ' A' ' 18' ' ' ALA . 23.7 t0 -95.62 146.18 24.68 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 120.049 -0.661 . . . . 0.0 111.085 -178.822 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.482 ' N ' ' OD1' ' A' ' 17' ' ' ASP . . . -179.16 175.79 0.93 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.06 179.392 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -96.17 134.11 39.65 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.688 -179.676 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.639 ' O ' ' O ' ' A' ' 31' ' ' VAL . 5.8 p -135.47 157.21 47.46 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.142 179.044 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.519 ' HB3' ' NH1' ' A' ' 28' ' ' ARG . 50.2 mt-10 -142.04 145.56 34.52 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 179.168 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 28.1 mt -123.01 136.39 59.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-O 121.168 0.508 . . . . 0.0 111.787 -178.235 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.493 ' H ' HD12 ' A' ' 23' ' ' LEU . 0.2 OUTLIER -119.58 123.38 43.79 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.562 -0.744 . . . . 0.0 110.603 179.919 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.425 ' O ' ' OE1' ' A' ' 24' ' ' GLN . 1.5 tm0? -130.51 101.91 5.92 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.404 -0.817 . . . . 0.0 109.671 178.929 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 80.33 -126.79 7.59 Favored Glycine 0 CA--C 1.524 0.624 0 N-CA-C 109.949 -1.26 . . . . 0.0 109.949 -178.715 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.3 pt-20 -100.66 11.96 38.42 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.872 0.367 . . . . 0.0 110.047 179.57 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.52 ' HB3' ' CZ2' ' A' ' 29' ' ' TRP . 38.4 mtt-85 -114.58 136.0 53.52 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 112.771 0.656 . . . . 0.0 112.771 -178.036 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.777 ' CG ' HH11 ' A' ' 28' ' ' ARG . 0.0 OUTLIER -128.11 149.64 50.32 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.261 179.1 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.539 ' NE1' ' O ' ' A' ' 48' ' ' ASP . 6.7 m-90 -146.74 155.03 42.08 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.454 -0.794 . . . . 0.0 110.297 -179.477 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 11.9 mt-10 -100.33 136.61 39.95 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.042 -0.526 . . . . 0.0 109.912 179.502 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.639 ' O ' ' O ' ' A' ' 20' ' ' SER . 17.1 m -147.38 156.93 9.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-O 121.25 0.547 . . . . 0.0 111.167 -179.552 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 1.072 ' H ' HD23 ' A' ' 32' ' ' LEU . 1.4 pt? -95.88 130.29 42.88 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 108.817 -0.808 . . . . 0.0 108.817 178.498 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.6 tt -91.7 126.0 36.63 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.267 0.556 . . . . 0.0 110.092 -179.527 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 74.5 m-70 -91.95 -27.45 17.87 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.276 -0.875 . . . . 0.0 111.803 -178.531 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -173.7 161.14 3.85 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 119.574 -0.85 . . . . 0.0 111.317 177.576 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.525 HG22 ' N ' ' A' ' 37' ' ' SER . 5.6 p -144.57 168.84 9.51 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.118 0 CA-C-N 115.584 -0.735 . . . . 0.0 111.067 -179.09 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.525 ' N ' HG22 ' A' ' 36' ' ' VAL . 10.8 m -142.28 169.65 17.19 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 107.982 -1.118 . . . . 0.0 107.982 178.518 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.586 ' H ' HD12 ' A' ' 38' ' ' LEU . 2.0 mp -65.57 -1.21 2.45 Favored 'General case' 0 C--N 1.324 -0.517 0 C-N-CA 119.583 -0.847 . . . . 0.0 110.305 -179.803 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' HIS . . . . . 0.532 ' NE2' ' NH1' ' A' ' 10' ' ' ARG . 47.7 p-80 -163.11 41.25 0.1 Allowed 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 120.748 -0.381 . . . . 0.0 111.469 179.813 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -176.07 152.24 12.66 Favored Glycine 0 CA--C 1.525 0.661 0 N-CA-C 110.997 -0.841 . . . . 0.0 110.997 179.835 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -147.31 148.67 16.31 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.208 0 CA-C-O 121.495 0.664 . . . . 0.0 111.647 -179.135 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -121.76 140.33 52.47 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 114.836 -1.075 . . . . 0.0 108.719 178.977 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.2 m -144.11 175.13 3.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-O 121.328 0.585 . . . . 0.0 111.752 -179.441 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -97.15 144.57 17.41 Favored Glycine 0 CA--C 1.529 0.938 0 N-CA-C 109.247 -1.541 . . . . 0.0 109.247 178.01 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' GLN . . . . . 0.409 ' O ' ' OE1' ' A' ' 45' ' ' GLN . 1.8 tm0? -87.42 115.6 63.33 Favored Pre-proline 0 N--CA 1.464 0.274 0 CA-C-N 118.127 0.963 . . . . 0.0 111.75 -178.431 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 79.4 Cg_endo -86.07 162.22 10.16 Favored 'Trans proline' 0 C--N 1.307 -1.65 0 C-N-CA 121.765 1.643 . . . . 0.0 111.462 178.931 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.498 ' OE1' ' N ' ' A' ' 47' ' ' GLN . 25.9 mp0 -65.28 -40.24 93.64 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 112.153 0.427 . . . . 0.0 112.153 -179.0 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.539 ' O ' ' NE1' ' A' ' 29' ' ' TRP . 16.4 m-20 -72.56 8.41 1.44 Allowed 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.05 0.389 . . . . 0.0 112.05 -178.538 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 49' ' ' TRP . . . . . 0.448 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 60.7 t-105 -61.45 68.43 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 111.696 0.258 . . . . 0.0 111.696 -179.657 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 50' ' ' ASN . . . . . 0.52 ' N ' ' O ' ' A' ' 48' ' ' ASP . 0.5 OUTLIER -93.28 78.98 4.47 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 120.023 -0.671 . . . . 0.0 109.682 178.688 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -141.77 158.22 26.57 Favored Glycine 0 CA--C 1.525 0.696 0 N-CA-C 111.369 -0.692 . . . . 0.0 111.369 -179.501 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 33.7 t0 -93.99 111.49 53.26 Favored Pre-proline 0 CA--C 1.533 0.311 0 CA-C-N 115.744 -0.228 . . . . 0.0 110.774 -179.89 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 76.7 Cg_exo -47.24 -22.28 2.31 Favored 'Trans proline' 0 N--CA 1.496 1.63 0 C-N-CA 122.597 2.198 . . . . 0.0 112.413 179.858 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 37.3 mt-30 -79.13 -24.01 43.64 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.82 -178.581 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.55 ' O ' ' CE1' ' A' ' 57' ' ' PHE . 3.0 mpt_? -94.82 151.4 38.99 Favored Pre-proline 0 C--N 1.33 -0.257 0 C-N-CA 120.581 -0.448 . . . . 0.0 109.962 179.69 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 35.3 Cg_endo -64.3 160.86 36.83 Favored 'Trans proline' 0 N--CA 1.495 1.6 0 C-N-CA 122.816 2.344 . . . . 0.0 113.285 -178.77 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.55 ' CE1' ' O ' ' A' ' 55' ' ' ARG . 44.5 m-85 -130.5 155.68 46.06 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 114.991 -1.004 . . . . 0.0 109.005 179.419 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -121.61 134.46 55.0 Favored 'General case' 0 C--O 1.22 -0.452 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 178.728 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' ALA . . . . . 0.555 ' HB2' HD13 ' A' ' 73' ' ' ILE . . . -115.86 135.66 53.79 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.113 0.483 . . . . 0.0 112.108 -178.454 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.46 ' NE ' HD13 ' A' ' 23' ' ' LEU . 2.4 mpt_? -121.35 127.72 51.54 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 177.361 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 10.6 mt -108.93 137.15 47.3 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.914 0.387 . . . . 0.0 110.636 -179.061 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' TYR . . . . . 0.613 ' N ' ' CD1' ' A' ' 62' ' ' TYR . 1.0 OUTLIER -120.34 110.21 16.28 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.348 179.785 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.528 HD23 ' C ' ' A' ' 63' ' ' LEU . 2.2 tt -104.54 -84.55 0.48 Allowed 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.413 179.401 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.45 ' H ' ' HB ' ' A' ' 67' ' ' VAL . . . -76.52 -176.89 43.17 Favored Glycine 0 CA--C 1.521 0.455 0 N-CA-C 109.503 -1.439 . . . . 0.0 109.503 178.62 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 3.2 mt -76.11 -32.22 59.07 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.015 -0.674 . . . . 0.0 110.319 -179.703 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.446 ' N ' ' OD1' ' A' ' 66' ' ' ASP . 1.3 m-20 -104.06 8.8 36.58 Favored 'General case' 0 C--N 1.332 -0.191 0 C-N-CA 122.759 0.424 . . . . 0.0 111.105 -179.913 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.55 ' O ' HG12 ' A' ' 67' ' ' VAL . 9.3 t -103.34 95.05 3.54 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.296 0 CA-C-O 121.529 0.681 . . . . 0.0 111.8 -178.759 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -112.15 117.74 33.43 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 114.753 -1.112 . . . . 0.0 108.259 178.208 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.534 HG23 ' CB ' ' A' ' 94' ' ' SER . 6.0 mt -113.9 143.62 23.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.887 0.375 . . . . 0.0 110.562 -179.043 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 11.6 mtm180 -128.26 131.26 48.76 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.914 179.191 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 2.2 mtp -140.39 148.88 41.92 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.917 -0.583 . . . . 0.0 109.945 179.651 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' GLU . . . . . 0.417 ' HB2' ' CD2' ' A' ' 89' ' ' HIS . 12.0 tm-20 -102.39 134.71 45.26 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 107.48 -1.304 . . . . 0.0 107.48 178.247 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.555 HD13 ' HB2' ' A' ' 59' ' ' ALA . 5.3 pt -143.97 157.46 15.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 N-CA-C 113.472 0.916 . . . . 0.0 113.472 -177.352 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -121.18 150.17 41.71 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 114.759 -1.109 . . . . 0.0 109.444 178.604 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.572 HD12 ' CE1' ' A' ' 85' ' ' PHE . 8.7 tp -66.71 123.76 21.01 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.265 0.555 . . . . 0.0 110.242 -179.638 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -98.0 -43.99 6.84 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 115.05 -0.977 . . . . 0.0 111.011 178.138 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' TRP . . . . . 0.586 ' NE1' ' HA3' ' A' ' 84' ' ' GLY . 68.0 p-90 -168.63 168.06 11.06 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.047 -179.13 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -146.45 123.72 11.57 Favored 'General case' 0 N--CA 1.464 0.257 0 N-CA-C 109.804 -0.443 . . . . 0.0 109.804 178.291 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' ARG . . . . . 0.408 ' NH1' " O2'" ' A' ' 502' ' ' C2E . 6.7 ttt-85 -152.26 133.93 14.69 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 119.922 -0.711 . . . . 0.0 112.906 179.979 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 56.64 47.16 18.95 Favored 'General case' 0 N--CA 1.465 0.285 0 N-CA-C 113.649 0.981 . . . . 0.0 113.649 176.752 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 81.78 -26.49 3.66 Favored Glycine 0 CA--C 1.522 0.529 0 C-N-CA 120.506 -0.854 . . . . 0.0 113.104 177.386 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 4.7 mt -89.6 153.79 20.48 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 117.685 0.742 . . . . 0.0 110.447 -179.289 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 43.5 mt -126.27 135.5 51.62 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.981 -179.395 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' GLY . . . . . 0.586 ' HA3' ' NE1' ' A' ' 77' ' ' TRP . . . -98.83 152.61 19.72 Favored Glycine 0 N--CA 1.451 -0.31 0 N-CA-C 109.949 -1.26 . . . . 0.0 109.949 178.963 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 85' ' ' PHE . . . . . 0.572 ' CE1' HD12 ' A' ' 75' ' ' LEU . 40.7 m-85 -145.51 136.69 24.85 Favored 'General case' 0 C--N 1.319 -0.753 0 C-N-CA 120.673 -0.411 . . . . 0.0 111.017 -179.227 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.458 ' O ' ' NE2' ' A' ' 88' ' ' GLN . 31.5 tt0 -103.66 127.61 51.08 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 179.231 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 3.7 t -73.76 124.81 26.76 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.062 0.458 . . . . 0.0 112.042 -178.445 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 88' ' ' GLN . . . . . 0.458 ' NE2' ' O ' ' A' ' 86' ' ' GLU . 39.1 mm-40 -99.41 -32.12 11.31 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.692 -0.685 . . . . 0.0 110.228 179.277 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 89' ' ' HIS . . . . . 0.57 ' C ' ' ND1' ' A' ' 89' ' ' HIS . 0.0 OUTLIER -161.75 141.8 10.35 Favored 'General case' 0 C--O 1.225 -0.222 0 CA-C-O 121.033 0.444 . . . . 0.0 110.151 179.433 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.452 HG23 ' CG1' ' A' ' 95' ' ' ILE . 5.7 tt -145.66 141.29 22.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-O 121.436 0.636 . . . . 0.0 110.151 -179.577 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 91' ' ' ASP . . . . . 0.509 ' N ' ' OD1' ' A' ' 91' ' ' ASP . 0.0 OUTLIER -54.07 140.28 32.27 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 114.873 -1.058 . . . . 0.0 112.125 -178.39 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 16.6 tp -54.18 -41.87 69.04 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.043 -0.98 . . . . 0.0 110.01 -179.78 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -69.67 -40.2 76.55 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 179.252 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 94' ' ' SER . . . . . 0.534 ' CB ' HG23 ' A' ' 69' ' ' ILE . 4.0 m -64.48 -35.87 82.35 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.956 179.459 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 95' ' ' ILE . . . . . 0.452 ' CG1' HG23 ' A' ' 90' ' ' ILE . 30.4 mt -58.51 -37.41 64.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 115.888 -0.597 . . . . 0.0 109.786 179.487 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -70.74 -41.86 71.27 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.148 -179.121 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 64.3 m-70 -61.75 -36.3 80.61 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 119.41 -0.916 . . . . 0.0 109.365 179.941 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.447 ' O ' HG23 ' A' ' 102' ' ' VAL . 5.4 mp -67.57 -33.72 75.59 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 177.763 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 2.4 mtp180 -64.29 -36.76 85.16 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 178.324 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 100' ' ' ARG . . . . . 0.414 ' HG2' HH11 ' A' ' 100' ' ' ARG . 20.7 mtt-85 -60.36 -45.85 92.02 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.962 179.043 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 2.8 mt -63.04 -34.94 78.66 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 -179.822 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 102' ' ' VAL . . . . . 0.522 HG22 HG13 ' A' ' 14' ' ' ILE . 79.1 t -68.4 -42.38 84.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.604 179.658 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 73.9 mt-10 -65.17 -44.92 86.96 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.771 -179.227 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 30.2 mt -70.43 -43.13 70.57 Favored 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 120.546 -0.462 . . . . 0.0 111.522 -178.718 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 4.4 m120 -68.28 -25.84 65.36 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 120.705 -0.398 . . . . 0.0 110.895 -179.438 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 13.1 tp -55.9 -29.42 60.01 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.927 0.394 . . . . 0.0 110.201 179.802 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 104.33 149.68 20.09 Favored Glycine 0 CA--C 1.524 0.602 0 N-CA-C 110.913 -0.875 . . . . 0.0 110.913 179.979 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 88.5 m-20 -77.38 -42.4 36.56 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.814 0.34 . . . . 0.0 110.552 -179.949 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -48.68 130.0 17.07 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.398 -179.958 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 69.4 mm-40 -88.68 80.62 7.22 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.71 179.985 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 8.0 mt -58.95 134.43 56.94 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.547 179.987 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.409 HD13 ' HA ' ' A' ' 112' ' ' LEU . 4.1 mm? -55.92 -23.12 29.71 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.358 179.827 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -135.02 174.17 10.91 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.229 -179.996 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 114' ' ' ARG . . . . . 0.408 ' C ' ' H ' ' A' ' 116' ' ' LEU . 10.0 ptm180 -177.75 172.85 1.67 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.721 -179.902 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 115' ' ' GLU . . . . . 0.433 ' CD ' ' HE2' ' A' ' 12' ' ' HIS . 56.9 mt-10 -73.89 41.04 0.12 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.956 -179.656 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.408 ' H ' ' C ' ' A' ' 114' ' ' ARG . 1.4 mt -67.68 -40.49 84.42 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 112.483 0.549 . . . . 0.0 112.483 -179.015 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 117' ' ' ALA . . . . . 0.578 ' O ' HG23 ' A' ' 120' ' ' VAL . . . -70.78 -26.51 63.37 Favored 'General case' 0 N--CA 1.463 0.217 0 N-CA-C 112.218 0.451 . . . . 0.0 112.218 179.803 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.408 ' C ' ' N ' ' A' ' 120' ' ' VAL . 6.8 mt -56.36 -36.58 68.96 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 120.607 -0.437 . . . . 0.0 111.651 -177.59 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 119' ' ' LEU . . . . . 0.428 ' O ' ' O ' ' A' ' 122' ' ' ALA . 12.7 mt -55.52 -10.84 0.72 Allowed 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 119.965 -0.694 . . . . 0.0 110.153 -178.147 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 120' ' ' VAL . . . . . 0.578 HG23 ' O ' ' A' ' 117' ' ' ALA . 21.0 t -56.52 -14.27 1.85 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.422 179.977 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 4.9 p -78.52 -32.25 47.93 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.516 179.961 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 122' ' ' ALA . . . . . 0.428 ' O ' ' O ' ' A' ' 119' ' ' LEU . . . -163.94 158.34 19.62 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.368 -179.9 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 123' ' ' HIS . . . . . 0.704 ' CG ' ' H ' ' A' ' 124' ' ' ASP . 19.5 p80 -116.78 -61.93 1.65 Allowed 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.729 179.967 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 124' ' ' ASP . . . . . 0.704 ' H ' ' CG ' ' A' ' 123' ' ' HIS . 3.8 m-20 61.17 18.02 8.69 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.919 0.39 . . . . 0.0 110.281 -179.741 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 125' ' ' ASP . . . . . 0.416 ' O ' ' OD1' ' A' ' 125' ' ' ASP . 49.9 t0 . . . . . 0 C--O 1.22 -0.49 0 CA-C-O 118.036 -0.983 . . . . 0.0 110.557 179.962 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 501' ' ' C2E . . . . . 0.7 ' C21' HH21 ' A' ' 8' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 502' ' ' C2E . . . . . 0.505 ' C4 ' ' CE2' ' A' ' 77' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.466 ' O ' ' OG ' ' A' ' 2' ' ' SER . 15.2 ttt . . . . . 0 N--CA 1.49 1.534 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.466 ' OG ' ' O ' ' A' ' 1' ' ' MET . 3.6 m -169.85 19.21 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.716 179.806 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 95.1 m-20 -98.22 109.52 22.26 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 179.26 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.57 ' O ' ' N ' ' A' ' 6' ' ' ASP . 0.5 OUTLIER -109.53 14.59 23.44 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.476 -0.784 . . . . 0.0 109.855 179.613 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 5' ' ' HIS . . . . . 0.53 ' CG ' ' C ' ' A' ' 4' ' ' GLN . 1.5 p80 41.95 17.3 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.414 -179.215 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' ASP . . . . . 0.595 ' O ' ' CZ ' ' A' ' 8' ' ' ARG . 0.5 OUTLIER 39.82 83.43 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.467 179.745 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.496 ' CD ' ' O ' ' A' ' 7' ' ' GLU . 0.3 OUTLIER -88.65 128.64 35.6 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 120.306 -0.558 . . . . 0.0 110.5 -179.69 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.652 ' NH2' ' C21' ' A' ' 501' ' ' C2E . 0.0 OUTLIER -125.65 -8.26 6.8 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.235 -179.19 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.733 ' O ' ' N ' ' A' ' 11' ' ' PHE . 2.1 ptt85 -110.87 96.91 6.45 Favored 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 120.919 -0.312 . . . . 0.0 110.174 179.977 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.765 ' NH1' ' H ' ' A' ' 124' ' ' ASP . 0.0 OUTLIER 16.71 -74.01 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 115.171 -0.922 . . . . 0.0 111.19 -179.658 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 11' ' ' PHE . . . . . 0.733 ' N ' ' O ' ' A' ' 9' ' ' ARG . 0.1 OUTLIER -150.36 170.47 18.96 Favored 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 179.338 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -43.23 161.19 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.867 0.365 . . . . 0.0 110.702 -179.826 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.433 ' O ' ' N ' ' A' ' 15' ' ' ALA . 21.2 mtm180 -111.57 147.82 34.6 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.185 -179.906 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.678 HG12 HG22 ' A' ' 102' ' ' VAL . 1.3 mp -53.8 92.39 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 179.705 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.433 ' N ' ' O ' ' A' ' 13' ' ' ARG . . . -95.65 120.06 35.23 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.486 0.66 . . . . 0.0 112.134 -179.039 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 6.4 p90 -149.85 158.6 44.32 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 107.968 -1.123 . . . . 0.0 107.968 177.183 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -95.33 146.32 24.46 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 120.138 -0.625 . . . . 0.0 110.943 -178.809 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -178.92 176.37 0.92 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.863 179.427 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -96.62 133.82 40.63 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.831 -179.829 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.572 ' O ' ' O ' ' A' ' 31' ' ' VAL . 13.0 t -133.74 152.92 52.01 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 121.103 0.478 . . . . 0.0 110.255 178.617 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 91.0 mt-10 -132.32 151.8 51.68 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 179.497 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.406 ' HA ' ' O ' ' A' ' 58' ' ' GLU . 79.5 mt -132.71 136.38 55.92 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.468 0 C-N-CA 120.066 -0.654 . . . . 0.0 111.427 -179.568 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.522 HD13 ' NE ' ' A' ' 60' ' ' ARG . 0.2 OUTLIER -123.45 123.35 40.46 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.33 -0.85 . . . . 0.0 111.054 -179.398 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.698 ' NE2' ' CE2' ' A' ' 57' ' ' PHE . 9.5 tt0 -129.58 102.05 6.2 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.428 -0.805 . . . . 0.0 109.614 178.472 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 80.3 -127.22 7.82 Favored Glycine 0 CA--C 1.523 0.561 0 N-CA-C 109.847 -1.301 . . . . 0.0 109.847 -178.781 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.434 ' OE1' ' O ' ' A' ' 26' ' ' GLU . 2.9 pp20? -100.04 12.2 37.48 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.969 0.414 . . . . 0.0 110.095 179.434 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.521 ' HB3' ' CZ2' ' A' ' 29' ' ' TRP . 27.5 mtt-85 -113.77 135.25 54.16 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.883 -0.599 . . . . 0.0 112.605 -178.401 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.435 ' HG3' ' N ' ' A' ' 29' ' ' TRP . 11.1 ttt-85 -129.01 150.48 50.4 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.169 179.132 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.521 ' CZ2' ' HB3' ' A' ' 27' ' ' ARG . 6.7 m-90 -147.94 156.18 42.39 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.518 -179.365 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 12.4 mt-10 -99.9 138.09 37.45 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 178.978 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.572 ' O ' ' O ' ' A' ' 20' ' ' SER . 11.0 m -147.77 157.37 9.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-O 121.255 0.55 . . . . 0.0 111.214 -179.255 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 1.009 ' H ' HD23 ' A' ' 32' ' ' LEU . 0.6 OUTLIER -98.01 130.61 44.83 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 108.428 -0.953 . . . . 0.0 108.428 178.499 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.6 tt -94.35 125.05 38.75 Favored 'General case' 0 C--N 1.324 -0.524 0 C-N-CA 120.385 -0.526 . . . . 0.0 109.786 -179.679 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 16.1 m-70 -90.7 -27.16 19.17 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.469 -0.787 . . . . 0.0 111.764 -178.341 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 -172.62 160.81 4.75 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 119.566 -0.854 . . . . 0.0 111.084 177.498 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.54 HG22 ' H ' ' A' ' 37' ' ' SER . 4.8 p -145.33 169.34 7.45 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.004 -178.965 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.54 ' H ' HG22 ' A' ' 36' ' ' VAL . 24.9 t -141.64 167.84 21.19 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 107.883 -1.154 . . . . 0.0 107.883 178.262 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.634 HD23 ' H ' ' A' ' 38' ' ' LEU . 0.1 OUTLIER -64.77 -1.57 2.01 Favored 'General case' 0 C--N 1.321 -0.669 0 C-N-CA 119.95 -0.7 . . . . 0.0 110.562 -179.259 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 39' ' ' HIS . . . . . 0.553 ' NE2' ' O ' ' A' ' 87' ' ' CYS . 19.9 t60 -159.14 41.68 0.23 Allowed 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 120.786 -0.366 . . . . 0.0 111.397 -179.523 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 40' ' ' GLY . . . . . 0.416 ' HA3' ' N3 ' ' A' ' 501' ' ' C2E . . . 177.77 158.69 21.26 Favored Glycine 0 CA--C 1.527 0.798 0 N-CA-C 111.165 -0.774 . . . . 0.0 111.165 179.697 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.409 HG21 HG21 ' A' ' 73' ' ' ILE . 0.1 OUTLIER -148.56 148.95 15.53 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.321 0 CA-C-O 121.342 0.591 . . . . 0.0 111.584 -178.856 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.615 HD23 ' N ' ' A' ' 43' ' ' VAL . 1.6 tt -121.59 136.19 54.96 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 115.177 -0.92 . . . . 0.0 108.706 178.729 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.615 ' N ' HD23 ' A' ' 42' ' ' LEU . 24.0 m -141.33 174.84 6.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-O 121.294 0.568 . . . . 0.0 111.964 -179.295 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -98.19 144.81 17.47 Favored Glycine 0 CA--C 1.529 0.912 0 N-CA-C 109.215 -1.554 . . . . 0.0 109.215 178.049 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' GLN . . . . . 0.578 ' O ' ' CD ' ' A' ' 45' ' ' GLN . 3.8 pp0? -88.03 116.72 67.05 Favored Pre-proline 0 CA--C 1.535 0.37 0 CA-C-N 118.078 0.939 . . . . 0.0 111.723 -178.349 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -84.82 162.57 12.09 Favored 'Trans proline' 0 C--N 1.305 -1.73 0 C-N-CA 121.384 1.389 . . . . 0.0 110.91 178.595 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -64.52 -40.18 95.16 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.698 0.285 . . . . 0.0 111.539 -178.965 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.521 ' O ' ' NE1' ' A' ' 29' ' ' TRP . 1.0 OUTLIER -70.45 8.64 0.77 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.821 -179.058 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 49' ' ' TRP . . . . . 0.461 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 60.7 t-105 -63.3 67.72 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 120.742 -0.383 . . . . 0.0 111.725 -179.39 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 50' ' ' ASN . . . . . 0.502 ' N ' ' O ' ' A' ' 48' ' ' ASP . 44.2 t-20 -93.08 78.84 4.58 Favored 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 120.332 -0.547 . . . . 0.0 109.932 178.857 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -141.21 160.16 26.76 Favored Glycine 0 CA--C 1.525 0.696 0 N-CA-C 111.462 -0.655 . . . . 0.0 111.462 -179.528 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' ASP . . . . . 0.436 ' OD1' ' OE1' ' A' ' 54' ' ' GLN . 25.7 t0 -95.46 110.73 52.39 Favored Pre-proline 0 CA--C 1.533 0.326 0 CA-C-N 115.79 -0.205 . . . . 0.0 110.739 -179.873 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 71.4 Cg_exo -46.66 -22.66 1.92 Allowed 'Trans proline' 0 N--CA 1.496 1.671 0 C-N-CA 122.626 2.217 . . . . 0.0 112.751 -179.811 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.436 ' OE1' ' OD1' ' A' ' 52' ' ' ASP . 11.0 mp0 -80.29 -23.91 40.39 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 120.541 -0.464 . . . . 0.0 111.818 -178.968 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.539 ' O ' ' CE1' ' A' ' 57' ' ' PHE . 18.2 mtt-85 -92.72 151.03 40.63 Favored Pre-proline 0 C--N 1.331 -0.224 0 C-N-CA 120.354 -0.538 . . . . 0.0 109.736 179.563 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 56' ' ' PRO . . . . . 0.561 ' O ' ' NE2' ' A' ' 24' ' ' GLN . 35.7 Cg_endo -64.76 160.88 38.45 Favored 'Trans proline' 0 C--N 1.308 -1.594 0 C-N-CA 122.723 2.282 . . . . 0.0 113.187 -178.735 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.698 ' CE2' ' NE2' ' A' ' 24' ' ' GLN . 42.9 m-85 -130.34 154.4 47.7 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 114.889 -1.051 . . . . 0.0 108.897 179.178 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.406 ' O ' ' HA ' ' A' ' 22' ' ' ILE . 83.4 mt-10 -120.6 134.96 55.23 Favored 'General case' 0 N--CA 1.467 0.392 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 178.469 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 59' ' ' ALA . . . . . 0.486 ' HB2' ' CD1' ' A' ' 73' ' ' ILE . . . -117.0 137.28 52.33 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.212 0.529 . . . . 0.0 112.296 -178.187 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.522 ' NE ' HD13 ' A' ' 23' ' ' LEU . 0.9 OUTLIER -122.72 127.66 49.52 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.214 -0.903 . . . . 0.0 108.681 177.254 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 7.8 mt -110.66 139.01 46.32 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 120.73 -0.388 . . . . 0.0 110.419 -179.348 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' TYR . . . . . 0.5 ' N ' ' CD1' ' A' ' 62' ' ' TYR . 6.7 m-85 -120.27 111.24 17.54 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.935 -179.871 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.572 HD23 ' C ' ' A' ' 63' ' ' LEU . 5.8 tt -105.09 -83.51 0.51 Allowed 'General case' 0 N--CA 1.462 0.15 0 CA-C-N 115.849 -0.614 . . . . 0.0 109.492 179.14 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.453 ' H ' ' HB ' ' A' ' 67' ' ' VAL . . . -77.81 178.85 51.81 Favored Glycine 0 CA--C 1.523 0.542 0 N-CA-C 109.523 -1.431 . . . . 0.0 109.523 178.786 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.532 HD23 ' O ' ' A' ' 65' ' ' LEU . 0.9 OUTLIER -73.81 -33.23 64.09 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 119.898 -0.721 . . . . 0.0 110.119 -179.627 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 39.3 t0 -102.88 8.65 39.15 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.097 179.881 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.566 ' O ' HG12 ' A' ' 67' ' ' VAL . 7.7 t -104.75 96.27 4.46 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.284 0 CA-C-O 121.308 0.575 . . . . 0.0 111.927 -178.812 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 6.0 tp -113.01 117.17 31.28 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 108.172 -1.048 . . . . 0.0 108.172 178.1 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.495 HG23 ' CB ' ' A' ' 94' ' ' SER . 3.3 mt -111.91 143.69 21.2 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-O 120.818 0.342 . . . . 0.0 110.498 -179.061 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.412 ' C ' ' HG2' ' A' ' 71' ' ' MET . 24.7 mtm-85 -128.35 130.46 47.79 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.878 179.257 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 71' ' ' MET . . . . . 0.807 ' SD ' HD12 ' A' ' 90' ' ' ILE . 0.9 OUTLIER -139.48 148.78 43.16 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.858 -0.61 . . . . 0.0 109.741 179.575 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 72.1 tt0 -102.28 129.48 48.71 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 107.798 -1.186 . . . . 0.0 107.798 178.448 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.486 ' CD1' ' HB2' ' A' ' 59' ' ' ALA . 13.8 pt -138.16 157.54 31.79 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 C-N-CA 119.637 -0.825 . . . . 0.0 113.138 -177.491 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 74' ' ' SER . . . . . 0.587 ' N ' ' OE1' ' A' ' 88' ' ' GLN . 95.6 p -121.44 151.23 40.45 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 114.74 -1.118 . . . . 0.0 109.61 178.521 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.48 ' CD1' ' CZ ' ' A' ' 85' ' ' PHE . 8.0 tp -66.53 123.05 18.98 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.105 0.479 . . . . 0.0 110.431 -179.449 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -98.1 -44.38 6.64 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.964 178.042 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' TRP . . . . . 0.709 ' NE1' ' HA3' ' A' ' 84' ' ' GLY . 69.3 p-90 -164.95 170.55 15.11 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.185 -179.454 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -151.34 124.43 8.72 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 121.155 -0.218 . . . . 0.0 110.732 179.117 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' ARG . . . . . 0.552 ' NE ' " O2'" ' A' ' 502' ' ' C2E . 0.0 OUTLIER -151.95 131.68 13.19 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 112.933 0.716 . . . . 0.0 112.933 179.245 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 54.26 47.06 23.91 Favored 'General case' 0 N--CA 1.468 0.425 0 N-CA-C 113.791 1.034 . . . . 0.0 113.791 176.069 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 72.15 13.06 76.36 Favored Glycine 0 CA--C 1.522 0.503 0 C-N-CA 120.18 -1.01 . . . . 0.0 111.739 178.338 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 48.8 mt -116.91 138.06 51.79 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 178.818 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.488 HD11 ' CB ' ' A' ' 45' ' ' GLN . 29.7 mt -125.78 135.02 51.55 Favored 'General case' 0 CA--C 1.513 -0.456 0 C-N-CA 120.382 -0.527 . . . . 0.0 111.491 -178.98 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 84' ' ' GLY . . . . . 0.709 ' HA3' ' NE1' ' A' ' 77' ' ' TRP . . . -98.4 153.95 20.02 Favored Glycine 0 N--CA 1.447 -0.629 0 N-CA-C 109.334 -1.506 . . . . 0.0 109.334 178.381 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 85' ' ' PHE . . . . . 0.484 ' CG ' HD12 ' A' ' 73' ' ' ILE . 28.8 m-85 -145.39 131.94 19.82 Favored 'General case' 0 C--N 1.312 -1.045 0 C-N-CA 120.794 -0.362 . . . . 0.0 110.568 -179.274 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.501 ' O ' ' NE2' ' A' ' 88' ' ' GLN . 20.3 pt-20 -103.6 128.77 50.82 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 179.692 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 87' ' ' CYS . . . . . 0.553 ' O ' ' NE2' ' A' ' 39' ' ' HIS . 5.2 t -75.71 124.52 27.4 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 112.234 0.457 . . . . 0.0 112.234 -178.028 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 88' ' ' GLN . . . . . 0.695 HE21 ' CA ' ' A' ' 88' ' ' GLN . 0.0 OUTLIER -102.12 -30.42 11.16 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.088 179.124 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 89' ' ' HIS . . . . . 0.609 ' ND1' ' N ' ' A' ' 90' ' ' ILE . 0.0 OUTLIER -158.77 140.47 13.53 Favored 'General case' 0 C--O 1.225 -0.198 0 CA-C-O 120.989 0.424 . . . . 0.0 110.202 179.298 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.807 HD12 ' SD ' ' A' ' 71' ' ' MET . 6.2 tt -146.18 140.73 21.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.043 -179.384 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 91' ' ' ASP . . . . . 0.529 ' O ' ' OG ' ' A' ' 94' ' ' SER . 0.1 OUTLIER -53.94 142.27 25.14 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 115.308 -0.86 . . . . 0.0 111.993 -178.534 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 8.0 tp -54.37 -42.3 70.17 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.238 -0.892 . . . . 0.0 110.168 -179.831 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 3.6 p30 -69.03 -42.08 76.83 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.02 179.499 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 94' ' ' SER . . . . . 0.529 ' OG ' ' O ' ' A' ' 91' ' ' ASP . 2.0 p -60.26 -37.74 81.37 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.975 179.606 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 63.5 mt -58.77 -38.12 70.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.128 179.53 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -70.42 -40.44 73.84 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 120.292 -0.563 . . . . 0.0 110.988 -178.87 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 68.1 m-70 -64.29 -44.23 92.31 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 119.978 -0.689 . . . . 0.0 109.847 179.923 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.676 ' O ' HG23 ' A' ' 102' ' ' VAL . 0.2 OUTLIER -68.13 -35.49 78.19 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.35 179.299 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.402 HH11 ' HD3' ' A' ' 99' ' ' ARG . 13.0 mtp-105 -66.22 -41.94 89.4 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 120.94 -0.304 . . . . 0.0 111.466 -179.688 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 3.6 ptm85 -68.95 -36.1 77.53 Favored 'General case' 0 C--N 1.331 -0.201 0 C-N-CA 120.162 -0.615 . . . . 0.0 109.587 177.606 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.557 HD21 HD12 ' A' ' 63' ' ' LEU . 2.2 mp -57.83 -34.91 70.19 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 177.443 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 102' ' ' VAL . . . . . 0.678 HG22 HG12 ' A' ' 14' ' ' ILE . 95.3 t -68.75 -45.44 81.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.195 179.232 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 -63.93 -35.59 81.17 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.644 179.898 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 9.1 mt -73.07 -42.55 62.93 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.576 -179.54 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -58.28 -50.5 73.38 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.444 179.892 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 9.3 mp -62.39 -25.23 67.82 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.272 179.939 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 110.93 -155.64 15.99 Favored Glycine 0 CA--C 1.522 0.501 0 N-CA-C 110.587 -1.005 . . . . 0.0 110.587 -179.877 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 108' ' ' ASP . . . . . 0.468 ' O ' ' N ' ' A' ' 110' ' ' GLU . 22.8 t70 -96.86 170.44 9.17 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.796 0.332 . . . . 0.0 110.351 179.877 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 109' ' ' GLU . . . . . 0.453 ' N ' ' CG ' ' A' ' 108' ' ' ASP . 0.0 OUTLIER -67.28 55.98 0.05 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.582 -179.957 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 110' ' ' GLU . . . . . 0.468 ' N ' ' O ' ' A' ' 108' ' ' ASP . 3.4 tt0 -46.46 174.7 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.445 179.932 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 1.4 mp -61.24 -33.13 73.01 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.743 -179.924 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.675 ' O ' HD23 ' A' ' 112' ' ' LEU . 0.4 OUTLIER -156.25 167.38 30.6 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.6 179.763 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 113' ' ' GLU . . . . . 0.42 ' O ' ' O ' ' A' ' 114' ' ' ARG . 19.3 tp10 -176.34 104.44 0.07 Allowed 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.602 179.96 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 114' ' ' ARG . . . . . 0.44 ' C ' ' H ' ' A' ' 116' ' ' LEU . 0.0 OUTLIER -53.09 -172.2 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.164 179.8 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 65.43 -0.55 1.15 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.975 0.416 . . . . 0.0 110.507 179.873 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.44 ' H ' ' C ' ' A' ' 114' ' ' ARG . 2.4 pp -67.27 -41.21 85.88 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.948 -179.689 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 117' ' ' ALA . . . . . 0.62 ' O ' HG23 ' A' ' 120' ' ' VAL . . . -69.13 -24.29 64.08 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 111.921 0.341 . . . . 0.0 111.921 -179.836 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 96.4 mt -55.13 -32.51 62.12 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 111.847 0.314 . . . . 0.0 111.847 -177.872 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 119' ' ' LEU . . . . . 0.531 ' C ' ' H ' ' A' ' 121' ' ' SER . 4.0 mm? -55.71 -16.95 4.88 Favored 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 119.961 -0.696 . . . . 0.0 109.465 -178.938 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 120' ' ' VAL . . . . . 0.639 ' O ' HG12 ' A' ' 120' ' ' VAL . 54.1 t -57.92 0.17 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.661 179.069 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 121' ' ' SER . . . . . 0.614 ' O ' ' HB3' ' A' ' 122' ' ' ALA . 8.2 t -69.85 -18.64 63.44 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.998 -0.547 . . . . 0.0 111.275 -179.604 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 122' ' ' ALA . . . . . 0.653 ' O ' ' O ' ' A' ' 123' ' ' HIS . . . 76.58 21.85 1.26 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.971 0.415 . . . . 0.0 110.083 -179.61 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 123' ' ' HIS . . . . . 0.653 ' O ' ' O ' ' A' ' 122' ' ' ALA . 0.1 OUTLIER 47.52 133.58 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 115.403 -0.817 . . . . 0.0 111.474 179.503 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 124' ' ' ASP . . . . . 0.765 ' H ' ' NH1' ' A' ' 10' ' ' ARG . 0.5 OUTLIER 32.45 26.82 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 115.653 -0.703 . . . . 0.0 111.848 179.286 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 125' ' ' ASP . . . . . 0.619 ' N ' ' O ' ' A' ' 123' ' ' HIS . 0.0 OUTLIER . . . . . 0 C--O 1.221 -0.434 0 CA-C-O 117.986 -1.007 . . . . 0.0 111.18 179.895 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 501' ' ' C2E . . . . . 0.918 ' O21' " H4'" ' A' ' 501' ' ' C2E . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 502' ' ' C2E . . . . . 0.576 ' C2 ' ' CD1' ' A' ' 77' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 6.6 mmt . . . . . 0 N--CA 1.489 1.522 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 7.9 t -119.14 116.77 27.03 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.412 -179.906 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -102.25 91.82 4.46 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 175.888 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.43 ' O ' ' OE1' ' A' ' 4' ' ' GLN . 0.1 OUTLIER -99.94 -34.4 10.13 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 120.832 -0.347 . . . . 0.0 111.718 -178.843 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 6.2 m80 -95.42 41.17 1.1 Allowed 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.507 -0.477 . . . . 0.0 111.022 -179.458 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' ASP . . . . . 0.558 ' O ' ' NE ' ' A' ' 8' ' ' ARG . 15.7 m-20 -57.45 120.13 7.71 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.059 -0.519 . . . . 0.0 109.782 179.218 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 18.0 tt0 -86.49 116.69 24.79 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.886 0.374 . . . . 0.0 110.593 -179.444 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.71 ' NH2' ' N11' ' A' ' 501' ' ' C2E . 0.0 OUTLIER -124.33 -2.48 8.04 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.26 -179.36 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.657 ' NH1' ' NH1' ' A' ' 13' ' ' ARG . 12.2 mtt180 -92.79 107.09 18.95 Favored 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 120.931 -0.308 . . . . 0.0 111.178 -178.967 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.572 ' C ' ' O ' ' A' ' 9' ' ' ARG . 0.0 OUTLIER -14.74 -57.81 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.016 179.943 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 11' ' ' PHE . . . . . 0.521 ' N ' ' O ' ' A' ' 9' ' ' ARG . 1.2 t80 -139.18 143.03 37.93 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.192 179.963 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -53.54 119.45 4.88 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.761 -179.771 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.657 ' NH1' ' NH1' ' A' ' 9' ' ' ARG . 0.0 OUTLIER -68.12 178.38 1.89 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.906 0.384 . . . . 0.0 110.173 179.706 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.523 ' N ' HD12 ' A' ' 14' ' ' ILE . 1.7 mp -98.54 113.49 33.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.093 179.776 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -95.14 119.76 34.2 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.307 0.575 . . . . 0.0 111.039 -179.755 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.56 ' CZ ' HD21 ' A' ' 101' ' ' LEU . 0.4 OUTLIER -149.66 149.26 30.36 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.109 -0.95 . . . . 0.0 108.442 178.631 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -95.54 149.28 21.6 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 120.116 -0.634 . . . . 0.0 111.335 -178.19 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.515 ' O ' HD12 ' A' ' 32' ' ' LEU . . . 179.06 177.96 0.49 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.466 -0.788 . . . . 0.0 109.891 179.802 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -96.22 133.94 39.93 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.622 179.95 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.58 ' O ' ' O ' ' A' ' 31' ' ' VAL . 20.5 p -134.03 154.34 51.21 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.992 0.425 . . . . 0.0 110.209 178.688 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 16.3 mt-10 -136.24 146.6 46.92 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 108.798 -0.816 . . . . 0.0 108.798 179.409 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.439 ' HA ' ' O ' ' A' ' 58' ' ' GLU . 39.8 mt -125.75 136.24 61.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 C-N-CA 120.037 -0.665 . . . . 0.0 111.329 -178.982 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.476 ' H ' HD12 ' A' ' 23' ' ' LEU . 0.1 OUTLIER -120.67 123.75 43.52 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.329 -0.85 . . . . 0.0 110.846 -179.497 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.628 ' O ' ' NE2' ' A' ' 24' ' ' GLN . 0.0 OUTLIER -131.49 102.2 5.84 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.513 -0.767 . . . . 0.0 109.606 178.811 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 78.97 -128.15 8.42 Favored Glycine 0 CA--C 1.525 0.664 0 N-CA-C 109.912 -1.275 . . . . 0.0 109.912 -178.711 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -99.14 12.32 36.47 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.865 0.364 . . . . 0.0 110.144 179.417 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.562 ' HB3' ' CZ2' ' A' ' 29' ' ' TRP . 18.6 mtt180 -113.41 135.43 53.87 Favored 'General case' 0 C--N 1.332 -0.177 0 N-CA-C 112.439 0.533 . . . . 0.0 112.439 -178.514 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.432 ' HG2' ' N ' ' A' ' 29' ' ' TRP . 7.0 ttt85 -128.86 148.25 50.88 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.184 179.282 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.562 ' CZ2' ' HB3' ' A' ' 27' ' ' ARG . 6.9 m-90 -146.65 155.82 42.73 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.628 -179.087 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 21.5 mt-10 -100.06 137.28 38.72 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 179.124 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.58 ' O ' ' O ' ' A' ' 20' ' ' SER . 17.3 m -146.88 157.69 10.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 121.31 0.576 . . . . 0.0 111.437 -179.361 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.515 HD12 ' O ' ' A' ' 18' ' ' ALA . 10.7 tp -96.55 128.88 43.89 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 178.576 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.445 ' N ' HD12 ' A' ' 32' ' ' LEU . 2.0 tt -93.37 124.99 37.74 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.232 0.539 . . . . 0.0 109.758 179.789 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 66.3 m-70 -91.24 -24.67 19.81 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.535 -0.757 . . . . 0.0 111.776 -178.434 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.59 ' CG ' ' HE ' ' A' ' 13' ' ' ARG . 2.8 p30 -174.59 163.61 3.58 Favored 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 119.579 -0.849 . . . . 0.0 111.635 177.516 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.523 HG22 ' H ' ' A' ' 37' ' ' SER . 5.0 p -147.17 168.8 4.78 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.123 0 CA-C-N 115.434 -0.803 . . . . 0.0 111.275 -178.903 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.523 ' H ' HG22 ' A' ' 36' ' ' VAL . 5.8 t -142.34 170.45 15.68 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 107.867 -1.16 . . . . 0.0 107.867 178.473 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.638 HD23 ' H ' ' A' ' 38' ' ' LEU . 0.1 OUTLIER -67.44 -2.58 6.56 Favored 'General case' 0 C--N 1.323 -0.566 0 C-N-CA 119.617 -0.833 . . . . 0.0 110.333 -179.687 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 39' ' ' HIS . . . . . 0.55 ' CD2' ' O ' ' A' ' 87' ' ' CYS . 1.6 t60 -156.67 37.97 0.32 Allowed 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 120.634 -0.426 . . . . 0.0 111.578 -179.627 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' GLY . . . . . 0.517 ' HA3' ' N3 ' ' A' ' 501' ' ' C2E . . . -178.73 158.4 22.74 Favored Glycine 0 CA--C 1.529 0.941 0 C-N-CA 120.505 -0.855 . . . . 0.0 111.526 179.795 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -149.82 150.17 13.97 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.362 0 CA-C-O 121.353 0.597 . . . . 0.0 111.565 -179.006 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.617 HD23 ' N ' ' A' ' 43' ' ' VAL . 1.5 tt -122.24 141.28 51.65 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 115.06 -0.973 . . . . 0.0 108.783 178.815 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.617 ' N ' HD23 ' A' ' 42' ' ' LEU . 15.9 m -145.34 175.03 2.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-O 121.202 0.525 . . . . 0.0 111.88 -179.242 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -99.56 144.85 17.25 Favored Glycine 0 CA--C 1.53 1.004 0 N-CA-C 109.68 -1.368 . . . . 0.0 109.68 178.423 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' GLN . . . . . 0.409 ' O ' ' OE1' ' A' ' 45' ' ' GLN . 2.5 tm0? -86.77 116.79 67.26 Favored Pre-proline 0 N--CA 1.465 0.307 0 CA-C-N 117.85 0.825 . . . . 0.0 111.939 -178.505 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 76.3 Cg_endo -87.1 151.65 8.22 Favored 'Trans proline' 0 C--N 1.309 -1.526 0 C-N-CA 121.567 1.511 . . . . 0.0 111.32 178.527 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -56.44 -13.74 2.5 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 112.658 0.614 . . . . 0.0 112.658 -178.76 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.53 ' O ' ' N ' ' A' ' 50' ' ' ASN . 81.9 m-20 -97.52 8.81 43.94 Favored 'General case' 0 N--CA 1.467 0.398 0 N-CA-C 112.324 0.49 . . . . 0.0 112.324 -178.432 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 49' ' ' TRP . . . . . 0.444 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 58.4 t-105 -60.55 67.67 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 112.119 0.415 . . . . 0.0 112.119 -179.358 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 50' ' ' ASN . . . . . 0.53 ' N ' ' O ' ' A' ' 48' ' ' ASP . 0.3 OUTLIER -93.53 78.64 4.35 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 178.042 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -142.81 162.99 27.38 Favored Glycine 0 CA--C 1.524 0.609 0 N-CA-C 111.538 -0.625 . . . . 0.0 111.538 -179.146 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' ASP . . . . . 0.516 ' OD2' ' NH1' ' A' ' 55' ' ' ARG . 15.8 t0 -95.95 122.05 59.38 Favored Pre-proline 0 CA--C 1.534 0.328 0 CA-C-N 115.608 -0.296 . . . . 0.0 110.423 180.0 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -60.82 -21.71 71.28 Favored 'Trans proline' 0 N--CA 1.495 1.611 0 C-N-CA 122.472 2.115 . . . . 0.0 112.183 -179.315 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 82.4 mt-30 -78.67 -24.06 45.34 Favored 'General case' 0 C--N 1.326 -0.448 0 C-N-CA 120.435 -0.506 . . . . 0.0 111.619 -179.19 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.542 ' O ' ' CE1' ' A' ' 57' ' ' PHE . 1.2 mpp_? -93.35 153.18 41.51 Favored Pre-proline 0 N--CA 1.464 0.239 0 C-N-CA 120.595 -0.442 . . . . 0.0 110.004 179.698 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_endo -65.4 160.73 41.21 Favored 'Trans proline' 0 C--N 1.308 -1.585 0 C-N-CA 122.737 2.291 . . . . 0.0 113.273 -178.899 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.542 ' CE1' ' O ' ' A' ' 55' ' ' ARG . 48.3 m-85 -130.87 155.24 47.07 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 114.891 -1.05 . . . . 0.0 109.117 179.633 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.439 ' O ' ' HA ' ' A' ' 22' ' ' ILE . 13.2 mm-40 -123.04 138.36 54.7 Favored 'General case' 0 N--CA 1.469 0.521 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 178.753 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 59' ' ' ALA . . . . . 0.449 ' HB2' HD13 ' A' ' 73' ' ' ILE . . . -119.63 137.4 53.9 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.231 0.539 . . . . 0.0 112.133 -178.296 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.891 ' HE ' ' HE ' ' A' ' 70' ' ' ARG . 40.0 mtt85 -124.17 128.2 48.88 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.27 -0.877 . . . . 0.0 108.788 177.729 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.405 HD23 ' N ' ' A' ' 61' ' ' LEU . 0.0 OUTLIER -113.33 146.46 39.4 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.021 0.439 . . . . 0.0 110.634 -179.25 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 62' ' ' TYR . . . . . 0.449 ' CD1' ' N ' ' A' ' 62' ' ' TYR . 24.0 m-85 -124.03 108.85 12.82 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.173 179.56 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.471 HD23 ' C ' ' A' ' 63' ' ' LEU . 1.8 tt -103.13 -86.5 0.44 Allowed 'General case' 0 C--N 1.333 -0.138 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 179.551 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.447 ' H ' ' HB ' ' A' ' 67' ' ' VAL . . . -74.3 174.06 50.36 Favored Glycine 0 CA--C 1.522 0.524 0 N-CA-C 109.147 -1.581 . . . . 0.0 109.147 178.367 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.569 HD12 ' N ' ' A' ' 65' ' ' LEU . 7.9 mp -71.31 -33.16 69.42 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 119.94 -0.704 . . . . 0.0 110.018 -179.788 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -102.52 9.55 39.44 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.902 179.912 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.469 ' O ' HG12 ' A' ' 67' ' ' VAL . 24.2 t -107.59 98.81 7.45 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.324 0 CA-C-O 121.204 0.526 . . . . 0.0 112.02 -178.742 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.501 HD12 ' N ' ' A' ' 69' ' ' ILE . 4.4 tp -113.86 117.77 32.35 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.268 -0.878 . . . . 0.0 108.709 178.55 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.501 ' N ' HD12 ' A' ' 68' ' ' LEU . 3.1 mt -112.15 144.28 20.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.935 0.398 . . . . 0.0 111.208 -179.04 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.891 ' HE ' ' HE ' ' A' ' 60' ' ' ARG . 1.0 OUTLIER -128.34 131.3 48.6 Favored 'General case' 0 C--O 1.237 0.421 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.677 179.277 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 2.7 mtp -140.07 149.24 42.88 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.055 179.633 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' GLU . . . . . 0.413 ' OE1' ' OE2' ' A' ' 58' ' ' GLU . 23.9 tt0 -105.01 132.4 51.29 Favored 'General case' 0 CA--C 1.516 -0.33 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 177.995 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.613 HD12 ' CB ' ' A' ' 85' ' ' PHE . 1.5 pt -141.88 158.48 20.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 C-N-CA 119.521 -0.872 . . . . 0.0 113.266 -177.465 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -118.91 149.16 42.05 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 114.966 -1.015 . . . . 0.0 109.205 178.35 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.518 HD12 ' CE1' ' A' ' 85' ' ' PHE . 16.2 tp -65.76 123.11 18.89 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.236 0.541 . . . . 0.0 110.199 -179.022 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -98.26 -44.62 6.5 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 115.261 -0.882 . . . . 0.0 111.257 178.423 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' TRP . . . . . 0.613 ' NE1' ' HA3' ' A' ' 84' ' ' GLY . 68.8 p-90 -166.05 169.58 14.43 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.412 -179.152 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -148.68 123.66 10.03 Favored 'General case' 0 N--CA 1.465 0.28 0 N-CA-C 109.446 -0.575 . . . . 0.0 109.446 178.222 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 37.6 ttt180 -152.37 133.54 14.3 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 119.762 -0.775 . . . . 0.0 112.809 -179.975 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 36.2 t0 57.24 47.15 17.47 Favored 'General case' 0 N--CA 1.465 0.276 0 N-CA-C 114.055 1.132 . . . . 0.0 114.055 176.845 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 82.9 -26.71 4.13 Favored Glycine 0 CA--C 1.521 0.452 0 C-N-CA 120.388 -0.911 . . . . 0.0 113.048 177.271 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 5.2 mt -89.66 161.6 16.03 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 117.689 0.744 . . . . 0.0 110.842 -179.057 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 40.5 mt -134.78 135.98 42.23 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.198 -179.25 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' GLY . . . . . 0.613 ' HA3' ' NE1' ' A' ' 77' ' ' TRP . . . -102.33 153.91 18.51 Favored Glycine 0 N--CA 1.453 -0.203 0 N-CA-C 109.741 -1.343 . . . . 0.0 109.741 178.529 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 85' ' ' PHE . . . . . 0.613 ' CB ' HD12 ' A' ' 73' ' ' ILE . 54.6 m-85 -145.64 139.63 26.75 Favored 'General case' 0 C--N 1.318 -0.777 0 C-N-CA 120.828 -0.349 . . . . 0.0 110.71 -179.725 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 20.4 pt-20 -103.86 130.08 51.4 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.084 -0.71 . . . . 0.0 109.084 179.764 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' CYS . . . . . 0.55 ' O ' ' CD2' ' A' ' 39' ' ' HIS . 5.2 t -77.33 124.36 27.75 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.006 0.431 . . . . 0.0 111.581 -178.556 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -101.2 -29.67 11.97 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.206 179.685 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 89' ' ' HIS . . . . . 0.532 ' C ' ' ND1' ' A' ' 89' ' ' HIS . 0.0 OUTLIER -161.71 141.72 10.36 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.063 0.459 . . . . 0.0 110.273 179.471 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.451 HG23 ' CG1' ' A' ' 95' ' ' ILE . 6.6 tt -145.57 141.1 22.25 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-N 115.755 -0.657 . . . . 0.0 109.971 -179.547 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 91' ' ' ASP . . . . . 0.516 ' CG ' ' H ' ' A' ' 94' ' ' SER . 0.1 OUTLIER -53.69 141.05 27.5 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 115.164 -0.925 . . . . 0.0 111.747 -178.444 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.445 ' N ' ' OD1' ' A' ' 91' ' ' ASP . 3.1 tp -54.27 -42.53 70.1 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.122 -0.945 . . . . 0.0 110.593 -179.558 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 11.5 t0 -70.15 -36.83 75.01 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 179.476 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 94' ' ' SER . . . . . 0.516 ' H ' ' CG ' ' A' ' 91' ' ' ASP . 3.6 m -64.53 -37.85 88.98 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.661 -0.699 . . . . 0.0 109.784 179.162 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 95' ' ' ILE . . . . . 0.451 ' CG1' HG23 ' A' ' 90' ' ' ILE . 50.1 mt -58.74 -37.82 68.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.056 179.529 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -70.56 -41.06 72.93 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.717 -179.167 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 97' ' ' HIS . . . . . 0.437 ' O ' ' HG2' ' A' ' 100' ' ' ARG . 64.1 m-70 -63.74 -44.07 94.59 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 119.932 -0.707 . . . . 0.0 109.764 179.786 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.449 HD21 ' CG1' ' A' ' 36' ' ' VAL . 0.4 OUTLIER -67.43 -36.38 81.12 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 120.681 -0.408 . . . . 0.0 109.941 179.093 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 43.9 mtt-85 -66.58 -41.68 88.15 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.454 -0.499 . . . . 0.0 110.553 179.298 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 100' ' ' ARG . . . . . 0.437 ' HG2' ' O ' ' A' ' 97' ' ' HIS . 15.1 ptt85 -69.24 -37.41 77.96 Favored 'General case' 0 CA--C 1.53 0.193 0 N-CA-C 109.853 -0.425 . . . . 0.0 109.853 177.449 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.56 HD21 ' CZ ' ' A' ' 16' ' ' PHE . 17.0 tp -58.72 -41.15 85.71 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 109.338 -0.615 . . . . 0.0 109.338 177.438 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 42.3 t -67.4 -36.75 77.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.922 -179.921 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 103' ' ' GLU . . . . . 0.481 ' O ' ' O ' ' A' ' 107' ' ' GLY . 22.6 tt0 -58.95 -40.77 85.69 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.031 -179.423 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 69.0 mt -65.36 -39.79 92.77 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 120.938 -0.305 . . . . 0.0 110.914 -179.677 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 105' ' ' ASN . . . . . 0.459 ' CG ' HG23 ' A' ' 14' ' ' ILE . 4.8 m-80 -67.44 -49.23 64.58 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 120.79 -0.364 . . . . 0.0 110.412 179.932 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -61.05 -39.64 90.6 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.296 179.906 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 107' ' ' GLY . . . . . 0.481 ' O ' ' O ' ' A' ' 103' ' ' GLU . . . 142.24 -142.46 11.75 Favored Glycine 0 CA--C 1.526 0.753 0 N-CA-C 110.893 -0.883 . . . . 0.0 110.893 179.878 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -173.66 97.89 0.11 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.915 0.388 . . . . 0.0 110.526 179.888 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 15.7 mm-40 47.97 89.14 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.5 -179.876 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -142.25 -40.77 0.35 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.224 -179.911 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 111' ' ' LEU . . . . . 0.652 ' N ' HD22 ' A' ' 111' ' ' LEU . 3.3 mm? 50.86 74.71 0.22 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.57 -179.863 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.531 ' O ' ' N ' ' A' ' 114' ' ' ARG . 24.2 tp -84.26 101.73 12.12 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.295 179.903 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -58.0 78.27 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.713 -179.836 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 114' ' ' ARG . . . . . 0.531 ' N ' ' O ' ' A' ' 112' ' ' LEU . 36.4 ttp180 -173.45 -77.33 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.072 179.876 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 1.3 pt-20 -85.46 10.13 13.78 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.665 -0.494 . . . . 0.0 109.665 179.35 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 6.4 tp -67.2 -38.24 85.0 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.357 -179.746 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 117' ' ' ALA . . . . . 0.593 ' O ' HG23 ' A' ' 120' ' ' VAL . . . -69.82 -24.25 63.44 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.647 179.528 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.423 HD23 ' HA ' ' A' ' 118' ' ' LEU . 47.7 mt -54.86 -36.43 65.07 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 120.173 -0.611 . . . . 0.0 110.743 -177.941 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 119' ' ' LEU . . . . . 0.583 HD22 ' N ' ' A' ' 119' ' ' LEU . 4.0 mm? -55.85 -15.44 3.29 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.123 -0.631 . . . . 0.0 110.018 -178.618 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 120' ' ' VAL . . . . . 0.618 ' O ' HG12 ' A' ' 120' ' ' VAL . 54.7 t -56.93 0.11 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 120.984 0.421 . . . . 0.0 110.338 -179.748 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 121' ' ' SER . . . . . 0.576 ' H ' ' C ' ' A' ' 119' ' ' LEU . 28.2 t -74.73 -24.57 58.74 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 109.544 -0.539 . . . . 0.0 109.544 178.83 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -163.1 157.18 20.36 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.067 179.652 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 123' ' ' HIS . . . . . 0.61 ' C ' ' HD1' ' A' ' 123' ' ' HIS . 0.1 OUTLIER 176.35 178.34 0.22 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.48 -179.901 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 59.2 m-20 -123.15 -10.08 8.13 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.356 179.743 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 1.5 t70 . . . . . 0 C--O 1.22 -0.452 0 CA-C-O 118.032 -0.985 . . . . 0.0 110.527 -179.863 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 501' ' ' C2E . . . . . 0.923 ' O21' " H4'" ' A' ' 501' ' ' C2E . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 502' ' ' C2E . . . . . 0.521 ' C2 ' ' CD1' ' A' ' 77' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.649 ' O ' ' CB ' ' A' ' 2' ' ' SER . 8.3 mmm . . . . . 0 N--CA 1.489 1.512 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.649 ' CB ' ' O ' ' A' ' 1' ' ' MET . 41.3 t 120.61 -29.8 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.541 0 O-C-N 123.942 0.776 . . . . 0.0 110.182 -179.857 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -99.28 -7.54 26.24 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.977 179.646 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.774 ' NE2' ' H ' ' A' ' 4' ' ' GLN . 0.0 OUTLIER -112.66 -0.83 14.97 Favored 'General case' 0 N--CA 1.464 0.248 0 C-N-CA 120.923 -0.311 . . . . 0.0 111.464 -179.938 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 5' ' ' HIS . . . . . 0.662 ' O ' ' NH1' ' A' ' 8' ' ' ARG . 0.5 OUTLIER 97.5 -96.92 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.456 0 O-C-N 123.533 0.521 . . . . 0.0 110.888 179.803 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 6' ' ' ASP . . . . . 0.401 ' O ' ' O ' ' A' ' 5' ' ' HIS . 10.1 m-20 60.09 152.52 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.784 -0.366 . . . . 0.0 110.281 -179.701 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.48 ' HA ' ' C61' ' A' ' 502' ' ' C2E . 3.4 tt0 -93.3 129.42 39.39 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-O 121.006 0.432 . . . . 0.0 110.719 -179.575 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.738 ' H ' ' C61' ' A' ' 502' ' ' C2E . 0.0 OUTLIER -126.2 -13.87 6.08 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.739 -178.618 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.713 ' O ' ' N ' ' A' ' 11' ' ' PHE . 3.2 ptt180 -108.12 79.57 1.28 Allowed 'General case' 0 N--CA 1.471 0.602 0 CA-C-O 121.108 0.48 . . . . 0.0 110.047 179.945 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.464 ' C ' ' O ' ' A' ' 9' ' ' ARG . 0.0 OUTLIER 20.24 -73.49 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.567 0 CA-C-N 114.8 -1.091 . . . . 0.0 112.062 -179.668 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 11' ' ' PHE . . . . . 0.713 ' N ' ' O ' ' A' ' 9' ' ' ARG . 0.7 OUTLIER -145.53 168.18 21.23 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-O 120.724 0.297 . . . . 0.0 110.397 -179.649 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 12' ' ' HIS . . . . . 0.782 ' CE1' HD13 ' A' ' 118' ' ' LEU . 0.0 OUTLIER -49.81 168.44 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.534 -179.76 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.662 HH12 HD12 ' A' ' 42' ' ' LEU . 8.4 mtm180 -119.03 165.19 14.43 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.375 180.0 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 7.2 mm -63.92 91.45 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 179.411 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -95.08 120.89 36.06 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.475 0.655 . . . . 0.0 111.992 -178.926 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 23.2 p90 -149.3 158.09 43.88 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 114.873 -1.058 . . . . 0.0 108.448 177.567 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -95.55 146.38 24.5 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 120.291 -0.564 . . . . 0.0 110.314 -179.591 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . 179.94 176.77 0.69 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.075 179.788 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -96.28 133.94 40.02 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.104 -179.686 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.47 ' O ' ' O ' ' A' ' 31' ' ' VAL . 11.4 p -132.94 150.32 52.17 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.081 -0.509 . . . . 0.0 109.941 178.338 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.559 ' OE1' ' NH2' ' A' ' 28' ' ' ARG . 8.3 mm-40 -132.51 138.2 47.45 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 179.59 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 43.0 mt -119.32 136.12 57.52 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 121.353 0.597 . . . . 0.0 110.987 -179.091 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.595 ' H ' HD12 ' A' ' 23' ' ' LEU . 0.1 OUTLIER -123.73 123.2 39.98 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.33 -0.85 . . . . 0.0 111.107 -179.135 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.582 HE21 ' C ' ' A' ' 24' ' ' GLN . 0.0 OUTLIER -128.65 101.57 6.2 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.328 -0.851 . . . . 0.0 109.687 178.918 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 80.99 -125.68 6.99 Favored Glycine 0 CA--C 1.525 0.662 0 N-CA-C 110.103 -1.199 . . . . 0.0 110.103 -178.664 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -101.17 11.63 39.07 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.86 0.362 . . . . 0.0 110.06 179.404 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.529 ' HB3' ' CZ2' ' A' ' 29' ' ' TRP . 36.1 mtt85 -113.5 134.65 54.56 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 112.652 0.612 . . . . 0.0 112.652 -178.146 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.559 ' NH2' ' OE1' ' A' ' 21' ' ' GLU . 70.0 ttt-85 -128.38 149.33 50.58 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.443 179.325 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.534 ' NE1' ' O ' ' A' ' 48' ' ' ASP . 7.8 m-90 -146.5 156.25 43.13 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.386 -0.825 . . . . 0.0 110.496 -179.382 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.531 ' H ' ' CD ' ' A' ' 30' ' ' GLU . 3.7 mp0 -100.77 138.85 37.27 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.975 -0.557 . . . . 0.0 109.621 179.35 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.47 ' O ' ' O ' ' A' ' 20' ' ' SER . 9.1 m -147.28 156.33 10.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-O 121.287 0.565 . . . . 0.0 110.962 -179.434 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 11.4 tp -97.04 129.92 44.42 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 108.123 -1.065 . . . . 0.0 108.123 178.631 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -92.08 124.09 35.92 Favored 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 120.29 -0.564 . . . . 0.0 110.072 -179.827 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 77.0 m-70 -90.67 -30.1 17.33 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.339 -0.846 . . . . 0.0 111.474 -178.803 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.401 ' OD1' ' C ' ' A' ' 35' ' ' ASP . 2.1 p30 -170.05 160.57 8.24 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 119.538 -0.865 . . . . 0.0 110.868 177.26 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.537 HG22 ' H ' ' A' ' 37' ' ' SER . 3.4 p -144.75 169.17 8.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.055 -178.825 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.537 ' H ' HG22 ' A' ' 36' ' ' VAL . 13.1 t -140.89 168.34 20.03 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 108.497 -0.927 . . . . 0.0 108.497 179.083 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.426 ' N ' HD12 ' A' ' 38' ' ' LEU . 0.3 OUTLIER -66.99 -2.02 4.82 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 119.92 -0.712 . . . . 0.0 110.687 -179.572 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 39' ' ' HIS . . . . . 0.421 ' N ' HD12 ' A' ' 38' ' ' LEU . 0.1 OUTLIER -158.71 35.91 0.22 Allowed 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 120.695 -0.402 . . . . 0.0 111.185 179.889 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -174.48 157.38 24.87 Favored Glycine 0 CA--C 1.526 0.78 0 N-CA-C 110.947 -0.861 . . . . 0.0 110.947 179.681 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -146.39 148.18 17.29 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.267 0 CA-C-O 121.484 0.659 . . . . 0.0 111.661 -179.239 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.662 HD12 HH12 ' A' ' 13' ' ' ARG . 0.8 OUTLIER -122.15 134.79 54.74 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 114.936 -1.029 . . . . 0.0 108.896 178.776 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.409 ' N ' HD23 ' A' ' 42' ' ' LEU . 22.0 m -139.37 174.95 8.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-O 121.227 0.537 . . . . 0.0 111.837 -179.311 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -96.77 143.33 16.67 Favored Glycine 0 CA--C 1.528 0.881 0 N-CA-C 109.331 -1.508 . . . . 0.0 109.331 178.071 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' GLN . . . . . 0.44 ' O ' ' OE1' ' A' ' 45' ' ' GLN . 2.1 tm0? -85.52 115.93 63.51 Favored Pre-proline 0 N--CA 1.465 0.275 0 CA-C-N 118.041 0.921 . . . . 0.0 111.678 -178.715 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 97.8 Cg_endo -86.27 161.5 9.86 Favored 'Trans proline' 0 C--N 1.308 -1.572 0 C-N-CA 121.543 1.495 . . . . 0.0 111.241 178.732 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 76.2 mt-30 -65.41 -40.21 93.1 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 112.591 0.589 . . . . 0.0 112.591 -178.789 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.534 ' O ' ' NE1' ' A' ' 29' ' ' TRP . 1.8 m-20 -71.64 8.4 1.14 Allowed 'General case' 0 N--CA 1.465 0.286 0 N-CA-C 112.013 0.375 . . . . 0.0 112.013 -178.709 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 49' ' ' TRP . . . . . 0.455 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 61.7 t-105 -60.56 67.84 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 111.832 0.308 . . . . 0.0 111.832 -179.426 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' ASN . . . . . 0.547 HD22 ' C ' ' A' ' 50' ' ' ASN . 0.3 OUTLIER -93.46 78.89 4.37 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 120.155 -0.618 . . . . 0.0 109.816 178.698 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -141.24 160.3 26.79 Favored Glycine 0 CA--C 1.525 0.706 0 N-CA-C 111.223 -0.751 . . . . 0.0 111.223 -179.656 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 59.2 t0 -97.32 108.03 42.12 Favored Pre-proline 0 CA--C 1.531 0.242 0 N-CA-C 110.627 -0.138 . . . . 0.0 110.627 -179.842 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -47.52 -22.54 2.87 Favored 'Trans proline' 0 C--N 1.311 -1.439 0 C-N-CA 122.167 1.911 . . . . 0.0 112.341 179.973 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 25.1 mt-30 -74.85 -23.99 58.51 Favored 'General case' 0 C--N 1.324 -0.512 0 C-N-CA 120.51 -0.476 . . . . 0.0 111.233 -179.237 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.546 ' O ' ' CE1' ' A' ' 57' ' ' PHE . 0.0 OUTLIER -96.77 150.09 36.53 Favored Pre-proline 0 C--N 1.331 -0.237 0 N-CA-C 109.863 -0.421 . . . . 0.0 109.863 -179.948 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 25.5 Cg_endo -61.62 160.78 26.92 Favored 'Trans proline' 0 N--CA 1.495 1.615 0 C-N-CA 122.824 2.349 . . . . 0.0 113.298 -178.487 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.546 ' CE1' ' O ' ' A' ' 55' ' ' ARG . 52.5 m-85 -130.98 154.69 47.89 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.012 -0.994 . . . . 0.0 109.313 179.58 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -122.16 136.39 54.9 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 109.036 -0.728 . . . . 0.0 109.036 178.372 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' ALA . . . . . 0.627 ' HB2' HD13 ' A' ' 73' ' ' ILE . . . -118.1 138.27 52.38 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.225 0.536 . . . . 0.0 112.19 -178.099 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.477 ' HG3' HD11 ' A' ' 23' ' ' LEU . 20.0 mtm-85 -124.09 127.67 48.16 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 177.813 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 12.8 mt -109.76 151.02 27.48 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.002 0.43 . . . . 0.0 111.215 -178.741 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 38.2 m-85 -132.29 108.84 9.48 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.428 179.593 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.442 HD23 ' C ' ' A' ' 63' ' ' LEU . 1.1 tt -102.84 -84.59 0.46 Allowed 'General case' 0 C--N 1.332 -0.155 0 N-CA-C 108.941 -0.763 . . . . 0.0 108.941 179.089 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.451 ' H ' ' HB ' ' A' ' 67' ' ' VAL . . . -76.65 179.35 49.27 Favored Glycine 0 CA--C 1.523 0.548 0 N-CA-C 108.819 -1.712 . . . . 0.0 108.819 178.202 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.623 HD12 ' N ' ' A' ' 65' ' ' LEU . 7.5 mp -74.07 -32.3 63.22 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 119.708 -0.797 . . . . 0.0 110.251 -179.589 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.401 ' O ' ' OD1' ' A' ' 66' ' ' ASP . 51.9 t0 -102.35 9.4 39.85 Favored 'General case' 0 C--N 1.332 -0.154 0 C-N-CA 122.735 0.414 . . . . 0.0 111.166 -179.865 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.572 ' O ' HG12 ' A' ' 67' ' ' VAL . 8.6 t -104.36 94.36 3.12 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.238 0 CA-C-O 121.487 0.66 . . . . 0.0 111.533 -179.172 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 6.6 tp -109.74 117.44 33.9 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 114.863 -1.062 . . . . 0.0 108.214 178.542 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.49 HG23 ' CB ' ' A' ' 94' ' ' SER . 7.6 mt -115.79 143.79 24.92 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.373 0 CA-C-O 121.047 0.451 . . . . 0.0 111.228 -178.632 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.444 ' C ' ' HG2' ' A' ' 71' ' ' MET . 0.0 OUTLIER -128.2 130.84 48.63 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.056 179.197 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 71' ' ' MET . . . . . 0.776 ' SD ' HD12 ' A' ' 90' ' ' ILE . 0.0 OUTLIER -139.91 148.04 41.44 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.625 -0.716 . . . . 0.0 109.611 179.511 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -100.43 132.78 45.62 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 107.081 -1.452 . . . . 0.0 107.081 177.731 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.627 HD13 ' HB2' ' A' ' 59' ' ' ALA . 7.7 pt -141.69 157.44 21.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 C-N-CA 119.407 -0.917 . . . . 0.0 113.458 -176.813 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -122.78 155.97 35.45 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 114.925 -1.034 . . . . 0.0 109.877 178.736 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.512 HD13 ' N ' ' A' ' 76' ' ' ALA . 0.2 OUTLIER -65.1 119.42 10.78 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.521 -0.308 . . . . 0.0 110.632 -179.533 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 76' ' ' ALA . . . . . 0.512 ' N ' HD13 ' A' ' 75' ' ' LEU . . . -97.1 -40.27 8.91 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 177.344 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 77' ' ' TRP . . . . . 0.623 ' NE1' ' HA3' ' A' ' 84' ' ' GLY . 69.2 p-90 -171.68 169.78 5.85 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.143 179.674 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -150.53 123.52 8.75 Favored 'General case' 0 N--CA 1.463 0.184 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 178.239 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 24.4 ttt85 -152.44 133.79 14.42 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 119.934 -0.706 . . . . 0.0 112.75 -179.948 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' ASP . . . . . 0.424 ' O ' ' OD1' ' A' ' 80' ' ' ASP . 25.7 t0 57.07 47.46 17.36 Favored 'General case' 0 N--CA 1.463 0.196 0 N-CA-C 113.764 1.024 . . . . 0.0 113.764 176.747 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 83.17 -27.95 3.86 Favored Glycine 0 CA--C 1.522 0.53 0 C-N-CA 120.241 -0.981 . . . . 0.0 113.284 177.073 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 4.3 mt -89.61 159.24 17.26 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 117.83 0.815 . . . . 0.0 110.436 -178.88 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 39.8 mt -131.48 135.98 47.54 Favored 'General case' 0 CA--C 1.518 -0.288 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.541 -178.811 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' GLY . . . . . 0.623 ' HA3' ' NE1' ' A' ' 77' ' ' TRP . . . -100.11 153.08 19.38 Favored Glycine 0 N--CA 1.453 -0.233 0 N-CA-C 109.748 -1.341 . . . . 0.0 109.748 178.471 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 85' ' ' PHE . . . . . 0.451 ' CE1' HD22 ' A' ' 75' ' ' LEU . 33.6 m-85 -145.7 135.72 23.67 Favored 'General case' 0 C--N 1.318 -0.768 0 C-N-CA 120.734 -0.386 . . . . 0.0 110.612 -179.575 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.408 ' H ' ' HG2' ' A' ' 86' ' ' GLU . 10.3 pt-20 -104.18 127.31 51.77 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.06 -0.719 . . . . 0.0 109.06 179.363 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -74.27 125.35 28.24 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.173 0.511 . . . . 0.0 111.542 -178.638 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -102.5 -29.82 11.36 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.032 179.817 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 89' ' ' HIS . . . . . 0.636 ' ND1' ' N ' ' A' ' 90' ' ' ILE . 0.0 OUTLIER -158.38 140.23 13.81 Favored 'General case' 0 C--O 1.226 -0.163 0 N-CA-C 109.891 -0.411 . . . . 0.0 109.891 178.735 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.776 HD12 ' SD ' ' A' ' 71' ' ' MET . 7.0 tt -146.15 141.08 21.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-O 121.352 0.596 . . . . 0.0 109.988 -179.444 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 91' ' ' ASP . . . . . 0.494 ' CB ' ' OG ' ' A' ' 94' ' ' SER . 0.1 OUTLIER -53.75 142.03 24.84 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.287 -0.87 . . . . 0.0 112.05 -178.381 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 6.0 tp -54.43 -42.36 70.45 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.178 -0.919 . . . . 0.0 109.968 -179.993 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' ASP . . . . . 0.425 ' OD2' ' OD2' ' A' ' 91' ' ' ASP . 3.5 p30 -68.36 -42.49 79.13 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.145 -0.48 . . . . 0.0 109.97 179.636 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 94' ' ' SER . . . . . 0.494 ' OG ' ' CB ' ' A' ' 91' ' ' ASP . 1.9 p -62.31 -36.24 81.55 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.037 -0.529 . . . . 0.0 109.998 179.373 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 95' ' ' ILE . . . . . 0.487 ' CG1' HG23 ' A' ' 90' ' ' ILE . 36.7 mt -58.86 -37.97 70.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.157 179.664 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -70.24 -39.71 74.89 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.257 -0.577 . . . . 0.0 110.914 -178.758 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 60.4 m-70 -61.84 -35.22 77.62 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 119.515 -0.874 . . . . 0.0 109.108 179.753 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.421 HD23 ' HA ' ' A' ' 98' ' ' LEU . 6.7 mt -67.44 -36.08 80.5 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 177.978 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 18.6 mtt-85 -66.55 -41.95 87.89 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 178.089 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 40.1 mtt85 -55.85 -37.87 69.33 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.022 178.194 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 4.1 mp -69.51 -44.6 70.72 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.542 -179.665 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 102' ' ' VAL . . . . . 0.42 ' CG1' ' N ' ' A' ' 103' ' ' GLU . 0.4 OUTLIER -61.39 -43.55 96.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.936 0.398 . . . . 0.0 110.086 179.968 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 103' ' ' GLU . . . . . 0.42 ' N ' ' CG1' ' A' ' 102' ' ' VAL . 1.8 tm-20 -65.78 -44.61 85.27 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.335 -179.769 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 27.0 mt -73.68 -22.62 59.88 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.413 -178.967 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -57.36 -36.86 71.75 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 120.761 -0.376 . . . . 0.0 110.511 -179.612 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.546 ' N ' HD12 ' A' ' 106' ' ' LEU . 7.0 mp -74.54 -25.18 59.16 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.682 -179.919 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 98.03 -83.82 0.69 Allowed Glycine 0 CA--C 1.525 0.694 0 N-CA-C 111.165 -0.774 . . . . 0.0 111.165 179.761 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -139.67 -76.64 0.34 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.557 0.217 . . . . 0.0 110.426 -179.796 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 173.24 18.78 0.0 OUTLIER 'General case' 0 CA--C 1.529 0.156 0 CA-C-N 116.528 -0.306 . . . . 0.0 110.493 179.92 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 82.0 mt-10 -111.59 -0.72 16.02 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.69 -179.972 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 111' ' ' LEU . . . . . 0.487 HD22 ' HA ' ' A' ' 111' ' ' LEU . 0.2 OUTLIER -144.63 108.31 4.67 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.346 179.983 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.599 ' N ' HD22 ' A' ' 112' ' ' LEU . 2.8 mm? -76.94 151.01 35.9 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.358 -179.699 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 23.3 tt0 -90.3 -70.06 0.69 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.834 -179.707 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 74.9 mtt180 -37.68 141.16 0.2 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.139 -179.823 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 115' ' ' GLU . . . . . 0.613 ' H ' HD12 ' A' ' 118' ' ' LEU . 34.4 tt0 -117.53 151.39 37.22 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.035 -0.53 . . . . 0.0 109.891 179.334 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.528 ' O ' HD13 ' A' ' 116' ' ' LEU . 0.1 OUTLIER -67.52 -34.69 77.63 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.102 -179.225 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 117' ' ' ALA . . . . . 0.614 ' O ' HG23 ' A' ' 120' ' ' VAL . . . -68.25 -24.6 64.91 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-O 121.404 0.621 . . . . 0.0 110.216 -179.406 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.782 HD13 ' CE1' ' A' ' 12' ' ' HIS . 28.8 mt -64.17 -30.87 71.91 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 115.175 -0.92 . . . . 0.0 109.751 178.265 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 119' ' ' LEU . . . . . 0.486 ' C ' ' H ' ' A' ' 121' ' ' SER . 0.3 OUTLIER -55.37 -10.23 0.58 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.351 -0.841 . . . . 0.0 109.255 -178.837 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 120' ' ' VAL . . . . . 0.614 HG23 ' O ' ' A' ' 117' ' ' ALA . 29.1 t -59.28 -1.45 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.327 176.253 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 121' ' ' SER . . . . . 0.486 ' H ' ' C ' ' A' ' 119' ' ' LEU . 0.3 OUTLIER -92.47 -16.73 25.45 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 111.907 0.336 . . . . 0.0 111.907 -178.915 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -97.64 -15.23 20.52 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.064 0.459 . . . . 0.0 110.832 -179.73 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 123' ' ' HIS . . . . . 0.531 ' CG ' ' N ' ' A' ' 124' ' ' ASP . 0.0 OUTLIER 179.75 -177.74 0.37 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.671 -0.695 . . . . 0.0 109.652 -178.618 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 124' ' ' ASP . . . . . 0.531 ' N ' ' CG ' ' A' ' 123' ' ' HIS . 17.3 t0 -175.2 -47.81 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 179.034 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 . . . . . 0 C--N 1.323 -0.564 0 CA-C-O 117.992 -1.004 . . . . 0.0 110.496 179.98 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 501' ' ' C2E . . . . . 0.667 ' C21' ' NH2' ' A' ' 8' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 502' ' ' C2E . . . . . 0.738 ' C61' ' H ' ' A' ' 8' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.496 ' O ' ' O ' ' A' ' 2' ' ' SER . 2.9 ttm . . . . . 0 N--CA 1.489 1.5 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.496 ' O ' ' O ' ' A' ' 1' ' ' MET . 6.2 m 39.62 99.69 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.927 179.732 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 3' ' ' ASP . . . . . 0.594 ' OD1' ' NE2' ' A' ' 4' ' ' GLN . 0.0 OUTLIER -99.05 14.1 30.47 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.242 179.074 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.594 ' NE2' ' OD1' ' A' ' 3' ' ' ASP . 23.9 mp0 -114.22 12.1 17.64 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.087 177.883 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 5' ' ' HIS . . . . . 0.656 ' C ' ' CD2' ' A' ' 5' ' ' HIS . 0.0 OUTLIER 76.05 11.07 3.04 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.728 179.567 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 6' ' ' ASP . . . . . 0.581 ' OD1' ' N ' ' A' ' 6' ' ' ASP . 0.3 OUTLIER -29.81 149.8 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.329 179.942 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.475 ' HB3' ' HB2' ' A' ' 122' ' ' ALA . 1.0 OUTLIER -84.12 133.48 34.62 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.199 0.523 . . . . 0.0 110.71 -179.802 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.663 ' H ' ' C61' ' A' ' 502' ' ' C2E . 0.0 OUTLIER -124.96 -8.8 7.19 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.443 -0.799 . . . . 0.0 111.307 -179.111 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.693 HH11 ' NE ' ' A' ' 13' ' ' ARG . 4.6 mtt180 -96.03 30.87 2.28 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-O 120.971 0.415 . . . . 0.0 110.594 -179.372 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER 59.57 -62.02 0.05 Allowed 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.963 179.63 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' PHE . . . . . 0.624 ' N ' ' O ' ' A' ' 9' ' ' ARG . 0.2 OUTLIER -140.4 169.51 17.53 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 110.075 -0.343 . . . . 0.0 110.075 179.909 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 80.2 m-70 -61.92 145.06 53.98 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.883 -179.758 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.693 ' NE ' HH11 ' A' ' 9' ' ' ARG . 0.0 OUTLIER -93.72 149.07 21.54 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.151 179.759 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.66 ' N ' HD12 ' A' ' 14' ' ' ILE . 1.7 mp -59.68 89.86 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 179.019 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.41 ' N ' ' O ' ' A' ' 13' ' ' ARG . . . -94.42 120.41 34.61 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.403 0.621 . . . . 0.0 111.676 -178.963 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 1.6 p90 -149.67 158.09 43.85 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 114.768 -1.105 . . . . 0.0 108.212 177.85 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 31.4 m-20 -95.37 146.42 24.4 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 120.14 -0.624 . . . . 0.0 110.432 -179.22 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -179.27 176.83 0.82 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.967 -0.56 . . . . 0.0 109.742 179.652 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -96.66 134.43 39.91 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.195 -179.666 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.595 ' O ' ' O ' ' A' ' 31' ' ' VAL . 16.9 p -133.43 153.98 51.16 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.01 0.434 . . . . 0.0 109.875 178.445 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.4 mt-10 -134.61 140.43 46.06 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 179.658 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 2.7 mm -118.93 135.66 58.63 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-O 121.489 0.661 . . . . 0.0 110.404 -179.639 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -127.23 123.06 35.68 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.04 -0.982 . . . . 0.0 110.482 -179.254 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.789 HE21 ' C ' ' A' ' 24' ' ' GLN . 0.0 OUTLIER -128.39 102.22 6.56 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.444 -0.798 . . . . 0.0 109.485 178.935 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 80.23 -124.22 6.39 Favored Glycine 0 CA--C 1.524 0.629 0 N-CA-C 110.204 -1.158 . . . . 0.0 110.204 -178.797 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -102.38 11.62 37.76 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.78 0.324 . . . . 0.0 110.288 179.915 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.591 ' HB3' ' CZ2' ' A' ' 29' ' ' TRP . 46.5 mtt180 -114.34 136.53 52.87 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 112.844 0.683 . . . . 0.0 112.844 -177.962 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.414 ' HG2' ' N ' ' A' ' 29' ' ' TRP . 27.7 ttt180 -129.05 149.55 50.82 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.104 0.478 . . . . 0.0 110.272 179.344 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.591 ' CZ2' ' HB3' ' A' ' 27' ' ' ARG . 5.6 m-90 -150.26 125.66 10.15 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.682 -178.859 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -75.06 143.29 43.53 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 119.853 -0.739 . . . . 0.0 109.692 -179.0 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.595 ' O ' ' O ' ' A' ' 20' ' ' SER . 6.1 m -148.4 158.94 7.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-O 121.262 0.553 . . . . 0.0 111.176 -179.019 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 1.11 ' H ' HD23 ' A' ' 32' ' ' LEU . 1.5 pt? -99.05 130.35 45.37 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 108.816 -0.809 . . . . 0.0 108.816 178.729 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -94.24 124.94 38.58 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.311 0.577 . . . . 0.0 109.544 -179.939 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 71.1 m-70 -89.49 -26.18 21.05 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.379 -0.828 . . . . 0.0 111.882 -178.241 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -174.03 162.98 3.92 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 119.739 -0.784 . . . . 0.0 111.326 177.842 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.51 HG22 ' H ' ' A' ' 37' ' ' SER . 4.8 p -146.71 168.81 5.49 Favored 'Isoleucine or valine' 0 C--O 1.231 0.104 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.041 -179.097 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.51 ' H ' HG22 ' A' ' 36' ' ' VAL . 67.5 p -142.28 168.08 20.58 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 107.321 -1.363 . . . . 0.0 107.321 177.851 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -62.41 -0.81 0.63 Allowed 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 119.33 -0.948 . . . . 0.0 110.697 -179.239 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 39' ' ' HIS . . . . . 0.434 ' H ' ' C ' ' A' ' 37' ' ' SER . 0.0 OUTLIER -164.92 45.62 0.09 Allowed 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 120.628 -0.429 . . . . 0.0 111.425 179.978 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -179.17 150.98 9.81 Favored Glycine 0 CA--C 1.529 0.919 0 N-CA-C 110.812 -0.915 . . . . 0.0 110.812 179.75 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -146.36 148.14 17.35 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.267 0 CA-C-O 121.445 0.64 . . . . 0.0 111.903 -179.175 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.444 HD12 ' O6 ' ' A' ' 501' ' ' C2E . 0.9 OUTLIER -122.52 126.62 48.19 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 114.921 -1.036 . . . . 0.0 108.963 179.059 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 30.5 m -131.3 174.96 12.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 121.392 0.615 . . . . 0.0 111.742 -179.379 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -98.28 145.61 17.83 Favored Glycine 0 CA--C 1.528 0.883 0 N-CA-C 109.638 -1.385 . . . . 0.0 109.638 178.393 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 6.9 tt0 -87.41 113.98 56.58 Favored Pre-proline 0 N--CA 1.466 0.346 0 CA-C-N 117.886 0.843 . . . . 0.0 111.992 -178.486 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -84.58 161.37 12.57 Favored 'Trans proline' 0 C--N 1.308 -1.575 0 C-N-CA 121.663 1.575 . . . . 0.0 111.359 178.474 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 32.2 tt0 -65.43 -40.06 92.87 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 112.279 0.474 . . . . 0.0 112.279 -178.894 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.524 ' O ' ' N ' ' A' ' 50' ' ' ASN . 57.7 t0 -73.18 8.39 1.68 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.528 -0.306 . . . . 0.0 111.62 -178.755 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 49' ' ' TRP . . . . . 0.465 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 62.6 t-105 -60.93 68.2 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.564 -0.289 . . . . 0.0 111.567 -179.667 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' ASN . . . . . 0.524 ' N ' ' O ' ' A' ' 48' ' ' ASP . 14.5 t30 -93.69 78.69 4.26 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 178.468 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -138.58 161.43 25.75 Favored Glycine 0 CA--C 1.524 0.602 0 C-N-CA 120.875 -0.679 . . . . 0.0 111.721 -179.429 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -96.14 120.39 62.81 Favored Pre-proline 0 CA--C 1.535 0.385 0 N-CA-C 109.836 -0.431 . . . . 0.0 109.836 179.774 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_endo -63.86 -22.29 68.99 Favored 'Trans proline' 0 N--CA 1.492 1.44 0 C-N-CA 122.172 1.914 . . . . 0.0 112.48 -179.368 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 42.5 mm-40 -75.95 -23.84 55.43 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 120.353 -0.539 . . . . 0.0 111.12 -179.492 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.518 ' O ' ' CE1' ' A' ' 57' ' ' PHE . 80.6 mtt180 -96.87 146.79 31.91 Favored Pre-proline 0 CA--C 1.532 0.258 0 C-N-CA 120.748 -0.381 . . . . 0.0 110.396 179.956 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_exo -57.87 160.97 13.77 Favored 'Trans proline' 0 N--CA 1.496 1.653 0 C-N-CA 122.665 2.244 . . . . 0.0 113.177 -179.332 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.518 ' CE1' ' O ' ' A' ' 55' ' ' ARG . 33.9 m-85 -129.62 154.88 46.66 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 114.973 -1.012 . . . . 0.0 108.766 179.049 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 28.3 mt-10 -122.25 137.93 54.67 Favored 'General case' 0 N--CA 1.465 0.279 0 N-CA-C 109.319 -0.623 . . . . 0.0 109.319 178.54 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -121.41 139.47 53.41 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.033 0.444 . . . . 0.0 112.167 -178.026 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.503 HH11 ' CG ' ' A' ' 60' ' ' ARG . 1.9 mtt-85 -123.12 127.31 48.52 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 177.03 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.49 ' N ' HD12 ' A' ' 61' ' ' LEU . 9.6 mp -106.52 151.07 25.47 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 120.777 -0.369 . . . . 0.0 110.255 -179.433 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 28.4 m-85 -134.11 110.0 9.31 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.735 179.963 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.518 HD23 ' C ' ' A' ' 63' ' ' LEU . 2.2 tt -104.37 -82.39 0.51 Allowed 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 115.698 -0.683 . . . . 0.0 109.346 179.513 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.455 ' H ' ' HB ' ' A' ' 67' ' ' VAL . . . -79.43 179.18 53.23 Favored Glycine 0 CA--C 1.523 0.535 0 N-CA-C 109.343 -1.503 . . . . 0.0 109.343 178.561 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 1.6 mt -73.58 -34.5 65.14 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 119.767 -0.773 . . . . 0.0 110.426 -179.463 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -99.96 9.23 43.27 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.954 179.908 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.567 ' O ' HG12 ' A' ' 67' ' ' VAL . 9.6 t -106.35 96.04 4.29 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.228 0 CA-C-O 121.168 0.509 . . . . 0.0 111.96 -178.616 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.513 HD12 ' N ' ' A' ' 69' ' ' ILE . 1.2 tp -114.97 118.06 32.38 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 178.216 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.513 ' N ' HD12 ' A' ' 68' ' ' LEU . 3.1 mt -112.46 146.15 17.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-O 120.846 0.355 . . . . 0.0 111.791 -178.193 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.482 ' NH2' ' OD2' ' A' ' 91' ' ' ASP . 33.8 ptt180 -128.04 132.23 49.1 Favored 'General case' 0 C--O 1.237 0.444 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.053 179.254 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -143.95 150.18 37.94 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.341 -0.845 . . . . 0.0 110.26 -179.965 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -106.33 126.81 52.7 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 178.332 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.414 HG22 ' HA ' ' A' ' 87' ' ' CYS . 10.5 pt -134.75 158.97 41.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 C-N-CA 119.77 -0.772 . . . . 0.0 113.01 -177.521 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 74' ' ' SER . . . . . 0.403 ' CB ' ' OE1' ' A' ' 88' ' ' GLN . 0.5 OUTLIER -122.77 155.87 35.64 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 115.048 -0.978 . . . . 0.0 110.172 179.209 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.491 HD22 ' CZ ' ' A' ' 85' ' ' PHE . 0.1 OUTLIER -65.66 119.23 10.78 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.311 -179.902 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 76' ' ' ALA . . . . . 0.416 ' N ' HD13 ' A' ' 75' ' ' LEU . . . -96.98 -40.75 8.73 Favored 'General case' 0 C--N 1.331 -0.203 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 177.648 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 77' ' ' TRP . . . . . 0.585 ' NE1' ' HA3' ' A' ' 84' ' ' GLY . 68.1 p-90 -171.28 169.3 6.4 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.517 -0.765 . . . . 0.0 109.809 179.8 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -149.43 123.79 9.62 Favored 'General case' 0 N--CA 1.464 0.245 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 178.728 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 26.7 ttt180 -152.35 134.36 14.91 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 119.706 -0.798 . . . . 0.0 113.017 179.791 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' ASP . . . . . 0.515 ' O ' ' OD1' ' A' ' 80' ' ' ASP . 11.8 t0 57.07 47.51 17.27 Favored 'General case' 0 N--CA 1.463 0.18 0 N-CA-C 113.861 1.06 . . . . 0.0 113.861 176.702 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 82.54 -27.61 3.68 Favored Glycine 0 CA--C 1.523 0.548 0 C-N-CA 120.356 -0.926 . . . . 0.0 113.491 177.121 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 4.7 mt -89.62 157.19 18.13 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 117.756 0.778 . . . . 0.0 110.285 -179.156 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 26.3 mt -128.22 135.43 49.69 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.0 -179.077 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' GLY . . . . . 0.585 ' HA3' ' NE1' ' A' ' 77' ' ' TRP . . . -98.39 152.52 19.8 Favored Glycine 0 N--CA 1.45 -0.378 0 N-CA-C 109.65 -1.38 . . . . 0.0 109.65 178.734 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 85' ' ' PHE . . . . . 0.491 ' CZ ' HD22 ' A' ' 75' ' ' LEU . 22.4 m-85 -145.66 135.31 23.32 Favored 'General case' 0 C--N 1.317 -0.819 0 C-N-CA 120.642 -0.423 . . . . 0.0 110.913 -179.199 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -104.26 126.22 51.18 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 178.843 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 87' ' ' CYS . . . . . 0.414 ' HA ' HG22 ' A' ' 73' ' ' ILE . 2.2 t -69.13 122.39 18.68 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.956 0.407 . . . . 0.0 111.679 -178.451 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 88' ' ' GLN . . . . . 0.403 ' OE1' ' CB ' ' A' ' 74' ' ' SER . 6.5 mt-30 -96.17 -33.52 12.01 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.18 179.411 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 89' ' ' HIS . . . . . 0.5 ' C ' ' ND1' ' A' ' 89' ' ' HIS . 0.0 OUTLIER -162.99 142.54 8.89 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.394 -179.905 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.468 HG23 ' CG1' ' A' ' 95' ' ' ILE . 6.2 tt -145.21 141.08 22.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-N 115.856 -0.611 . . . . 0.0 109.695 -179.844 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 91' ' ' ASP . . . . . 0.483 ' OD1' ' N ' ' A' ' 93' ' ' ASP . 7.0 t70 -56.6 145.72 27.52 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 115.54 -0.755 . . . . 0.0 111.807 -178.109 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.435 ' N ' ' OD1' ' A' ' 91' ' ' ASP . 48.5 tp -54.24 -42.21 69.63 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 115.272 -0.877 . . . . 0.0 110.446 -179.144 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 93' ' ' ASP . . . . . 0.483 ' N ' ' OD1' ' A' ' 91' ' ' ASP . 1.3 m-20 -70.16 -33.07 71.32 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 179.523 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 94' ' ' SER . . . . . 0.421 ' HB3' HD11 ' A' ' 90' ' ' ILE . 13.3 m -69.06 -37.81 78.73 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.838 -0.619 . . . . 0.0 109.84 179.309 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 95' ' ' ILE . . . . . 0.468 ' CG1' HG23 ' A' ' 90' ' ' ILE . 56.6 mt -58.87 -38.12 70.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.19 179.623 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -70.6 -42.06 71.5 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.421 -0.512 . . . . 0.0 111.364 -178.538 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 60.9 m-70 -61.74 -35.78 79.09 Favored 'General case' 0 C--N 1.324 -0.53 0 C-N-CA 119.143 -1.023 . . . . 0.0 109.126 179.51 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 6.0 mp -67.49 -34.86 78.02 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 177.41 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 58.3 mtp180 -66.25 -39.43 89.5 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 108.671 -0.863 . . . . 0.0 108.671 177.877 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 29.7 mmt-85 -60.15 -42.95 95.99 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.116 -0.947 . . . . 0.0 110.663 178.864 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.436 HD23 ' HA ' ' A' ' 101' ' ' LEU . 5.6 mt -61.14 -36.34 79.51 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 -179.765 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 102' ' ' VAL . . . . . 0.522 HG22 HG12 ' A' ' 14' ' ' ILE . 90.3 t -68.73 -44.86 81.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.258 179.793 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 66.2 mt-10 -65.33 -45.55 83.78 Favored 'General case' 0 N--CA 1.464 0.243 0 N-CA-C 112.261 0.467 . . . . 0.0 112.261 -178.595 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.507 ' O ' ' N ' ' A' ' 108' ' ' ASP . 6.4 mp -72.52 -41.22 66.12 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 120.872 -0.331 . . . . 0.0 111.453 -179.231 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 105' ' ' ASN . . . . . 0.434 ' OD1' ' O ' ' A' ' 101' ' ' LEU . 9.9 m120 -57.75 -25.79 60.95 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 120.658 -0.417 . . . . 0.0 110.201 179.909 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 1.6 tp -56.55 -18.87 13.16 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.572 -179.89 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 107' ' ' GLY . . . . . 0.568 ' O ' ' N ' ' A' ' 109' ' ' GLU . . . -148.5 -45.07 0.03 OUTLIER Glycine 0 CA--C 1.524 0.627 0 C-N-CA 120.865 -0.683 . . . . 0.0 111.568 -179.695 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 108' ' ' ASP . . . . . 0.507 ' N ' ' O ' ' A' ' 104' ' ' LEU . 7.8 m-20 -60.38 71.83 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.816 0.341 . . . . 0.0 110.496 -179.772 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 109' ' ' GLU . . . . . 0.568 ' N ' ' O ' ' A' ' 107' ' ' GLY . 2.7 tp10 -171.93 150.56 2.6 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.36 -179.736 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 23.5 mt-10 -62.17 -117.43 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.296 179.863 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 111' ' ' LEU . . . . . 0.659 ' N ' HD12 ' A' ' 111' ' ' LEU . 8.2 mp -67.6 -139.8 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.811 -0.44 . . . . 0.0 109.811 179.643 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 1.2 mp 56.4 40.16 29.79 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.664 0.268 . . . . 0.0 111.051 179.681 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -144.79 92.64 2.3 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.887 0.375 . . . . 0.0 110.408 179.797 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 114' ' ' ARG . . . . . 0.416 HH11 ' HB2' ' A' ' 116' ' ' LEU . 0.1 OUTLIER -173.09 122.32 0.39 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.595 179.976 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 75.5 mm-40 -48.81 -36.2 16.18 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.226 179.732 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.638 ' O ' HG23 ' A' ' 120' ' ' VAL . 9.9 mp -53.86 -44.86 70.74 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.355 179.539 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -66.18 -51.68 55.47 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.897 0.38 . . . . 0.0 111.282 179.888 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 15.1 mt -58.48 -49.02 78.85 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.987 -0.551 . . . . 0.0 112.458 -177.974 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 119' ' ' LEU . . . . . 0.516 ' O ' ' O ' ' A' ' 122' ' ' ALA . 0.7 OUTLIER -72.77 -49.36 31.26 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 120.008 -0.677 . . . . 0.0 111.567 -178.705 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 120' ' ' VAL . . . . . 0.638 HG23 ' O ' ' A' ' 116' ' ' LEU . 87.8 t -56.76 -12.56 1.27 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 C-N-CA 120.162 -0.615 . . . . 0.0 111.136 -176.19 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 121' ' ' SER . . . . . 0.484 ' O ' ' OG ' ' A' ' 121' ' ' SER . 1.8 t -88.51 18.48 4.53 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 178.185 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 122' ' ' ALA . . . . . 0.516 ' O ' ' O ' ' A' ' 119' ' ' LEU . . . 170.79 -170.66 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 115.431 -0.804 . . . . 0.0 109.695 179.86 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 123' ' ' HIS . . . . . 0.775 ' O ' ' N ' ' A' ' 125' ' ' ASP . 4.8 p80 -175.86 -173.1 0.57 Allowed 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.72 -0.392 . . . . 0.0 111.017 179.245 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 124' ' ' ASP . . . . . 0.656 ' O ' ' CB ' ' A' ' 125' ' ' ASP . 0.5 OUTLIER -30.38 -17.47 0.0 OUTLIER 'General case' 0 CA--C 1.531 0.214 0 N-CA-C 113.275 0.843 . . . . 0.0 113.275 -179.428 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 125' ' ' ASP . . . . . 0.775 ' N ' ' O ' ' A' ' 123' ' ' HIS . 25.1 t70 . . . . . 0 N--CA 1.472 0.654 0 CA-C-O 118.113 -0.946 . . . . 0.0 110.08 179.9 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 501' ' ' C2E . . . . . 0.999 ' O21' " H4'" ' A' ' 501' ' ' C2E . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 502' ' ' C2E . . . . . 0.663 ' C61' ' H ' ' A' ' 8' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.615 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 8.5 t -148.81 21.09 1.01 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.778 -179.748 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 51.2 m-20 -98.75 -7.26 27.94 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.084 0.468 . . . . 0.0 110.252 179.31 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.636 ' C ' ' CG ' ' A' ' 5' ' ' HIS . 0.0 OUTLIER -112.89 15.13 19.84 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.889 -179.093 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 5' ' ' HIS . . . . . 0.636 ' CG ' ' C ' ' A' ' 4' ' ' GLN . 0.0 OUTLIER 50.89 17.7 0.45 Allowed 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 108.046 -1.094 . . . . 0.0 108.046 -177.365 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 6' ' ' ASP . . . . . 0.602 ' O ' ' NE ' ' A' ' 8' ' ' ARG . 13.3 m-20 48.12 82.32 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 114.742 -1.117 . . . . 0.0 110.443 -179.355 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.427 ' HA ' ' C51' ' A' ' 502' ' ' C2E . 8.7 tt0 -83.72 119.69 25.11 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 179.074 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.61 ' NH2' ' N11' ' A' ' 501' ' ' C2E . 0.0 OUTLIER -126.14 21.96 7.32 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.489 -178.515 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.657 ' NH1' ' NE ' ' A' ' 13' ' ' ARG . 8.9 mtt180 -124.98 113.79 18.28 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 120.405 -0.518 . . . . 0.0 111.219 -179.14 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.664 ' CD ' ' H ' ' A' ' 11' ' ' PHE . 0.0 OUTLIER -30.19 -64.8 0.12 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.414 -0.812 . . . . 0.0 110.988 179.717 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 11' ' ' PHE . . . . . 0.664 ' H ' ' CD ' ' A' ' 10' ' ' ARG . 26.9 m-85 -111.83 170.91 7.82 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-O 120.97 0.414 . . . . 0.0 111.03 -179.622 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -81.68 156.65 24.95 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.483 179.959 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.657 ' NE ' ' NH1' ' A' ' 9' ' ' ARG . 0.1 OUTLIER -102.9 145.46 29.78 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-O 120.995 0.426 . . . . 0.0 110.845 -179.899 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.628 ' N ' HD12 ' A' ' 14' ' ' ILE . 1.2 mp -82.52 102.21 8.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 179.162 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -94.96 120.25 34.86 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.582 0.706 . . . . 0.0 112.035 -178.924 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 2.5 p90 -149.77 158.79 44.5 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 114.686 -1.143 . . . . 0.0 107.959 177.605 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -95.26 147.11 23.83 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 119.981 -0.688 . . . . 0.0 110.574 -178.963 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.424 ' O ' HD12 ' A' ' 32' ' ' LEU . . . -179.67 178.48 0.64 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.902 -0.59 . . . . 0.0 109.763 179.915 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -96.55 134.04 40.26 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 120.786 -0.365 . . . . 0.0 110.976 179.987 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.583 ' O ' ' O ' ' A' ' 31' ' ' VAL . 7.6 p -135.78 157.04 47.84 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.18 179.044 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.406 ' C ' ' OE1' ' A' ' 21' ' ' GLU . 0.8 OUTLIER -144.74 144.38 31.16 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.122 -0.696 . . . . 0.0 109.122 178.702 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 1.2 mm -119.24 136.75 55.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-O 121.133 0.492 . . . . 0.0 111.591 -177.995 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.549 HD11 ' HG3' ' A' ' 60' ' ' ARG . 0.2 OUTLIER -121.63 123.15 41.24 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.617 -0.72 . . . . 0.0 111.017 -179.882 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.574 ' O ' ' NE2' ' A' ' 24' ' ' GLN . 0.0 OUTLIER -130.34 102.39 6.17 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.096 179.342 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 80.07 -126.06 7.24 Favored Glycine 0 CA--C 1.523 0.564 0 N-CA-C 109.821 -1.312 . . . . 0.0 109.821 -178.707 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -100.19 11.87 38.36 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 179.151 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.486 ' HB3' ' CZ2' ' A' ' 29' ' ' TRP . 2.2 mtt180 -112.74 131.25 55.76 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.846 -0.615 . . . . 0.0 112.364 -177.267 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.452 HH11 ' HD3' ' A' ' 28' ' ' ARG . 36.4 ttt180 -126.24 148.47 49.47 Favored 'General case' 0 CA--C 1.519 -0.238 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.783 178.875 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.53 ' NE1' ' O ' ' A' ' 48' ' ' ASP . 7.1 m-90 -147.47 156.44 42.85 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.459 -178.894 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.536 ' H ' ' CD ' ' A' ' 30' ' ' GLU . 3.1 mp0 -102.4 140.89 36.08 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.162 -0.472 . . . . 0.0 109.9 179.58 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.583 ' O ' ' O ' ' A' ' 20' ' ' SER . 12.4 m -150.25 157.25 6.16 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-O 121.159 0.504 . . . . 0.0 110.904 -179.697 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.507 HD12 ' N ' ' A' ' 33' ' ' LEU . 6.7 tp -94.23 128.54 40.74 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 107.475 -1.306 . . . . 0.0 107.475 178.144 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.802 HD23 ' O ' ' A' ' 33' ' ' LEU . 0.4 OUTLIER -90.22 126.01 35.68 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.57 -0.53 . . . . 0.0 109.57 -179.727 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 40.0 m-70 -93.06 -28.64 16.24 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.558 -0.747 . . . . 0.0 111.962 -178.218 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 2.0 p-10 -172.75 158.76 4.08 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 119.483 -0.887 . . . . 0.0 110.862 177.418 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.538 HG22 ' N ' ' A' ' 37' ' ' SER . 7.1 p -143.54 169.27 11.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.494 -0.775 . . . . 0.0 110.878 -178.904 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.538 ' N ' HG22 ' A' ' 36' ' ' VAL . 17.1 t -140.91 170.72 15.2 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 178.814 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.489 HD12 ' N ' ' A' ' 39' ' ' HIS . 1.1 pp -67.4 -0.11 3.39 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 119.976 -0.689 . . . . 0.0 111.11 -179.397 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 39' ' ' HIS . . . . . 0.514 ' NE2' ' O ' ' A' ' 87' ' ' CYS . 1.6 t60 -162.22 35.12 0.12 Allowed 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 120.73 -0.388 . . . . 0.0 111.217 179.776 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 40' ' ' GLY . . . . . 0.509 ' HA3' ' N3 ' ' A' ' 501' ' ' C2E . . . -171.66 156.06 25.23 Favored Glycine 0 CA--C 1.526 0.731 0 N-CA-C 110.759 -0.936 . . . . 0.0 110.759 179.903 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -148.03 150.37 14.43 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 CA-C-O 121.597 0.713 . . . . 0.0 112.606 -178.839 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.452 HD12 ' O6 ' ' A' ' 501' ' ' C2E . 0.6 OUTLIER -123.0 140.51 52.96 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 114.665 -1.152 . . . . 0.0 109.191 178.849 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.415 ' N ' HD23 ' A' ' 42' ' ' LEU . 10.6 m -145.58 174.99 2.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-O 121.091 0.472 . . . . 0.0 111.092 179.95 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -96.96 145.38 17.84 Favored Glycine 0 CA--C 1.526 0.775 0 N-CA-C 109.47 -1.452 . . . . 0.0 109.47 178.237 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 45.2 tt0 -86.6 115.63 62.99 Favored Pre-proline 0 N--CA 1.462 0.154 0 CA-C-N 117.732 0.766 . . . . 0.0 111.79 -178.538 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 66.4 Cg_endo -85.13 161.33 11.53 Favored 'Trans proline' 0 C--N 1.306 -1.67 0 C-N-CA 121.569 1.513 . . . . 0.0 111.134 178.856 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 58.7 mt-30 -65.17 -40.14 93.89 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 112.128 0.418 . . . . 0.0 112.128 -178.885 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.562 ' O ' ' N ' ' A' ' 50' ' ' ASN . 0.9 OUTLIER -72.21 8.63 1.24 Allowed 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 111.85 0.315 . . . . 0.0 111.85 -178.794 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 49' ' ' TRP . . . . . 0.486 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 64.9 t-105 -59.57 67.17 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 111.825 0.305 . . . . 0.0 111.825 -179.738 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 50' ' ' ASN . . . . . 0.562 ' N ' ' O ' ' A' ' 48' ' ' ASP . 32.8 t-20 -93.33 78.34 4.47 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 120.159 -0.616 . . . . 0.0 109.59 178.325 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -144.58 144.34 13.18 Favored Glycine 0 CA--C 1.523 0.533 0 N-CA-C 111.17 -0.772 . . . . 0.0 111.17 -179.38 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 23.0 t0 -77.94 113.33 31.94 Favored Pre-proline 0 CA--C 1.533 0.318 0 CA-C-N 115.878 -0.161 . . . . 0.0 111.102 -179.709 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -50.07 -22.63 8.12 Favored 'Trans proline' 0 N--CA 1.495 1.584 0 C-N-CA 122.522 2.148 . . . . 0.0 112.673 179.578 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 67.1 mm-40 -77.51 -23.99 50.12 Favored 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 120.642 -0.423 . . . . 0.0 111.769 -178.853 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.575 ' O ' ' CE1' ' A' ' 57' ' ' PHE . 66.8 mtm180 -92.94 151.04 40.34 Favored Pre-proline 0 C--N 1.33 -0.252 0 C-N-CA 120.671 -0.412 . . . . 0.0 110.077 179.741 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -62.94 160.73 32.32 Favored 'Trans proline' 0 N--CA 1.495 1.596 0 C-N-CA 122.834 2.356 . . . . 0.0 113.436 -178.701 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.575 ' CE1' ' O ' ' A' ' 55' ' ' ARG . 41.6 m-85 -130.59 155.18 46.97 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 114.897 -1.047 . . . . 0.0 109.147 179.343 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.411 ' O ' HD12 ' A' ' 23' ' ' LEU . 14.3 mt-10 -123.06 139.07 54.46 Favored 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 178.777 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 59' ' ' ALA . . . . . 0.429 ' HB2' HD13 ' A' ' 73' ' ' ILE . . . -118.66 135.93 54.2 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 112.501 0.556 . . . . 0.0 112.501 -177.772 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.574 ' C ' HD12 ' A' ' 61' ' ' LEU . 2.1 mmt85 -122.74 127.67 49.5 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 108.261 -1.014 . . . . 0.0 108.261 177.107 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.625 ' N ' HD12 ' A' ' 61' ' ' LEU . 7.9 mp -111.48 151.22 28.85 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 120.67 -0.412 . . . . 0.0 111.241 -178.558 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 9.8 m-85 -131.76 110.09 10.61 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.625 179.446 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.507 HD23 ' C ' ' A' ' 63' ' ' LEU . 2.0 tt -103.78 -85.43 0.46 Allowed 'General case' 0 C--N 1.333 -0.143 0 N-CA-C 108.991 -0.744 . . . . 0.0 108.991 178.968 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.45 ' H ' ' HB ' ' A' ' 67' ' ' VAL . . . -75.28 179.84 45.1 Favored Glycine 0 CA--C 1.522 0.508 0 N-CA-C 109.017 -1.633 . . . . 0.0 109.017 178.338 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.79 ' N ' HD22 ' A' ' 65' ' ' LEU . 2.5 mm? -74.42 -32.44 62.66 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 119.709 -0.796 . . . . 0.0 110.232 -179.479 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 24.7 m-20 -102.53 9.27 39.59 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 122.734 0.414 . . . . 0.0 111.063 -179.827 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.574 ' O ' HG12 ' A' ' 67' ' ' VAL . 8.5 t -103.22 93.76 2.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-O 121.34 0.59 . . . . 0.0 111.667 -178.905 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 4.4 tp -109.99 117.66 34.37 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 178.272 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.55 HG23 ' OG ' ' A' ' 94' ' ' SER . 6.3 mt -115.78 143.99 24.45 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.278 0 CA-C-O 120.982 0.42 . . . . 0.0 111.374 -178.88 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.502 ' NH2' ' OD2' ' A' ' 91' ' ' ASP . 28.5 ptt-85 -128.38 130.73 48.13 Favored 'General case' 0 C--O 1.237 0.441 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.007 179.223 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 71' ' ' MET . . . . . 0.699 ' SD ' HD12 ' A' ' 90' ' ' ILE . 1.5 mtm -139.95 148.19 41.58 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 115.934 -0.576 . . . . 0.0 109.691 179.453 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -101.97 132.68 47.65 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 107.87 -1.159 . . . . 0.0 107.87 178.718 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.649 HD12 ' HB2' ' A' ' 85' ' ' PHE . 4.1 pt -142.7 157.41 18.5 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 C-N-CA 119.44 -0.904 . . . . 0.0 112.977 -177.666 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 3.3 t -121.91 155.45 35.42 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 115.47 -0.786 . . . . 0.0 109.763 179.032 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.593 HD13 ' N ' ' A' ' 76' ' ' ALA . 0.2 OUTLIER -65.02 118.43 9.11 Favored 'General case' 0 CA--C 1.521 -0.162 0 CA-C-O 121.161 0.505 . . . . 0.0 110.603 -178.575 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 76' ' ' ALA . . . . . 0.593 ' N ' HD13 ' A' ' 75' ' ' LEU . . . -97.22 -40.99 8.51 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.064 177.446 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 77' ' ' TRP . . . . . 0.595 ' CD1' ' C2 ' ' A' ' 502' ' ' C2E . 68.8 p-90 -170.42 169.76 7.33 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.79 -179.819 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -151.07 123.99 8.65 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 116.299 -0.409 . . . . 0.0 109.948 178.658 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -152.04 132.03 13.42 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 120.043 -0.663 . . . . 0.0 112.364 179.593 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 55.67 47.19 21.14 Favored 'General case' 0 N--CA 1.465 0.287 0 N-CA-C 113.089 0.774 . . . . 0.0 113.089 176.85 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 68.17 12.67 63.44 Favored Glycine 0 CA--C 1.523 0.547 0 C-N-CA 120.343 -0.932 . . . . 0.0 111.902 178.385 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 29.1 mt -115.74 136.13 53.36 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 108.474 -0.935 . . . . 0.0 108.474 178.488 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 37.6 mt -124.48 136.41 53.99 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.497 -178.928 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' GLY . . . . . 0.475 ' HA3' ' NE1' ' A' ' 77' ' ' TRP . . . -123.36 134.58 9.49 Favored Glycine 0 CA--C 1.519 0.337 0 N-CA-C 109.481 -1.448 . . . . 0.0 109.481 178.551 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 85' ' ' PHE . . . . . 0.649 ' HB2' HD12 ' A' ' 73' ' ' ILE . 26.0 m-85 -122.65 157.78 31.46 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.964 0.412 . . . . 0.0 110.096 -179.805 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -104.8 130.55 52.89 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 178.314 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 87' ' ' CYS . . . . . 0.514 ' O ' ' NE2' ' A' ' 39' ' ' HIS . 44.5 t -74.78 124.23 26.42 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.826 0.346 . . . . 0.0 111.336 -178.976 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 3.6 pm0 -100.73 -31.2 11.31 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.458 179.598 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 89' ' ' HIS . . . . . 0.611 ' ND1' ' N ' ' A' ' 90' ' ' ILE . 0.0 OUTLIER -159.2 141.0 13.4 Favored 'General case' 0 C--O 1.225 -0.203 0 CA-C-O 120.909 0.385 . . . . 0.0 110.08 179.283 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.699 HD12 ' SD ' ' A' ' 71' ' ' MET . 7.7 tt -145.31 140.51 22.47 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-O 121.438 0.637 . . . . 0.0 110.15 -178.947 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 91' ' ' ASP . . . . . 0.502 ' OD2' ' NH2' ' A' ' 70' ' ' ARG . 0.1 OUTLIER -55.02 140.85 36.34 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 115.033 -0.985 . . . . 0.0 112.334 -178.058 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 6.6 tp -54.56 -42.62 71.21 Favored 'General case' 0 N--CA 1.462 0.136 0 CA-C-N 115.075 -0.966 . . . . 0.0 110.321 -179.642 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 93' ' ' ASP . . . . . 0.414 ' OD1' ' N ' ' A' ' 94' ' ' SER . 0.5 OUTLIER -71.93 -35.8 69.75 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 179.557 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 94' ' ' SER . . . . . 0.55 ' OG ' HG23 ' A' ' 69' ' ' ILE . 1.5 t -64.53 -38.26 90.39 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.427 179.078 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 95' ' ' ILE . . . . . 0.442 ' CG1' HG23 ' A' ' 90' ' ' ILE . 22.0 mt -59.01 -37.49 68.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.372 179.133 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -70.19 -40.12 74.83 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.096 -0.641 . . . . 0.0 110.612 -178.938 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 59.7 m-70 -63.08 -37.07 85.76 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 119.475 -0.89 . . . . 0.0 109.097 179.315 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -67.52 -37.5 82.85 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 178.131 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 48.7 mtp85 -66.35 -38.52 87.8 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 178.402 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 23.0 mmt180 -57.15 -39.9 76.14 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.32 178.098 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.436 HD21 HD12 ' A' ' 63' ' ' LEU . 5.4 mp -69.6 -36.75 76.49 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.359 -0.837 . . . . 0.0 110.183 -179.797 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 87.8 t -68.4 -46.67 80.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.62 179.851 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 94.2 mt-10 -65.16 -42.22 93.94 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.031 -179.667 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 44.8 mt -69.37 -40.43 77.46 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.813 -0.355 . . . . 0.0 110.684 -179.485 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -58.14 -48.98 78.58 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.692 -0.403 . . . . 0.0 110.132 179.832 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 4.8 mp -55.73 -39.92 71.76 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.191 179.96 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 107' ' ' GLY . . . . . 0.51 ' O ' ' N ' ' A' ' 109' ' ' GLU . . . 64.66 85.56 0.07 OUTLIER Glycine 0 CA--C 1.523 0.556 0 N-CA-C 110.616 -0.994 . . . . 0.0 110.616 -179.954 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -65.17 57.01 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.762 0.315 . . . . 0.0 110.494 -179.838 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 109' ' ' GLU . . . . . 0.51 ' N ' ' O ' ' A' ' 107' ' ' GLY . 0.0 OUTLIER -71.75 79.5 0.85 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.495 -179.991 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 61.26 -155.29 0.36 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.053 179.87 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 4.8 tt -41.75 138.57 1.4 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.861 -179.635 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 8.0 tp -162.5 67.63 0.23 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.308 179.877 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 16.0 mm-40 -111.25 126.17 54.59 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.88 -179.667 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 114' ' ' ARG . . . . . 0.559 ' C ' ' H ' ' A' ' 116' ' ' LEU . 3.1 tpt180 -175.52 -84.34 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.193 179.845 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 115' ' ' GLU . . . . . 0.458 ' HB2' HD12 ' A' ' 118' ' ' LEU . 2.4 pt-20 -71.54 18.71 0.07 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.133 179.738 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.559 ' H ' ' C ' ' A' ' 114' ' ' ARG . 6.2 tp -66.77 -40.09 88.1 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.72 -0.673 . . . . 0.0 112.167 -179.134 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 117' ' ' ALA . . . . . 0.602 ' O ' HG23 ' A' ' 120' ' ' VAL . . . -68.83 -22.45 64.24 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 111.7 0.259 . . . . 0.0 111.7 -179.554 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.458 HD12 ' HB2' ' A' ' 115' ' ' GLU . 72.7 mt -53.26 -31.04 41.61 Favored 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 120.6 -0.44 . . . . 0.0 110.627 -178.508 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 119' ' ' LEU . . . . . 0.531 ' CD2' ' N ' ' A' ' 119' ' ' LEU . 1.4 mm? -58.99 -27.92 65.87 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 177.927 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 120' ' ' VAL . . . . . 0.602 HG23 ' O ' ' A' ' 117' ' ' ALA . 43.0 t -59.15 -46.81 91.78 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.169 0 CA-C-N 115.37 -0.832 . . . . 0.0 111.565 179.662 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 121' ' ' SER . . . . . 0.507 ' C ' ' H ' ' A' ' 123' ' ' HIS . 1.2 t -89.24 -30.73 18.3 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.743 -178.466 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -73.31 19.68 0.09 Allowed 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.157 -0.617 . . . . 0.0 110.583 -179.225 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 123' ' ' HIS . . . . . 0.601 ' CE1' ' CB ' ' A' ' 124' ' ' ASP . 0.5 OUTLIER -106.6 -44.55 4.45 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.357 179.941 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 124' ' ' ASP . . . . . 0.601 ' CB ' ' CE1' ' A' ' 123' ' ' HIS . 10.1 t0 -121.71 -27.01 4.78 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.828 -179.85 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 125' ' ' ASP . . . . . 0.461 ' O ' ' O ' ' A' ' 121' ' ' SER . 0.2 OUTLIER . . . . . 0 C--O 1.22 -0.471 0 CA-C-O 118.152 -0.928 . . . . 0.0 110.593 -179.593 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 501' ' ' C2E . . . . . 1.043 ' O21' " H4'" ' A' ' 501' ' ' C2E . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 502' ' ' C2E . . . . . 0.595 ' C2 ' ' CD1' ' A' ' 77' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.583 0 N-CA-C 109.408 -0.59 . . . . 0.0 109.408 . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 51.6 p -119.44 65.32 0.79 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.356 179.74 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 18.1 p-10 -99.08 29.69 3.76 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.547 179.64 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.448 ' O ' ' O ' ' A' ' 5' ' ' HIS . 0.0 OUTLIER -111.95 12.91 20.79 Favored 'General case' 0 N--CA 1.462 0.161 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.793 -179.871 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 5' ' ' HIS . . . . . 0.544 ' CG ' ' O4A' ' A' ' 502' ' ' C2E . 0.0 OUTLIER 46.43 102.42 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.053 179.764 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -52.38 158.52 1.19 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.205 179.39 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.514 ' OE1' ' N ' ' A' ' 7' ' ' GLU . 16.0 pm0 -91.81 134.75 34.47 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-O 121.089 0.471 . . . . 0.0 110.798 -179.821 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.724 HH21 ' C21' ' A' ' 501' ' ' C2E . 0.0 OUTLIER -122.47 -8.03 8.61 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.254 -178.962 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.636 ' CD ' HH11 ' A' ' 13' ' ' ARG . 1.2 ptt85 -111.73 93.07 4.28 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-O 120.917 0.389 . . . . 0.0 110.184 179.946 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.521 ' C ' ' O ' ' A' ' 9' ' ' ARG . 0.0 OUTLIER 17.26 -82.55 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 115.363 -0.835 . . . . 0.0 111.672 -179.775 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 11' ' ' PHE . . . . . 0.563 ' N ' ' O ' ' A' ' 9' ' ' ARG . 0.9 OUTLIER -127.83 156.73 42.07 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-O 120.816 0.341 . . . . 0.0 110.332 -179.642 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -51.06 135.17 25.6 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.608 -179.888 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.65 ' NH2' HD12 ' A' ' 42' ' ' LEU . 15.6 mtm-85 -76.68 160.65 29.18 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.783 -179.72 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.704 ' N ' HD12 ' A' ' 14' ' ' ILE . 1.5 mp -73.31 95.93 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.762 179.745 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -95.5 120.68 36.17 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.307 0.575 . . . . 0.0 112.497 -178.806 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 28.9 p90 -149.74 158.71 44.43 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.009 -0.996 . . . . 0.0 108.316 177.199 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -95.42 147.59 23.37 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 120.152 -0.619 . . . . 0.0 110.74 -179.174 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.617 ' O ' HD12 ' A' ' 32' ' ' LEU . . . 179.27 176.79 0.58 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.097 179.879 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -96.26 134.16 39.71 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.946 -179.927 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.492 ' O ' ' O ' ' A' ' 31' ' ' VAL . 11.7 p -134.44 153.37 51.95 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.925 0.393 . . . . 0.0 110.375 178.952 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 68.6 mt-10 -133.49 140.02 47.0 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 109.136 -0.69 . . . . 0.0 109.136 179.437 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.411 ' HA ' ' O ' ' A' ' 58' ' ' GLU . 0.6 OUTLIER -119.9 135.77 59.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-O 121.311 0.577 . . . . 0.0 110.639 -179.47 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.459 ' H ' HD12 ' A' ' 23' ' ' LEU . 0.2 OUTLIER -123.71 123.26 40.14 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.407 -0.815 . . . . 0.0 111.113 -179.075 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.496 ' OE1' ' NH1' ' A' ' 27' ' ' ARG . 1.5 tm0? -129.62 102.09 6.21 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.377 -0.828 . . . . 0.0 110.042 179.079 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 81.06 -126.44 7.38 Favored Glycine 0 CA--C 1.523 0.549 0 N-CA-C 109.961 -1.256 . . . . 0.0 109.961 -178.87 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 14.7 pt-20 -100.18 11.66 38.83 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 179.269 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.496 ' NH1' ' OE1' ' A' ' 24' ' ' GLN . 0.2 OUTLIER -114.51 133.07 56.05 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.604 -0.726 . . . . 0.0 112.607 -176.443 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.433 ' O ' ' CD1' ' A' ' 29' ' ' TRP . 41.8 ttt-85 -128.12 153.0 47.33 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.334 179.555 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.433 ' CD1' ' O ' ' A' ' 28' ' ' ARG . 6.3 m-90 -150.51 156.48 41.5 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.276 -0.875 . . . . 0.0 110.501 -179.41 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.453 ' N ' ' CD ' ' A' ' 30' ' ' GLU . 4.7 mp0 -100.72 138.59 37.57 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.692 -0.485 . . . . 0.0 109.692 179.462 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.492 ' O ' ' O ' ' A' ' 20' ' ' SER . 18.4 m -148.34 158.69 7.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 121.232 0.539 . . . . 0.0 111.357 -179.241 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.617 HD12 ' O ' ' A' ' 18' ' ' ALA . 15.9 tp -96.52 128.16 43.19 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 108.392 -0.966 . . . . 0.0 108.392 178.732 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -91.08 125.85 35.99 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.249 0.547 . . . . 0.0 110.061 -179.885 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 72.2 m-70 -92.1 -28.24 17.24 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.308 -0.86 . . . . 0.0 111.76 -178.809 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.59 ' CG ' HH21 ' A' ' 13' ' ' ARG . 3.6 p30 -173.78 162.47 4.02 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 119.409 -0.916 . . . . 0.0 111.449 177.677 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.504 HG22 ' H ' ' A' ' 37' ' ' SER . 3.3 p -145.35 168.84 7.93 Favored 'Isoleucine or valine' 0 C--O 1.231 0.124 0 CA-C-N 115.564 -0.744 . . . . 0.0 111.098 -179.063 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.518 ' CB ' HN22 ' A' ' 501' ' ' C2E . 30.1 t -140.99 169.32 17.84 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 107.93 -1.137 . . . . 0.0 107.93 178.694 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.68 ' H ' HD12 ' A' ' 38' ' ' LEU . 5.9 mp -64.65 0.21 1.19 Allowed 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 119.44 -0.904 . . . . 0.0 110.241 -179.256 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 39' ' ' HIS . . . . . 0.445 ' H ' ' C ' ' A' ' 37' ' ' SER . 32.9 p-80 -163.36 43.81 0.11 Allowed 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 120.633 -0.427 . . . . 0.0 111.581 179.995 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 40' ' ' GLY . . . . . 0.53 ' HA3' ' N3 ' ' A' ' 501' ' ' C2E . . . 178.78 158.18 20.79 Favored Glycine 0 CA--C 1.53 0.977 0 C-N-CA 120.716 -0.754 . . . . 0.0 111.525 179.784 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -149.34 149.19 15.01 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.352 0 CA-C-O 121.364 0.602 . . . . 0.0 111.751 -178.759 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.65 HD12 ' NH2' ' A' ' 13' ' ' ARG . 1.1 tt -121.88 127.75 50.82 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 114.93 -1.032 . . . . 0.0 108.442 178.325 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.416 ' N ' HD23 ' A' ' 42' ' ' LEU . 23.2 m -130.9 174.72 12.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-O 121.3 0.571 . . . . 0.0 111.543 -179.028 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -96.81 144.15 17.16 Favored Glycine 0 CA--C 1.526 0.774 0 N-CA-C 109.164 -1.574 . . . . 0.0 109.164 178.062 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -85.4 115.49 61.59 Favored Pre-proline 0 N--CA 1.464 0.239 0 CA-C-N 117.995 0.897 . . . . 0.0 111.713 -178.633 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 78.2 Cg_endo -85.47 160.63 11.01 Favored 'Trans proline' 0 C--N 1.307 -1.616 0 C-N-CA 121.685 1.59 . . . . 0.0 111.259 178.923 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 16.5 pt20 -65.43 -30.59 71.4 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.127 0.417 . . . . 0.0 112.127 -179.106 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.543 ' O ' ' N ' ' A' ' 50' ' ' ASN . 40.7 m-20 -80.5 8.45 7.72 Favored 'General case' 0 N--CA 1.465 0.278 0 N-CA-C 111.957 0.355 . . . . 0.0 111.957 -178.699 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 49' ' ' TRP . . . . . 0.441 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 61.8 t-105 -60.1 66.75 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 112.089 0.403 . . . . 0.0 112.089 -179.389 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 50' ' ' ASN . . . . . 0.551 HD22 ' C ' ' A' ' 50' ' ' ASN . 0.2 OUTLIER -93.25 78.9 4.48 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 120.002 -0.679 . . . . 0.0 109.555 178.386 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -143.9 160.27 27.73 Favored Glycine 0 CA--C 1.523 0.535 0 N-CA-C 111.098 -0.801 . . . . 0.0 111.098 -179.45 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -95.03 109.22 43.18 Favored Pre-proline 0 CA--C 1.534 0.358 0 CA-C-N 115.63 -0.285 . . . . 0.0 110.694 -179.756 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -48.68 -22.53 4.56 Favored 'Trans proline' 0 N--CA 1.494 1.51 0 C-N-CA 122.391 2.061 . . . . 0.0 112.549 179.831 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 38.6 mt-30 -75.71 -24.02 56.18 Favored 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 120.497 -0.481 . . . . 0.0 111.413 -179.13 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.518 ' O ' ' CE1' ' A' ' 57' ' ' PHE . 21.7 mtm180 -94.77 155.79 38.92 Favored Pre-proline 0 C--N 1.33 -0.242 0 C-N-CA 120.838 -0.345 . . . . 0.0 110.085 179.777 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -67.05 160.8 45.61 Favored 'Trans proline' 0 C--N 1.308 -1.569 0 C-N-CA 122.753 2.302 . . . . 0.0 112.935 -179.063 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.518 ' CE1' ' O ' ' A' ' 55' ' ' ARG . 58.8 m-85 -130.53 156.0 45.54 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.142 -0.936 . . . . 0.0 108.953 179.418 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.411 ' O ' ' HA ' ' A' ' 22' ' ' ILE . 33.9 mt-10 -122.5 138.61 54.5 Favored 'General case' 0 C--O 1.221 -0.434 0 N-CA-C 109.063 -0.717 . . . . 0.0 109.063 178.483 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 59' ' ' ALA . . . . . 0.474 ' HB2' HD13 ' A' ' 73' ' ' ILE . . . -119.86 138.3 53.48 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 112.463 0.542 . . . . 0.0 112.463 -177.876 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.505 ' CZ ' ' OH ' ' A' ' 62' ' ' TYR . 31.3 mtm180 -123.92 127.68 48.34 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 177.681 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.502 HD12 ' C ' ' A' ' 60' ' ' ARG . 11.2 mp -108.73 151.16 26.57 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.0 0.429 . . . . 0.0 111.053 -178.798 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 62' ' ' TYR . . . . . 0.505 ' OH ' ' CZ ' ' A' ' 60' ' ' ARG . 36.8 m-85 -133.42 108.6 8.77 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.29 179.539 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.499 HD12 ' C ' ' A' ' 62' ' ' TYR . 8.8 mp -104.47 -90.11 0.4 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.165 179.436 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -70.12 177.23 32.45 Favored Glycine 0 CA--C 1.523 0.538 0 N-CA-C 109.166 -1.574 . . . . 0.0 109.166 178.304 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.75 ' H ' HD12 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -73.21 -32.61 64.88 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 119.824 -0.75 . . . . 0.0 110.219 -179.544 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -102.42 9.65 39.55 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 122.846 0.459 . . . . 0.0 111.251 -179.763 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.463 ' O ' HG12 ' A' ' 67' ' ' VAL . 34.3 t -106.03 96.51 4.67 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.378 0 CA-C-O 121.441 0.639 . . . . 0.0 111.997 -178.747 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.446 HD13 ' CE2' ' A' ' 62' ' ' TYR . 6.5 tp -113.22 117.61 32.36 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.078 -0.965 . . . . 0.0 108.421 178.514 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.472 HG23 ' CB ' ' A' ' 94' ' ' SER . 3.7 mt -114.16 145.19 20.31 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-O 120.933 0.397 . . . . 0.0 111.56 -178.707 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 6.9 ptm180 -128.01 135.47 49.93 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.801 179.018 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -146.33 149.54 34.0 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.426 -179.597 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -102.96 135.62 44.29 Favored 'General case' 0 N--CA 1.463 0.184 0 N-CA-C 108.01 -1.107 . . . . 0.0 108.01 178.166 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.583 HD12 ' CB ' ' A' ' 85' ' ' PHE . 1.9 pt -144.37 157.89 15.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 C-N-CA 119.467 -0.893 . . . . 0.0 113.163 -177.59 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 1.3 t -123.07 155.86 36.07 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.067 178.805 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.618 HD13 ' N ' ' A' ' 76' ' ' ALA . 0.2 OUTLIER -65.2 118.66 9.56 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.951 0.405 . . . . 0.0 110.338 -179.65 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 76' ' ' ALA . . . . . 0.618 ' N ' HD13 ' A' ' 75' ' ' LEU . . . -97.1 -40.83 8.63 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.047 177.658 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 77' ' ' TRP . . . . . 0.547 ' NE1' ' HA3' ' A' ' 84' ' ' GLY . 67.2 p-90 -171.04 169.23 6.66 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.316 -179.956 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -151.27 123.86 8.47 Favored 'General case' 0 N--CA 1.464 0.226 0 N-CA-C 109.97 -0.382 . . . . 0.0 109.97 178.778 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 2.7 ttm180 -152.27 134.08 14.78 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 119.827 -0.749 . . . . 0.0 113.016 179.651 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 40.6 m-20 56.56 47.34 18.78 Favored 'General case' 0 N--CA 1.463 0.219 0 N-CA-C 113.983 1.105 . . . . 0.0 113.983 176.485 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 84.36 -27.76 4.52 Favored Glycine 0 CA--C 1.523 0.581 0 C-N-CA 120.408 -0.901 . . . . 0.0 113.452 177.23 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 4.0 mt -89.58 155.76 19.05 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 117.847 0.824 . . . . 0.0 110.439 -179.008 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 44.1 mt -128.62 135.57 49.5 Favored 'General case' 0 CA--C 1.52 -0.208 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.456 -179.136 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' GLY . . . . . 0.547 ' HA3' ' NE1' ' A' ' 77' ' ' TRP . . . -98.98 151.51 19.5 Favored Glycine 0 N--CA 1.453 -0.199 0 N-CA-C 109.691 -1.363 . . . . 0.0 109.691 178.615 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 85' ' ' PHE . . . . . 0.583 ' CB ' HD12 ' A' ' 73' ' ' ILE . 46.5 m-85 -145.97 136.77 24.35 Favored 'General case' 0 C--N 1.32 -0.702 0 C-N-CA 120.655 -0.418 . . . . 0.0 110.46 -179.716 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -104.06 127.28 51.63 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.411 -0.588 . . . . 0.0 109.411 179.822 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 43.3 t -77.55 128.31 33.96 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.071 0.462 . . . . 0.0 111.21 -179.065 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -103.98 -27.37 12.19 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.191 179.962 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 89' ' ' HIS . . . . . 0.601 ' ND1' ' N ' ' A' ' 90' ' ' ILE . 0.0 OUTLIER -159.67 140.74 12.55 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.063 0.458 . . . . 0.0 110.281 179.484 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.601 ' N ' ' ND1' ' A' ' 89' ' ' HIS . 8.8 tt -146.06 141.15 21.52 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 115.741 -0.663 . . . . 0.0 109.817 -179.942 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -53.71 140.41 29.61 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.086 -0.961 . . . . 0.0 112.242 -178.004 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 6.4 tt -54.63 -42.22 70.97 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.148 -0.933 . . . . 0.0 109.847 179.822 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -68.27 -36.73 79.84 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 179.225 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 94' ' ' SER . . . . . 0.472 ' CB ' HG23 ' A' ' 69' ' ' ILE . 4.1 m -67.59 -36.4 80.81 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.595 -0.729 . . . . 0.0 109.738 179.146 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 95' ' ' ILE . . . . . 0.441 HG12 HG23 ' A' ' 90' ' ' ILE . 1.0 OUTLIER -58.66 -38.55 72.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.757 -0.656 . . . . 0.0 109.936 179.284 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -70.9 -38.48 72.99 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.281 -0.568 . . . . 0.0 111.281 -178.735 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 97' ' ' HIS . . . . . 0.479 ' O ' HD22 ' A' ' 101' ' ' LEU . 60.4 m-70 -63.38 -43.03 98.76 Favored 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 118.929 -1.108 . . . . 0.0 108.821 179.456 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.438 ' O ' HG23 ' A' ' 102' ' ' VAL . 4.1 mp -59.93 -33.97 72.61 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 110.03 -0.359 . . . . 0.0 110.03 178.193 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 5.9 mtp85 -62.42 -36.9 83.84 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 120.181 -0.607 . . . . 0.0 109.731 178.966 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 15.5 mmm180 -59.17 -51.35 70.38 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.057 179.479 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.479 HD22 ' O ' ' A' ' 97' ' ' HIS . 0.2 OUTLIER -59.38 -34.65 72.68 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.494 -179.843 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 102' ' ' VAL . . . . . 0.438 HG23 ' O ' ' A' ' 98' ' ' LEU . 69.8 t -68.78 -44.84 81.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.698 179.224 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -63.14 -47.38 82.95 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.55 -179.081 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 6.6 mp -63.98 -40.05 95.51 Favored 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 120.545 -0.462 . . . . 0.0 110.675 -179.558 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -57.41 -47.71 81.04 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.887 -0.325 . . . . 0.0 110.504 -179.683 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 90.0 mt -66.78 -27.41 67.56 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.47 179.956 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 101.38 -72.43 0.37 Allowed Glycine 0 CA--C 1.526 0.737 0 N-CA-C 110.99 -0.844 . . . . 0.0 110.99 179.749 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 51.1 m-20 -159.8 69.49 0.42 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.803 0.335 . . . . 0.0 110.577 -179.892 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -121.48 -174.62 2.9 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.362 179.843 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 19.7 mt-10 -77.05 -133.41 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.475 179.969 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -130.1 -174.92 3.46 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.923 0.392 . . . . 0.0 110.443 -179.804 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 2.5 tp 64.53 1.96 1.47 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.031 -0.532 . . . . 0.0 110.831 179.87 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 113' ' ' GLU . . . . . 0.555 ' O ' ' C ' ' A' ' 114' ' ' ARG . 4.2 mp0 41.75 -129.21 0.55 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.408 -179.877 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 114' ' ' ARG . . . . . 0.555 ' C ' ' O ' ' A' ' 113' ' ' GLU . 63.3 mtm-85 14.69 103.66 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.486 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.752 179.691 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 115' ' ' GLU . . . . . 0.592 ' H ' HD12 ' A' ' 118' ' ' LEU . 10.4 tt0 -164.61 142.7 6.71 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.228 0.537 . . . . 0.0 111.274 179.921 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 4.5 tt -54.02 -34.85 61.05 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.475 -0.784 . . . . 0.0 111.013 179.617 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 117' ' ' ALA . . . . . 0.61 ' O ' HG23 ' A' ' 120' ' ' VAL . . . -68.82 -23.25 64.24 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.015 -0.539 . . . . 0.0 112.217 179.839 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.592 HD12 ' H ' ' A' ' 115' ' ' GLU . 37.8 mt -54.22 -43.1 70.52 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 119.783 -0.767 . . . . 0.0 110.723 -177.672 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 119' ' ' LEU . . . . . 0.528 ' C ' ' H ' ' A' ' 121' ' ' SER . 7.2 mp -55.6 -16.69 4.32 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.085 -0.646 . . . . 0.0 110.23 -178.304 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 120' ' ' VAL . . . . . 0.626 ' O ' HG12 ' A' ' 120' ' ' VAL . 76.1 t -57.14 -2.55 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-O 120.908 0.385 . . . . 0.0 110.64 179.584 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 121' ' ' SER . . . . . 0.528 ' H ' ' C ' ' A' ' 119' ' ' LEU . 32.5 p -101.43 -35.3 9.24 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.739 -178.969 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 122' ' ' ALA . . . . . 0.809 ' O ' ' O ' ' A' ' 123' ' ' HIS . . . -123.29 -83.58 0.65 Allowed 'General case' 0 N--CA 1.464 0.258 0 C-N-CA 120.953 -0.299 . . . . 0.0 111.794 -179.027 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 123' ' ' HIS . . . . . 0.809 ' O ' ' O ' ' A' ' 122' ' ' ALA . 0.0 OUTLIER 36.36 167.27 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.516 0.674 . . . . 0.0 111.882 -179.885 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 124' ' ' ASP . . . . . 0.588 ' N ' ' CG ' ' A' ' 123' ' ' HIS . 2.7 p30 -162.77 -35.61 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.342 179.948 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 125' ' ' ASP . . . . . 0.516 ' C ' ' O ' ' A' ' 124' ' ' ASP . 34.6 t70 . . . . . 0 C--O 1.22 -0.465 0 CA-C-O 117.916 -1.04 . . . . 0.0 111.437 179.627 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 501' ' ' C2E . . . . . 0.931 ' O21' " H4'" ' A' ' 501' ' ' C2E . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 502' ' ' C2E . . . . . 0.672 ' C61' ' H ' ' A' ' 8' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 60.4 mtp . . . . . 0 N--CA 1.489 1.495 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 45.8 t -162.87 -37.83 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.671 -180.0 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 35.5 p-10 -95.22 62.32 2.49 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.682 -179.911 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.627 ' O ' ' CG ' ' A' ' 5' ' ' HIS . 8.4 mp0 -69.83 -35.35 74.7 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.764 0.792 . . . . 0.0 111.13 -178.079 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 5' ' ' HIS . . . . . 0.627 ' CG ' ' O ' ' A' ' 4' ' ' GLN . 0.4 OUTLIER 148.68 19.42 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 113.879 -1.51 . . . . 0.0 107.699 -178.263 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 6' ' ' ASP . . . . . 0.647 ' O ' ' CZ ' ' A' ' 8' ' ' ARG . 10.2 m-20 56.82 65.07 1.48 Allowed 'General case' 0 N--CA 1.454 -0.226 0 CA-C-N 115.246 -0.888 . . . . 0.0 108.71 -178.257 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -81.94 132.45 35.27 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.55 -0.75 . . . . 0.0 111.112 -178.754 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.656 ' NH2' ' N11' ' A' ' 501' ' ' C2E . 0.0 OUTLIER -122.73 -8.31 8.46 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-N 115.509 -0.768 . . . . 0.0 110.956 -179.797 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.593 ' O ' ' N ' ' A' ' 11' ' ' PHE . 1.3 ptt85 -102.56 105.49 16.01 Favored 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 120.856 -0.338 . . . . 0.0 110.131 179.752 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.745 HH21 ' P11' ' A' ' 501' ' ' C2E . 0.0 OUTLIER -1.66 -65.96 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 115.367 -0.833 . . . . 0.0 111.995 -179.591 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 11' ' ' PHE . . . . . 0.702 ' CE2' ' CE1' ' A' ' 12' ' ' HIS . 0.1 OUTLIER -141.85 170.03 16.49 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-O 120.847 0.356 . . . . 0.0 110.494 -179.581 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 12' ' ' HIS . . . . . 0.702 ' CE1' ' CE2' ' A' ' 11' ' ' PHE . 0.0 OUTLIER -58.08 162.72 3.24 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.352 -179.99 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.588 HH21 ' CG ' ' A' ' 35' ' ' ASP . 0.9 OUTLIER -114.59 161.45 18.05 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 120.889 0.376 . . . . 0.0 110.691 -179.836 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.612 HG23 ' OD1' ' A' ' 105' ' ' ASN . 20.5 mm -72.87 93.64 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.152 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.53 179.73 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -95.25 119.72 34.24 Favored 'General case' 0 C--N 1.331 -0.225 0 C-N-CA 120.157 -0.617 . . . . 0.0 111.694 -179.744 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 6.2 p90 -150.36 159.03 44.75 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 114.876 -1.057 . . . . 0.0 108.201 177.206 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -94.99 146.47 24.23 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 119.935 -0.706 . . . . 0.0 111.176 -178.503 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -178.23 175.86 1.16 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.867 -0.606 . . . . 0.0 109.964 179.646 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -96.22 134.79 38.89 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.083 -179.615 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.58 ' O ' ' O ' ' A' ' 31' ' ' VAL . 11.4 p -134.87 154.07 51.8 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.035 0.445 . . . . 0.0 110.428 178.861 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -133.94 142.61 47.77 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 108.904 -0.776 . . . . 0.0 108.904 179.419 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 53.3 mt -122.61 136.8 58.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-O 121.429 0.633 . . . . 0.0 111.108 -179.541 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.676 ' H ' HD12 ' A' ' 23' ' ' LEU . 0.0 OUTLIER -121.94 123.81 42.56 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.133 -0.94 . . . . 0.0 110.949 -179.158 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.7 ' NE2' ' CE2' ' A' ' 57' ' ' PHE . 2.5 tt0 -126.77 131.2 51.35 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 107.876 -1.157 . . . . 0.0 107.876 178.339 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 47.47 -120.5 5.75 Favored Glycine 0 CA--C 1.528 0.876 0 N-CA-C 110.451 -1.06 . . . . 0.0 110.451 -179.234 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -105.08 13.21 31.18 Favored 'General case' 0 N--CA 1.463 0.225 0 N-CA-C 111.637 0.236 . . . . 0.0 111.637 -179.503 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.618 ' HB3' ' CZ2' ' A' ' 29' ' ' TRP . 2.6 mpt_? -111.95 133.1 54.35 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 -179.023 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.473 ' HG3' ' N ' ' A' ' 29' ' ' TRP . 0.0 OUTLIER -125.18 145.04 50.15 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.02 -0.536 . . . . 0.0 109.799 179.261 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.618 ' CZ2' ' HB3' ' A' ' 27' ' ' ARG . 6.3 m-90 -145.52 156.53 43.77 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.364 -0.835 . . . . 0.0 110.705 -179.03 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 16.4 mt-10 -100.6 137.94 38.34 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 178.773 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.58 ' O ' ' O ' ' A' ' 20' ' ' SER . 26.3 m -147.74 159.05 8.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-O 121.199 0.523 . . . . 0.0 111.287 -179.548 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.872 ' H ' HD23 ' A' ' 32' ' ' LEU . 1.4 pt? -98.38 130.04 45.03 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 108.79 -0.818 . . . . 0.0 108.79 178.652 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -93.31 126.58 38.5 Favored 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 120.179 -0.608 . . . . 0.0 109.661 -179.762 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 76.1 m-70 -91.82 -26.14 18.66 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.366 -0.834 . . . . 0.0 111.959 -178.31 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.588 ' CG ' HH21 ' A' ' 13' ' ' ARG . 2.9 p30 -174.01 161.03 3.6 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 119.38 -0.928 . . . . 0.0 111.354 177.443 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.526 HG22 ' H ' ' A' ' 37' ' ' SER . 3.4 p -144.22 168.74 10.39 Favored 'Isoleucine or valine' 0 C--O 1.232 0.135 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.987 -179.128 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.526 ' H ' HG22 ' A' ' 36' ' ' VAL . 6.3 t -142.2 168.42 19.79 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 107.621 -1.251 . . . . 0.0 107.621 178.659 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.586 ' CD1' ' ND1' ' A' ' 39' ' ' HIS . 0.3 OUTLIER -63.81 1.02 0.69 Allowed 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 119.216 -0.994 . . . . 0.0 110.549 -179.625 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 39' ' ' HIS . . . . . 0.586 ' ND1' ' CD1' ' A' ' 38' ' ' LEU . 21.9 p-80 -166.53 44.51 0.06 Allowed 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 120.718 -0.393 . . . . 0.0 111.226 179.35 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -176.97 152.04 11.81 Favored Glycine 0 CA--C 1.526 0.719 0 N-CA-C 111.012 -0.835 . . . . 0.0 111.012 179.68 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -148.01 149.01 15.69 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.259 0 CA-C-O 121.545 0.688 . . . . 0.0 111.581 -179.337 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -121.34 135.04 55.14 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 114.873 -1.058 . . . . 0.0 108.191 178.488 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 20.2 m -140.61 174.71 7.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 C-N-CA 120.261 -0.576 . . . . 0.0 111.826 -178.887 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -97.41 143.99 17.05 Favored Glycine 0 CA--C 1.526 0.746 0 N-CA-C 109.497 -1.441 . . . . 0.0 109.497 178.305 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' GLN . . . . . 0.54 ' O ' ' CD ' ' A' ' 45' ' ' GLN . 0.0 OUTLIER -86.58 115.91 64.02 Favored Pre-proline 0 CA--C 1.533 0.327 0 CA-C-N 117.74 0.77 . . . . 0.0 111.729 -178.569 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 89.7 Cg_endo -84.62 161.14 12.49 Favored 'Trans proline' 0 C--N 1.308 -1.557 0 C-N-CA 121.42 1.414 . . . . 0.0 111.262 179.003 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.2 pt20 -65.3 -38.34 89.9 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 112.437 0.532 . . . . 0.0 112.437 -178.745 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.594 ' O ' ' NE1' ' A' ' 29' ' ' TRP . 1.3 m-20 -74.66 8.36 2.42 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 111.87 0.322 . . . . 0.0 111.87 -178.647 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 49' ' ' TRP . . . . . 0.463 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 65.4 t-105 -58.57 67.98 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 112.03 0.382 . . . . 0.0 112.03 -179.534 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 50' ' ' ASN . . . . . 0.561 ' N ' ' O ' ' A' ' 48' ' ' ASP . 32.2 t-20 -93.22 78.73 4.51 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 120.086 -0.646 . . . . 0.0 109.585 178.484 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -146.15 143.75 11.98 Favored Glycine 0 CA--C 1.526 0.733 0 N-CA-C 111.242 -0.743 . . . . 0.0 111.242 -179.492 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -77.46 122.22 85.62 Favored Pre-proline 0 CA--C 1.536 0.43 0 CA-C-N 115.77 -0.215 . . . . 0.0 110.939 -179.813 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 12.7 Cg_endo -58.35 -22.69 59.43 Favored 'Trans proline' 0 N--CA 1.496 1.654 0 C-N-CA 122.698 2.266 . . . . 0.0 112.362 -179.441 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 22.2 mp0 -78.77 -23.86 45.04 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.337 -0.545 . . . . 0.0 111.69 -179.183 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.522 ' O ' ' CE1' ' A' ' 57' ' ' PHE . 42.2 mtt180 -91.1 155.41 44.77 Favored Pre-proline 0 N--CA 1.463 0.201 0 C-N-CA 120.471 -0.492 . . . . 0.0 109.921 179.772 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 56' ' ' PRO . . . . . 0.544 ' O ' ' NE2' ' A' ' 24' ' ' GLN . 44.6 Cg_endo -67.81 160.59 47.63 Favored 'Trans proline' 0 C--N 1.308 -1.601 0 C-N-CA 122.762 2.308 . . . . 0.0 113.243 -178.846 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.7 ' CE2' ' NE2' ' A' ' 24' ' ' GLN . 51.5 m-85 -130.64 156.54 44.72 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 114.935 -1.029 . . . . 0.0 108.953 179.433 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.532 ' O ' HD12 ' A' ' 23' ' ' LEU . 19.5 mt-10 -121.95 135.07 54.84 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 108.852 -0.796 . . . . 0.0 108.852 178.466 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 59' ' ' ALA . . . . . 0.636 ' HB2' HD13 ' A' ' 73' ' ' ILE . . . -116.49 136.92 52.58 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.088 0.47 . . . . 0.0 111.56 -178.431 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 7.0 mtt180 -123.65 127.77 48.7 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 108.538 -0.912 . . . . 0.0 108.538 177.848 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 6.6 mt -107.07 144.82 33.19 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.593 -0.443 . . . . 0.0 110.54 -179.184 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' TYR . . . . . 0.517 ' N ' ' CD1' ' A' ' 62' ' ' TYR . 6.5 m-85 -128.58 110.3 12.13 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.719 179.899 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.506 HD21 HD11 ' A' ' 101' ' ' LEU . 9.1 mp -105.57 -91.15 0.4 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.257 179.294 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -68.84 178.8 24.35 Favored Glycine 0 CA--C 1.521 0.461 0 N-CA-C 109.484 -1.446 . . . . 0.0 109.484 178.689 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.627 ' C ' HD12 ' A' ' 65' ' ' LEU . 0.9 OUTLIER -74.0 -31.4 62.94 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.015 -0.674 . . . . 0.0 110.122 -179.893 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.416 ' O ' ' OD1' ' A' ' 66' ' ' ASP . 37.5 t0 -103.39 9.23 37.94 Favored 'General case' 0 C--N 1.333 -0.141 0 C-N-CA 122.663 0.385 . . . . 0.0 111.272 -179.802 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.549 ' O ' HG12 ' A' ' 67' ' ' VAL . 16.4 t -104.08 95.26 3.68 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.3 0 CA-C-O 121.4 0.619 . . . . 0.0 111.761 -178.876 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.491 HD12 ' N ' ' A' ' 69' ' ' ILE . 3.7 tp -111.51 117.19 32.32 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 107.859 -1.163 . . . . 0.0 107.859 178.128 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.609 HG23 ' OG ' ' A' ' 94' ' ' SER . 5.1 mt -114.37 144.12 22.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-O 120.959 0.409 . . . . 0.0 111.086 -178.812 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.416 HH11 ' HD3' ' A' ' 70' ' ' ARG . 4.1 ptt180 -128.28 130.6 48.1 Favored 'General case' 0 C--O 1.238 0.48 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.828 179.189 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 71' ' ' MET . . . . . 0.784 ' SD ' HD12 ' A' ' 90' ' ' ILE . 1.2 mtm -140.01 147.47 40.44 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.66 -0.7 . . . . 0.0 109.622 179.583 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -99.68 132.59 44.92 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 107.627 -1.249 . . . . 0.0 107.627 178.529 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.636 HD13 ' HB2' ' A' ' 59' ' ' ALA . 13.1 pt -142.0 157.21 20.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 C-N-CA 119.109 -1.036 . . . . 0.0 113.132 -177.467 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 2.7 p -123.65 155.48 37.67 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 114.983 -1.008 . . . . 0.0 110.021 179.219 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.49 HD12 ' CE1' ' A' ' 85' ' ' PHE . 5.6 tp -66.01 119.45 11.38 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.0 0.429 . . . . 0.0 110.802 -179.699 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -97.22 -41.05 8.48 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.342 177.796 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 77' ' ' TRP . . . . . 0.576 ' NE1' ' HA3' ' A' ' 84' ' ' GLY . 67.8 p-90 -171.0 170.73 6.13 Favored 'General case' 0 N--CA 1.466 0.375 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.051 -179.782 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -151.28 124.11 8.58 Favored 'General case' 0 N--CA 1.465 0.289 0 N-CA-C 110.197 -0.298 . . . . 0.0 110.197 178.89 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 1.2 ttp180 -152.37 134.07 14.69 Favored 'General case' 0 CA--C 1.533 0.326 0 N-CA-C 113.148 0.796 . . . . 0.0 113.148 179.795 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 57.11 47.41 17.34 Favored 'General case' 0 N--CA 1.463 0.225 0 N-CA-C 114.124 1.157 . . . . 0.0 114.124 176.434 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 84.55 -28.64 4.28 Favored Glycine 0 CA--C 1.523 0.571 0 C-N-CA 120.382 -0.913 . . . . 0.0 113.157 177.184 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 6.4 mt -89.5 157.81 17.94 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 117.574 0.687 . . . . 0.0 110.57 -178.927 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.442 HD11 ' CB ' ' A' ' 45' ' ' GLN . 38.0 mt -128.74 135.25 48.94 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.833 -0.622 . . . . 0.0 111.016 -179.397 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 84' ' ' GLY . . . . . 0.576 ' HA3' ' NE1' ' A' ' 77' ' ' TRP . . . -95.04 152.1 20.32 Favored Glycine 0 N--CA 1.45 -0.392 0 N-CA-C 109.471 -1.451 . . . . 0.0 109.471 178.544 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 85' ' ' PHE . . . . . 0.49 ' CE1' HD12 ' A' ' 75' ' ' LEU . 22.5 m-85 -145.74 132.44 19.96 Favored 'General case' 0 C--N 1.32 -0.716 0 C-N-CA 120.641 -0.424 . . . . 0.0 110.675 -179.247 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.412 ' O ' ' CG ' ' A' ' 86' ' ' GLU . 7.4 pt-20 -104.02 127.45 51.58 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 179.67 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 1.8 t -74.8 125.69 29.33 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.16 0.505 . . . . 0.0 111.824 -178.685 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 1.5 pt20 -100.79 -29.22 12.38 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.162 179.327 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' HIS . . . . . 0.622 ' ND1' ' N ' ' A' ' 90' ' ' ILE . 0.0 OUTLIER -160.39 141.18 11.9 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.958 0.409 . . . . 0.0 110.143 179.512 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.784 HD12 ' SD ' ' A' ' 71' ' ' MET . 6.5 tt -145.65 140.71 22.02 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.096 -179.23 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -56.33 139.64 47.77 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 115.21 -0.905 . . . . 0.0 112.373 -178.079 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 5.5 tp -54.29 -42.29 69.88 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 115.145 -0.934 . . . . 0.0 110.431 -180.0 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 25.6 t0 -69.06 -37.76 78.69 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 179.277 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 94' ' ' SER . . . . . 0.609 ' OG ' HG23 ' A' ' 69' ' ' ILE . 1.2 t -68.54 -35.19 77.1 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.639 179.183 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 95' ' ' ILE . . . . . 0.445 ' CG1' HG23 ' A' ' 90' ' ' ILE . 20.3 mt -58.64 -37.27 64.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.771 179.233 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -70.33 -40.71 73.97 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 120.278 -0.569 . . . . 0.0 110.669 -178.999 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 61.6 m-70 -61.81 -36.08 80.07 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 119.499 -0.88 . . . . 0.0 109.149 179.454 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -67.62 -34.21 76.52 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.16 -0.473 . . . . 0.0 109.775 178.012 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -66.31 -37.92 86.52 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 109.5 -0.556 . . . . 0.0 109.5 178.846 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 71.7 mtt180 -56.43 -37.92 70.89 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.277 178.389 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.506 HD11 HD21 ' A' ' 63' ' ' LEU . 4.4 mt -69.99 -47.27 62.9 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.237 -179.547 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 51.6 t -60.67 -41.2 87.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.729 -179.831 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -63.44 -48.48 77.58 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.969 -179.756 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 39.1 mt -65.48 -41.79 92.92 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.389 -0.368 . . . . 0.0 110.814 -179.578 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 105' ' ' ASN . . . . . 0.612 ' OD1' HG23 ' A' ' 14' ' ' ILE . 0.5 OUTLIER -60.83 -31.77 71.18 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 120.703 -0.399 . . . . 0.0 110.184 -179.903 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -55.96 -18.78 10.07 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.29 -0.413 . . . . 0.0 109.994 179.72 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 107' ' ' GLY . . . . . 0.47 ' O ' ' O ' ' A' ' 108' ' ' ASP . . . -113.37 -41.58 0.95 Allowed Glycine 0 CA--C 1.526 0.745 0 N-CA-C 111.056 -0.817 . . . . 0.0 111.056 179.971 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 108' ' ' ASP . . . . . 0.47 ' O ' ' O ' ' A' ' 107' ' ' GLY . 2.2 m-20 -58.63 -142.36 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.821 0.343 . . . . 0.0 110.575 -179.893 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 109' ' ' GLU . . . . . 0.487 ' O ' ' CD1' ' A' ' 112' ' ' LEU . 48.8 tt0 56.01 105.08 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.355 -179.932 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -87.98 43.32 1.11 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.861 -179.751 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 4.5 mp -141.66 30.79 1.67 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.512 179.777 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.487 ' CD1' ' O ' ' A' ' 109' ' ' GLU . 11.1 mp -48.34 101.2 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.87 0.367 . . . . 0.0 110.369 -179.942 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 52.0 mm-40 -140.47 -45.61 0.41 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.383 -179.975 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 114' ' ' ARG . . . . . 0.525 ' HG2' ' CE1' ' A' ' 12' ' ' HIS . 1.0 OUTLIER -42.27 143.17 0.65 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.028 179.896 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 115' ' ' GLU . . . . . 0.615 ' H ' HD12 ' A' ' 118' ' ' LEU . 0.4 OUTLIER -78.02 148.11 34.52 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.245 0.545 . . . . 0.0 111.182 -179.393 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.774 ' N ' HD22 ' A' ' 116' ' ' LEU . 2.6 mm? -67.04 -38.89 86.69 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.241 -0.89 . . . . 0.0 111.035 179.605 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 117' ' ' ALA . . . . . 0.63 ' O ' HG23 ' A' ' 120' ' ' VAL . . . -68.34 -22.12 64.71 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.119 -0.491 . . . . 0.0 112.004 -179.206 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.615 HD12 ' H ' ' A' ' 115' ' ' GLU . 37.0 mt -53.06 -31.58 42.39 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 120.641 -0.423 . . . . 0.0 110.883 -178.362 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 15.0 mt -58.14 -27.7 64.01 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 178.832 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 120' ' ' VAL . . . . . 0.63 HG23 ' O ' ' A' ' 117' ' ' ALA . 43.7 t -58.67 -45.83 90.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 115.326 -0.852 . . . . 0.0 111.909 179.732 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 3.0 t -72.94 -12.11 60.83 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 112.991 0.737 . . . . 0.0 112.991 -177.817 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -104.74 -4.74 22.0 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 120.179 -0.609 . . . . 0.0 111.958 -179.016 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 123' ' ' HIS . . . . . 0.651 ' ND1' ' O ' ' A' ' 123' ' ' HIS . 5.8 p80 -173.37 28.6 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.534 -0.466 . . . . 0.0 111.051 179.651 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 124' ' ' ASP . . . . . 0.502 ' C ' ' O ' ' A' ' 123' ' ' HIS . 35.2 t0 -24.91 82.77 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.348 0 N-CA-C 111.967 0.358 . . . . 0.0 111.967 -178.878 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 125' ' ' ASP . . . . . 0.623 ' N ' ' O ' ' A' ' 123' ' ' HIS . 0.9 OUTLIER . . . . . 0 C--O 1.22 -0.483 0 CA-C-O 118.04 -0.981 . . . . 0.0 110.389 179.675 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 501' ' ' C2E . . . . . 0.745 ' P11' HH21 ' A' ' 10' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 502' ' ' C2E . . . . . 0.546 ' C21' ' NH1' ' A' ' 9' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.524 ' C ' HE21 ' A' ' 4' ' ' GLN . 66.6 mmm . . . . . 0 N--CA 1.491 1.575 0 N-CA-C 109.449 -0.575 . . . . 0.0 109.449 . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.555 ' O ' ' NE2' ' A' ' 4' ' ' GLN . 1.9 t 75.66 -132.65 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.81 -179.972 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -100.75 63.22 1.04 Allowed 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 121.179 0.514 . . . . 0.0 109.935 177.766 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.819 ' H ' ' CD ' ' A' ' 4' ' ' GLN . 0.0 OUTLIER -81.25 11.91 3.94 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.274 -0.875 . . . . 0.0 111.916 -179.189 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 5' ' ' HIS . . . . . 0.522 ' HB2' ' O ' ' A' ' 4' ' ' GLN . 0.3 OUTLIER 79.01 15.17 1.07 Allowed 'General case' 0 C--N 1.33 -0.279 0 O-C-N 123.285 0.366 . . . . 0.0 111.771 179.345 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 6' ' ' ASP . . . . . 0.489 ' O ' ' CZ ' ' A' ' 8' ' ' ARG . 75.4 m-20 -49.57 138.77 13.37 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 108.852 -0.796 . . . . 0.0 108.852 179.388 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.455 ' C ' ' CD ' ' A' ' 7' ' ' GLU . 0.4 OUTLIER -79.53 133.08 36.47 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 120.122 -0.631 . . . . 0.0 111.157 -178.841 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.648 HH21 ' C21' ' A' ' 501' ' ' C2E . 0.0 OUTLIER -123.46 -6.3 8.16 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-N 115.747 -0.66 . . . . 0.0 111.079 -179.502 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.536 ' O ' ' C ' ' A' ' 10' ' ' ARG . 1.0 OUTLIER -110.81 94.87 5.22 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 120.944 0.402 . . . . 0.0 110.068 179.532 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.536 ' C ' ' O ' ' A' ' 9' ' ' ARG . 0.0 OUTLIER 18.27 -84.72 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.475 0 CA-C-N 115.399 -0.819 . . . . 0.0 111.346 -179.649 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 11' ' ' PHE . . . . . 0.534 ' N ' ' O ' ' A' ' 9' ' ' ARG . 0.1 OUTLIER -138.49 160.76 38.75 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 110.124 -0.324 . . . . 0.0 110.124 179.914 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 5.9 p80 -39.04 153.68 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.955 0.407 . . . . 0.0 110.829 -179.734 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.569 ' NH1' ' N1 ' ' A' ' 501' ' ' C2E . 0.4 OUTLIER -108.65 149.04 29.5 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.224 -179.911 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.635 ' N ' HD12 ' A' ' 14' ' ' ILE . 1.8 mp -54.56 96.27 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-O 121.008 0.432 . . . . 0.0 110.21 179.862 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -94.91 120.57 35.35 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.954 -179.834 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.453 ' HE2' HD23 ' A' ' 63' ' ' LEU . 0.4 OUTLIER -149.48 153.43 37.23 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.058 -0.974 . . . . 0.0 108.453 178.399 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -95.36 149.64 21.15 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 120.299 -0.56 . . . . 0.0 111.149 -178.503 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . 178.39 178.78 0.38 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.802 -0.635 . . . . 0.0 109.99 179.626 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -96.36 134.71 39.16 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.892 -179.941 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.67 ' O ' ' O ' ' A' ' 31' ' ' VAL . 5.8 p -136.5 159.03 43.02 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.34 179.169 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.414 ' C ' ' OE1' ' A' ' 21' ' ' GLU . 0.5 OUTLIER -146.71 146.23 30.26 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 178.674 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.516 ' CD1' HD11 ' A' ' 73' ' ' ILE . 1.1 mm -120.37 136.47 57.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-O 121.208 0.528 . . . . 0.0 111.645 -178.091 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.51 ' H ' HD12 ' A' ' 23' ' ' LEU . 0.2 OUTLIER -121.25 123.11 41.42 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.836 -179.902 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.725 ' NE2' ' CE2' ' A' ' 57' ' ' PHE . 12.2 tt0 -130.39 102.27 6.11 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.303 -0.862 . . . . 0.0 109.775 179.028 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 79.89 -126.51 7.48 Favored Glycine 0 CA--C 1.525 0.657 0 N-CA-C 110.053 -1.219 . . . . 0.0 110.053 -179.022 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.4 pm0 -100.61 10.89 40.58 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.816 0.341 . . . . 0.0 110.213 179.444 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.576 ' HB3' ' CZ2' ' A' ' 29' ' ' TRP . 6.5 mtt180 -112.56 133.82 54.4 Favored 'General case' 0 CA--C 1.52 -0.175 0 N-CA-C 112.228 0.455 . . . . 0.0 112.228 -178.758 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 74.7 ttt180 -128.02 149.2 50.47 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.182 179.417 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.576 ' CZ2' ' HB3' ' A' ' 27' ' ' ARG . 6.7 m-90 -147.15 155.54 42.22 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.246 -179.079 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.559 ' H ' ' CD ' ' A' ' 30' ' ' GLU . 3.0 mp0 -101.5 137.89 39.23 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 179.566 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.67 ' O ' ' O ' ' A' ' 20' ' ' SER . 19.2 m -146.71 157.45 10.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 121.261 0.553 . . . . 0.0 111.16 -179.768 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 1.014 ' H ' HD23 ' A' ' 32' ' ' LEU . 1.6 pt? -96.17 130.27 43.27 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 108.614 -0.884 . . . . 0.0 108.614 178.363 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.518 HD13 HD21 ' A' ' 61' ' ' LEU . 1.7 tt -91.47 125.97 36.39 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.241 0.543 . . . . 0.0 110.088 -179.329 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 75.2 m-70 -91.85 -28.57 17.24 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.225 -0.898 . . . . 0.0 111.86 -178.5 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 2.0 p30 -173.39 162.99 4.42 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 119.412 -0.915 . . . . 0.0 111.461 177.632 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.521 HG22 ' N ' ' A' ' 37' ' ' SER . 7.3 p -145.48 168.01 8.65 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.084 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.777 -179.193 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.521 ' N ' HG22 ' A' ' 36' ' ' VAL . 6.5 t -141.78 170.39 15.81 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 107.907 -1.145 . . . . 0.0 107.907 179.042 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -66.11 -0.62 2.55 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 119.488 -0.885 . . . . 0.0 110.832 -178.909 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 39' ' ' HIS . . . . . 0.43 ' NE2' ' O ' ' A' ' 87' ' ' CYS . 3.0 t60 -163.09 40.03 0.1 Allowed 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 120.682 -0.407 . . . . 0.0 111.128 179.713 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -175.05 155.38 20.46 Favored Glycine 0 CA--C 1.526 0.749 0 N-CA-C 111.144 -0.782 . . . . 0.0 111.144 179.849 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -148.2 148.94 15.69 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.204 0 CA-C-O 121.359 0.599 . . . . 0.0 111.375 -179.17 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -122.09 137.33 54.85 Favored 'General case' 0 N--CA 1.462 0.134 0 CA-C-N 115.133 -0.94 . . . . 0.0 108.642 178.932 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 19.8 m -141.39 174.88 6.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 C-N-CA 120.27 -0.572 . . . . 0.0 111.788 -179.181 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -96.58 145.25 17.75 Favored Glycine 0 CA--C 1.529 0.968 0 N-CA-C 109.572 -1.411 . . . . 0.0 109.572 178.257 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.4 tm0? -87.34 114.18 57.45 Favored Pre-proline 0 N--CA 1.465 0.283 0 CA-C-N 117.877 0.839 . . . . 0.0 111.947 -178.518 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 94.3 Cg_endo -85.26 161.42 11.34 Favored 'Trans proline' 0 C--N 1.309 -1.524 0 C-N-CA 121.714 1.609 . . . . 0.0 111.723 179.082 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.403 ' HG2' ' H ' ' A' ' 48' ' ' ASP . 0.5 OUTLIER -65.57 -40.32 92.63 Favored 'General case' 0 CA--C 1.532 0.277 0 N-CA-C 112.439 0.533 . . . . 0.0 112.439 -179.081 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.531 ' O ' ' NE1' ' A' ' 29' ' ' TRP . 37.7 m-20 -72.85 8.06 1.7 Allowed 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 111.839 0.311 . . . . 0.0 111.839 -178.565 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 49' ' ' TRP . . . . . 0.448 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 60.3 t-105 -60.67 68.28 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.712 -179.58 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 50' ' ' ASN . . . . . 0.531 ' N ' ' O ' ' A' ' 48' ' ' ASP . 0.6 OUTLIER -93.22 78.78 4.51 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 120.207 -0.597 . . . . 0.0 109.572 178.643 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -141.45 159.54 26.77 Favored Glycine 0 CA--C 1.524 0.638 0 N-CA-C 111.31 -0.716 . . . . 0.0 111.31 -179.381 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 22.4 t0 -94.47 110.34 48.29 Favored Pre-proline 0 CA--C 1.533 0.291 0 CA-C-N 115.823 -0.189 . . . . 0.0 110.546 -179.98 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_exo -46.39 -22.72 1.76 Allowed 'Trans proline' 0 N--CA 1.495 1.579 0 C-N-CA 122.647 2.232 . . . . 0.0 112.393 -179.919 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 69.1 mt-30 -79.61 -24.05 42.24 Favored 'General case' 0 C--N 1.326 -0.444 0 C-N-CA 120.648 -0.421 . . . . 0.0 111.815 -178.751 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.578 ' O ' ' CE1' ' A' ' 57' ' ' PHE . 0.0 OUTLIER -93.55 150.72 39.32 Favored Pre-proline 0 C--N 1.329 -0.283 0 C-N-CA 120.531 -0.468 . . . . 0.0 110.166 179.941 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 56' ' ' PRO . . . . . 0.589 ' O ' ' NE2' ' A' ' 24' ' ' GLN . 35.9 Cg_endo -64.43 160.68 38.18 Favored 'Trans proline' 0 N--CA 1.495 1.582 0 C-N-CA 122.841 2.361 . . . . 0.0 113.421 -178.655 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.725 ' CE2' ' NE2' ' A' ' 24' ' ' GLN . 50.4 m-85 -131.22 157.02 44.34 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 114.845 -1.07 . . . . 0.0 109.134 179.594 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.411 ' O ' HD12 ' A' ' 23' ' ' LEU . 83.5 mt-10 -122.72 137.18 54.99 Favored 'General case' 0 N--CA 1.468 0.444 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 178.535 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -116.29 135.41 53.91 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.026 0.441 . . . . 0.0 111.894 -178.44 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.609 ' C ' HD12 ' A' ' 61' ' ' LEU . 39.2 mmt-85 -122.05 127.22 49.96 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 107.757 -1.201 . . . . 0.0 107.757 177.141 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.609 HD12 ' C ' ' A' ' 60' ' ' ARG . 9.0 mp -112.07 151.23 29.63 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.945 0.402 . . . . 0.0 111.21 -178.447 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 9.4 m-85 -131.32 108.45 9.66 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.447 179.471 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.543 ' C ' HD13 ' A' ' 63' ' ' LEU . 2.1 tm? -103.93 -84.58 0.47 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.65 -0.704 . . . . 0.0 109.232 179.521 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.434 ' H ' ' HB ' ' A' ' 67' ' ' VAL . . . -76.09 175.96 51.94 Favored Glycine 0 CA--C 1.521 0.438 0 N-CA-C 108.76 -1.736 . . . . 0.0 108.76 178.065 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 9.8 mt -72.5 -32.64 66.33 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 119.537 -0.865 . . . . 0.0 110.103 -179.557 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -102.84 9.53 38.88 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 122.912 0.485 . . . . 0.0 111.034 -179.842 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.55 ' O ' HG12 ' A' ' 67' ' ' VAL . 9.1 t -106.71 96.61 4.76 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.343 0 CA-C-O 121.4 0.619 . . . . 0.0 111.738 -179.108 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 6.4 tp -112.24 117.35 32.29 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 108.032 -1.099 . . . . 0.0 108.032 178.168 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.405 HG23 ' HB2' ' A' ' 94' ' ' SER . 5.7 mt -112.55 143.43 22.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.86 0.362 . . . . 0.0 111.222 -178.648 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.412 ' HD2' HH11 ' A' ' 70' ' ' ARG . 11.1 mtm180 -128.05 130.65 48.6 Favored 'General case' 0 C--O 1.238 0.463 0 CA-C-O 121.224 0.535 . . . . 0.0 111.346 179.715 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 2.4 mtp -140.28 148.56 41.62 Favored 'General case' 0 C--N 1.334 -0.1 0 CA-C-N 115.535 -0.757 . . . . 0.0 109.881 179.666 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 27.8 tt0 -106.51 125.54 51.12 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 107.793 -1.188 . . . . 0.0 107.793 177.997 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.592 HD12 ' CB ' ' A' ' 85' ' ' PHE . 9.9 pt -133.09 160.26 42.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 N-CA-C 113.279 0.844 . . . . 0.0 113.279 -176.945 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 37.6 m -121.67 151.87 39.98 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 114.564 -1.198 . . . . 0.0 109.357 178.763 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.588 HD12 ' CE1' ' A' ' 85' ' ' PHE . 6.3 tp -67.09 123.02 19.08 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.297 0.57 . . . . 0.0 110.5 -179.679 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -97.81 -41.84 7.86 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 115.146 -0.934 . . . . 0.0 110.667 178.241 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' TRP . . . . . 0.587 ' NE1' ' HA3' ' A' ' 84' ' ' GLY . 67.5 p-90 -170.51 168.64 7.66 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.356 -179.349 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -147.46 123.87 10.98 Favored 'General case' 0 N--CA 1.465 0.299 0 N-CA-C 109.95 -0.389 . . . . 0.0 109.95 178.67 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 38.6 ttt180 -152.3 133.76 14.52 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 119.944 -0.703 . . . . 0.0 112.826 179.931 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' ASP . . . . . 0.452 ' O ' ' OD1' ' A' ' 80' ' ' ASP . 33.4 t0 56.98 47.22 18.04 Favored 'General case' 0 N--CA 1.463 0.181 0 N-CA-C 113.951 1.093 . . . . 0.0 113.951 176.585 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 82.29 -27.42 3.62 Favored Glycine 0 CA--C 1.524 0.597 0 C-N-CA 120.397 -0.906 . . . . 0.0 113.162 177.28 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 6.9 mt -89.5 156.73 18.45 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 117.672 0.736 . . . . 0.0 110.447 -179.084 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 36.2 mt -128.88 135.51 49.17 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.202 -179.282 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' GLY . . . . . 0.587 ' HA3' ' NE1' ' A' ' 77' ' ' TRP . . . -96.18 153.19 20.46 Favored Glycine 0 N--CA 1.45 -0.424 0 N-CA-C 109.576 -1.409 . . . . 0.0 109.576 178.692 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 85' ' ' PHE . . . . . 0.592 ' CB ' HD12 ' A' ' 73' ' ' ILE . 26.6 m-85 -145.62 132.36 20.0 Favored 'General case' 0 C--N 1.317 -0.808 0 C-N-CA 120.792 -0.363 . . . . 0.0 110.733 -179.298 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.421 ' O ' ' CG ' ' A' ' 86' ' ' GLU . 6.5 pt-20 -103.66 126.21 50.66 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 108.632 -0.877 . . . . 0.0 108.632 179.059 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 87' ' ' CYS . . . . . 0.455 ' HA ' HG22 ' A' ' 73' ' ' ILE . 7.8 t -64.55 119.6 10.77 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 112.278 0.473 . . . . 0.0 112.278 -177.984 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 10.3 mm100 -89.32 -37.82 14.62 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.693 179.323 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 89' ' ' HIS . . . . . 0.412 ' ND1' ' N ' ' A' ' 90' ' ' ILE . 0.0 OUTLIER -164.66 144.85 7.55 Favored 'General case' 0 C--O 1.222 -0.375 0 CA-C-N 115.716 -0.674 . . . . 0.0 109.82 179.928 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.535 HG23 ' CG1' ' A' ' 95' ' ' ILE . 7.2 tt -143.81 140.45 25.47 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-O 121.407 0.623 . . . . 0.0 110.063 -179.814 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 91' ' ' ASP . . . . . 0.503 ' CB ' ' OG ' ' A' ' 94' ' ' SER . 0.2 OUTLIER -57.38 141.08 48.46 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 115.001 -1.0 . . . . 0.0 112.084 -178.001 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.48 ' HA ' HD12 ' A' ' 95' ' ' ILE . 3.2 tp -54.36 -42.06 69.85 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.254 -0.885 . . . . 0.0 110.403 -179.84 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -65.1 -42.94 93.55 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 179.295 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 94' ' ' SER . . . . . 0.503 ' OG ' ' CB ' ' A' ' 91' ' ' ASP . 1.1 p -66.86 -35.45 80.07 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.718 179.184 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 95' ' ' ILE . . . . . 0.535 ' CG1' HG23 ' A' ' 90' ' ' ILE . 31.3 mt -58.73 -38.33 71.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.248 179.769 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -69.79 -37.7 76.41 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 119.876 -0.73 . . . . 0.0 111.422 -177.945 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 60.3 m-70 -61.89 -35.67 79.03 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 119.567 -0.853 . . . . 0.0 109.578 179.767 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.653 ' O ' HG23 ' A' ' 102' ' ' VAL . 6.9 mp -62.11 -35.63 79.29 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 178.08 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.453 HH11 ' HD2' ' A' ' 99' ' ' ARG . 1.7 mmm180 -66.31 -39.75 89.49 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 119.847 -0.741 . . . . 0.0 109.008 178.177 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -61.8 -47.65 84.16 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.968 179.502 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.442 ' O ' ' OD1' ' A' ' 105' ' ' ASN . 4.1 mm? -61.91 -40.7 96.35 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.136 0.494 . . . . 0.0 110.124 -179.913 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 102' ' ' VAL . . . . . 0.653 HG23 ' O ' ' A' ' 98' ' ' LEU . 96.3 t -68.06 -47.41 78.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 115.618 -0.719 . . . . 0.0 111.594 -179.341 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 18.2 mm-40 -64.25 -43.06 96.06 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.436 -179.125 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 69.2 mt -66.16 -27.53 68.09 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.219 -178.981 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 105' ' ' ASN . . . . . 0.442 ' OD1' ' O ' ' A' ' 101' ' ' LEU . 13.1 m120 -59.46 -31.42 69.3 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 120.779 -0.368 . . . . 0.0 110.771 -179.766 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.499 HD22 ' N ' ' A' ' 106' ' ' LEU . 3.6 mm? -60.09 -18.7 48.89 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.492 179.888 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -70.12 1.11 19.64 Favored Glycine 0 CA--C 1.524 0.647 0 N-CA-C 110.429 -1.068 . . . . 0.0 110.429 179.899 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 108' ' ' ASP . . . . . 0.497 ' C ' ' H ' ' A' ' 110' ' ' GLU . 41.4 p30 -82.34 11.89 5.01 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.816 0.341 . . . . 0.0 110.582 -179.93 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 25.3 mm-40 -73.94 23.31 0.08 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.546 179.981 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 110' ' ' GLU . . . . . 0.497 ' H ' ' C ' ' A' ' 108' ' ' ASP . 66.4 mt-10 -67.14 -98.88 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.437 179.788 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 78.0 mt -140.86 78.39 1.65 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.303 179.903 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 21.2 tp -172.43 -85.55 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.721 -179.791 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 16.9 tt0 -50.79 152.01 2.24 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.912 -179.506 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 28.1 ptt180 -166.78 -176.55 3.51 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.445 179.729 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -79.32 -30.56 42.87 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.748 -179.842 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.495 ' O ' HG23 ' A' ' 120' ' ' VAL . 9.5 mp -54.51 -47.7 72.77 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.564 179.971 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -67.56 -51.94 44.71 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.477 179.676 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 95.0 mt -57.88 -49.35 77.01 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 112.802 0.668 . . . . 0.0 112.802 -177.53 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 119' ' ' LEU . . . . . 0.467 ' O ' ' N ' ' A' ' 123' ' ' HIS . 1.1 mt -72.9 -49.25 30.86 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 119.9 -0.72 . . . . 0.0 111.66 -178.709 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 120' ' ' VAL . . . . . 0.548 ' C ' ' H ' ' A' ' 122' ' ' ALA . 99.1 t -57.92 -15.8 5.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 C-N-CA 120.204 -0.598 . . . . 0.0 111.047 -177.467 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 121' ' ' SER . . . . . 0.702 ' O ' ' HB2' ' A' ' 122' ' ' ALA . 0.3 OUTLIER -70.79 21.27 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.42 179.051 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 122' ' ' ALA . . . . . 0.764 ' O ' ' O ' ' A' ' 123' ' ' HIS . . . 154.25 4.64 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.351 179.301 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 123' ' ' HIS . . . . . 0.764 ' O ' ' O ' ' A' ' 122' ' ' ALA . 0.0 OUTLIER -41.38 -131.72 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 121.148 0.499 . . . . 0.0 111.891 -179.19 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 124' ' ' ASP . . . . . 0.581 ' N ' ' CG ' ' A' ' 123' ' ' HIS . 42.0 t0 61.89 -26.78 0.05 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.881 -179.439 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 125' ' ' ASP . . . . . 0.666 ' H ' ' C ' ' A' ' 123' ' ' HIS . 15.5 m-20 . . . . . 0 C--O 1.22 -0.465 0 CA-C-O 118.019 -0.991 . . . . 0.0 110.87 -179.811 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 501' ' ' C2E . . . . . 0.648 ' C21' HH21 ' A' ' 8' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 502' ' ' C2E . . . . . 0.515 ' C4 ' ' CE2' ' A' ' 77' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.646 ' N ' HD12 ' A' ' 14' ' ' ILE . 1.8 mp . . . . . 0 CA--C 1.521 -0.161 0 CA-C-O 120.889 0.376 . . . . 0.0 110.093 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -95.02 120.16 34.76 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.338 0.59 . . . . 0.0 111.262 -179.675 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 5.1 p90 -150.25 158.92 44.68 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 177.668 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . 0.437 ' OD1' ' N ' ' A' ' 17' ' ' ASP . 0.1 OUTLIER -95.49 146.03 24.74 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 120.304 -0.558 . . . . 0.0 110.858 -179.028 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -178.49 176.56 1.02 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.783 179.148 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -96.54 133.63 40.76 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.023 -179.454 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.538 ' O ' ' O ' ' A' ' 31' ' ' VAL . 4.9 p -132.51 149.9 52.25 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.316 0.579 . . . . 0.0 110.201 178.378 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 12.5 mm-40 -131.0 138.97 49.92 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.435 -0.802 . . . . 0.0 108.838 179.708 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 1.1 mm -120.27 136.39 57.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-O 121.282 0.563 . . . . 0.0 110.704 -179.374 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.712 ' H ' HD12 ' A' ' 23' ' ' LEU . 0.0 OUTLIER -126.12 123.4 38.23 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.393 -0.821 . . . . 0.0 111.014 -179.133 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.539 ' OE1' ' CE2' ' A' ' 57' ' ' PHE . 22.1 tt0 -129.35 102.18 6.31 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.094 -0.957 . . . . 0.0 109.676 178.826 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 80.3 -127.33 7.88 Favored Glycine 0 CA--C 1.524 0.606 0 N-CA-C 109.94 -1.264 . . . . 0.0 109.94 -178.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -100.22 11.32 39.66 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.833 0.349 . . . . 0.0 110.179 179.586 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.579 ' HB3' ' CZ2' ' A' ' 29' ' ' TRP . 35.4 mtt180 -113.14 133.82 54.85 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 112.423 0.527 . . . . 0.0 112.423 -178.34 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.439 ' HG2' ' N ' ' A' ' 29' ' ' TRP . 17.2 ttt180 -128.35 149.22 50.61 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.582 179.786 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.579 ' CZ2' ' HB3' ' A' ' 27' ' ' ARG . 6.8 m-90 -146.7 155.79 42.68 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.505 -179.286 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.539 ' OE1' ' N ' ' A' ' 30' ' ' GLU . 1.9 mp0 -100.56 135.44 42.0 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.774 179.459 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.538 ' O ' ' O ' ' A' ' 20' ' ' SER . 15.4 m -145.61 157.33 12.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-O 121.315 0.579 . . . . 0.0 111.026 -179.612 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 1.057 ' H ' HD23 ' A' ' 32' ' ' LEU . 1.5 pt? -96.86 130.57 44.12 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 178.759 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -91.97 125.0 36.5 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.278 0.561 . . . . 0.0 109.908 -179.512 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 69.6 m-70 -91.4 -28.54 17.61 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.307 -0.861 . . . . 0.0 111.662 -178.695 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 -172.66 161.07 4.76 Favored 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 119.484 -0.886 . . . . 0.0 111.08 177.577 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . 0.531 HG22 ' H ' ' A' ' 37' ' ' SER . 4.6 p -145.56 169.08 7.3 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.243 -178.894 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . 0.531 ' H ' HG22 ' A' ' 36' ' ' VAL . 32.1 t -142.18 169.59 17.31 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 107.894 -1.15 . . . . 0.0 107.894 178.348 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 2.6 mt -66.36 -0.82 2.88 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 119.793 -0.763 . . . . 0.0 110.856 -179.461 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . 0.546 ' CE1' ' O ' ' A' ' 87' ' ' CYS . 36.3 t60 -159.72 40.17 0.2 Allowed 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 120.664 -0.415 . . . . 0.0 111.472 -179.908 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -179.83 157.74 20.82 Favored Glycine 0 CA--C 1.525 0.681 0 N-CA-C 111.021 -0.832 . . . . 0.0 111.021 179.803 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -148.47 148.83 15.67 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.259 0 CA-C-O 121.382 0.61 . . . . 0.0 111.628 -178.804 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.491 HD23 ' N ' ' A' ' 43' ' ' VAL . 1.0 OUTLIER -121.95 137.4 54.81 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 115.016 -0.993 . . . . 0.0 108.759 178.664 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.491 ' N ' HD23 ' A' ' 42' ' ' LEU . 32.7 m -141.98 174.53 6.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-O 121.214 0.531 . . . . 0.0 111.534 -179.447 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -96.43 145.48 17.85 Favored Glycine 0 CA--C 1.528 0.882 0 N-CA-C 109.506 -1.438 . . . . 0.0 109.506 178.39 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . 0.463 ' O ' ' OE1' ' A' ' 45' ' ' GLN . 1.9 tm0? -86.86 115.19 61.62 Favored Pre-proline 0 N--CA 1.464 0.235 0 CA-C-N 117.88 0.84 . . . . 0.0 111.838 -178.492 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 97.4 Cg_endo -84.92 160.55 11.86 Favored 'Trans proline' 0 C--N 1.307 -1.613 0 C-N-CA 121.51 1.473 . . . . 0.0 111.22 178.715 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.638 ' H ' ' NE2' ' A' ' 47' ' ' GLN . 3.7 mp0 -65.33 -40.4 93.66 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 112.422 0.527 . . . . 0.0 112.422 -178.677 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . 0.549 ' O ' ' N ' ' A' ' 50' ' ' ASN . 46.8 t0 -73.09 8.37 1.65 Allowed 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 111.89 0.33 . . . . 0.0 111.89 -178.592 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' TRP . . . . . 0.444 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 60.6 t-105 -59.3 69.62 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 111.828 0.307 . . . . 0.0 111.828 -179.579 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . 0.549 ' N ' ' O ' ' A' ' 48' ' ' ASP . 0.5 OUTLIER -93.21 79.06 4.5 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 120.439 -0.505 . . . . 0.0 110.024 178.909 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -142.94 161.25 27.54 Favored Glycine 0 CA--C 1.526 0.765 0 N-CA-C 111.417 -0.673 . . . . 0.0 111.417 -179.44 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -95.44 109.94 48.08 Favored Pre-proline 0 CA--C 1.535 0.366 0 N-CA-C 110.512 -0.181 . . . . 0.0 110.512 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 78.7 Cg_exo -46.32 -22.98 1.8 Allowed 'Trans proline' 0 N--CA 1.498 1.769 0 C-N-CA 122.713 2.275 . . . . 0.0 112.813 -179.785 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 3.4 mm100 -79.86 -24.23 41.4 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 120.354 -0.539 . . . . 0.0 111.652 -178.718 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.578 ' O ' ' CE1' ' A' ' 57' ' ' PHE . 82.1 mtt180 -92.15 148.81 37.49 Favored Pre-proline 0 C--N 1.33 -0.246 0 C-N-CA 120.721 -0.391 . . . . 0.0 110.403 -179.978 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . 0.442 ' O ' ' OE1' ' A' ' 24' ' ' GLN . 29.8 Cg_endo -63.23 160.87 32.79 Favored 'Trans proline' 0 N--CA 1.497 1.724 0 C-N-CA 123.07 2.514 . . . . 0.0 113.436 -178.761 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.578 ' CE1' ' O ' ' A' ' 55' ' ' ARG . 49.0 m-85 -131.12 157.3 43.49 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 114.971 -1.013 . . . . 0.0 109.161 179.419 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.6 ' O ' HD12 ' A' ' 23' ' ' LEU . 64.8 mt-10 -122.21 138.46 54.47 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 178.245 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -118.98 137.08 53.76 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.316 0.487 . . . . 0.0 112.316 -178.116 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.622 ' HG3' HD11 ' A' ' 23' ' ' LEU . 9.4 mtm180 -123.11 127.73 49.13 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 108.379 -0.971 . . . . 0.0 108.379 177.237 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.556 HD23 ' C ' ' A' ' 60' ' ' ARG . 0.4 OUTLIER -109.88 144.16 38.75 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 120.638 -0.425 . . . . 0.0 110.736 -178.898 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' TYR . . . . . 0.431 ' CD1' ' N ' ' A' ' 62' ' ' TYR . 14.3 m-85 -125.47 109.47 12.75 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.694 179.862 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -106.17 -85.87 0.49 Allowed 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.39 -0.823 . . . . 0.0 109.488 179.579 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.413 ' H ' ' HB ' ' A' ' 67' ' ' VAL . . . -74.65 176.06 48.89 Favored Glycine 0 CA--C 1.521 0.428 0 N-CA-C 109.168 -1.573 . . . . 0.0 109.168 178.46 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.409 ' N ' HD23 ' A' ' 65' ' ' LEU . 2.0 mt -73.12 -33.18 65.39 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 119.667 -0.813 . . . . 0.0 110.011 -179.587 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 51.4 t0 -102.35 8.82 40.17 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.869 179.858 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . 0.54 ' O ' HG12 ' A' ' 67' ' ' VAL . 13.2 t -106.05 96.68 4.81 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.283 0 CA-C-O 121.364 0.602 . . . . 0.0 111.833 -178.832 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 7.9 tp -113.04 117.4 31.92 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 107.977 -1.12 . . . . 0.0 107.977 178.089 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.485 HG23 ' CB ' ' A' ' 94' ' ' SER . 8.5 mt -111.64 142.54 23.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-O 120.909 0.385 . . . . 0.0 110.881 -178.541 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 26.3 ttp180 -128.49 130.64 47.8 Favored 'General case' 0 C--O 1.24 0.553 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.343 179.824 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . 0.783 ' SD ' HD12 ' A' ' 90' ' ' ILE . 1.4 mtm -139.42 147.63 41.69 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.739 -0.664 . . . . 0.0 109.575 179.238 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 22.0 tt0 -104.75 124.5 49.52 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 107.529 -1.286 . . . . 0.0 107.529 178.273 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.405 HG22 ' HA ' ' A' ' 87' ' ' CYS . 2.7 pt -134.34 160.75 41.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 C-N-CA 119.673 -0.811 . . . . 0.0 113.0 -177.162 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 35.5 m -121.13 152.2 39.0 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.057 -0.974 . . . . 0.0 109.46 178.804 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.59 HD12 ' CE1' ' A' ' 85' ' ' PHE . 10.2 tp -66.44 123.36 19.8 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.274 0.559 . . . . 0.0 109.97 -179.659 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -97.68 -41.7 7.98 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.854 178.373 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' TRP . . . . . 0.554 ' NE1' ' HA3' ' A' ' 84' ' ' GLY . 65.9 p-90 -171.22 165.04 7.3 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.556 -179.121 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -143.59 123.98 13.89 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 109.622 -0.511 . . . . 0.0 109.622 178.437 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 6.7 ttt180 -152.1 133.46 14.5 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 119.634 -0.826 . . . . 0.0 112.96 179.868 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 3.6 t70 57.01 47.03 18.32 Favored 'General case' 0 N--CA 1.462 0.139 0 N-CA-C 113.735 1.013 . . . . 0.0 113.735 176.804 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 82.56 -26.68 3.98 Favored Glycine 0 CA--C 1.523 0.532 0 C-N-CA 120.445 -0.883 . . . . 0.0 113.263 177.238 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.405 ' N ' HD23 ' A' ' 82' ' ' LEU . 5.0 mt -89.66 159.21 17.24 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 117.631 0.715 . . . . 0.0 110.362 -179.11 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 44.0 mt -132.0 135.73 46.75 Favored 'General case' 0 CA--C 1.516 -0.356 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.344 -179.16 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . 0.554 ' HA3' ' NE1' ' A' ' 77' ' ' TRP . . . -102.58 154.0 18.39 Favored Glycine 0 N--CA 1.452 -0.278 0 N-CA-C 109.758 -1.337 . . . . 0.0 109.758 178.714 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' PHE . . . . . 0.59 ' CE1' HD12 ' A' ' 75' ' ' LEU . 50.5 m-85 -145.36 136.55 24.89 Favored 'General case' 0 C--N 1.318 -0.763 0 C-N-CA 120.921 -0.312 . . . . 0.0 110.45 -179.66 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -104.01 128.96 51.6 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 179.53 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . 0.578 ' C ' HE21 ' A' ' 88' ' ' GLN . 42.9 t -69.38 120.45 15.2 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 112.378 0.51 . . . . 0.0 112.378 -178.237 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . 0.578 HE21 ' C ' ' A' ' 87' ' ' CYS . 5.0 mm-40 -94.58 -34.79 12.51 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.075 178.935 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . 0.449 ' ND1' ' C ' ' A' ' 89' ' ' HIS . 0.0 OUTLIER -161.41 141.89 10.9 Favored 'General case' 0 C--O 1.223 -0.338 0 CA-C-N 116.187 -0.46 . . . . 0.0 109.848 179.761 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.783 HD12 ' SD ' ' A' ' 71' ' ' MET . 6.0 tt -145.04 140.9 23.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-O 121.332 0.587 . . . . 0.0 110.465 -178.833 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -56.9 142.86 39.78 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 115.153 -0.931 . . . . 0.0 112.297 -178.455 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 5.0 tp -54.28 -42.04 69.57 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 114.892 -1.049 . . . . 0.0 110.319 -179.343 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 26.3 t0 -68.3 -42.65 79.15 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.04 179.603 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' SER . . . . . 0.485 ' CB ' HG23 ' A' ' 69' ' ' ILE . 14.8 m -60.07 -38.39 82.7 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.062 179.5 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 50.8 mt -58.79 -38.46 72.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.317 179.913 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -70.97 -40.79 71.73 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.235 -0.586 . . . . 0.0 111.157 -179.204 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 60.0 m-70 . . . . . 0 C--N 1.325 -0.494 0 C-N-CA 119.177 -1.009 . . . . 0.0 108.704 179.87 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 12.2 mm . . . . . 0 C--O 1.232 0.18 0 N-CA-C 110.085 -0.339 . . . . 0.0 110.085 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -93.67 120.55 34.08 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.506 0.669 . . . . 0.0 111.714 -179.221 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 2.9 p90 -149.37 156.9 42.78 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 114.803 -1.09 . . . . 0.0 108.2 178.298 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -95.51 146.18 24.63 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 120.009 -0.676 . . . . 0.0 110.82 -179.106 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . 179.57 176.75 0.63 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.065 179.865 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -96.47 134.23 39.92 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.731 -179.659 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.508 ' O ' ' O ' ' A' ' 31' ' ' VAL . 6.5 p -134.06 151.89 51.6 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.16 0.505 . . . . 0.0 110.451 178.914 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 22.8 mm-40 -129.27 144.43 51.22 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.679 -0.691 . . . . 0.0 109.169 179.654 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 75.4 mt -126.9 136.46 60.73 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.326 0 C-N-CA 120.352 -0.539 . . . . 0.0 110.869 -179.782 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -125.46 123.27 38.85 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.538 -0.756 . . . . 0.0 111.256 -178.893 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.548 ' OE1' ' CE2' ' A' ' 57' ' ' PHE . 23.8 tt0 -129.58 102.33 6.32 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.453 -0.794 . . . . 0.0 109.717 178.715 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 80.41 -126.23 7.31 Favored Glycine 0 CA--C 1.523 0.564 0 N-CA-C 109.789 -1.324 . . . . 0.0 109.789 -178.96 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -101.42 11.77 38.54 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.816 0.341 . . . . 0.0 110.277 179.58 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.559 ' HB3' ' CZ2' ' A' ' 29' ' ' TRP . 48.0 mtt180 -114.29 134.18 55.13 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 112.664 0.616 . . . . 0.0 112.664 -178.189 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 56.5 ttt180 -127.88 149.48 50.28 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.421 179.288 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.559 ' CZ2' ' HB3' ' A' ' 27' ' ' ARG . 7.2 m-90 -146.31 156.04 43.07 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.477 -179.568 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -100.7 135.23 42.47 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.585 179.22 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.508 ' O ' ' O ' ' A' ' 20' ' ' SER . 28.9 m -145.73 156.3 12.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 C-N-CA 120.652 -0.419 . . . . 0.0 110.83 -179.663 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.519 ' H ' HD23 ' A' ' 32' ' ' LEU . 0.3 OUTLIER -95.12 130.32 41.87 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 108.518 -0.919 . . . . 0.0 108.518 178.429 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.5 tt -90.1 126.01 35.63 Favored 'General case' 0 C--N 1.325 -0.492 0 C-N-CA 120.203 -0.599 . . . . 0.0 110.179 -179.478 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' HIS . . . . . 0.408 ' NE2' HD12 ' A' ' 32' ' ' LEU . 79.3 m-70 -90.29 -30.98 17.15 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.055 -0.975 . . . . 0.0 111.704 -178.811 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -173.67 162.31 4.08 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 119.632 -0.827 . . . . 0.0 111.434 178.303 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . 0.536 HG22 ' H ' ' A' ' 37' ' ' SER . 4.1 p -144.75 168.77 9.21 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.112 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.117 -179.549 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . 0.536 ' H ' HG22 ' A' ' 36' ' ' VAL . 18.8 t -142.33 167.27 22.49 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 107.402 -1.333 . . . . 0.0 107.402 178.262 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.527 ' H ' HD12 ' A' ' 38' ' ' LEU . 1.7 mp -62.42 1.4 0.35 Allowed 'General case' 0 C--N 1.322 -0.588 0 C-N-CA 119.412 -0.915 . . . . 0.0 110.635 -179.483 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . 0.489 ' CD2' ' N ' ' A' ' 39' ' ' HIS . 0.3 OUTLIER -168.34 44.89 0.04 OUTLIER 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 120.655 -0.418 . . . . 0.0 111.338 179.868 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -177.71 150.44 9.99 Favored Glycine 0 CA--C 1.527 0.782 0 N-CA-C 110.573 -1.011 . . . . 0.0 110.573 179.768 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.588 HG21 HG21 ' A' ' 73' ' ' ILE . 0.1 OUTLIER -147.02 148.65 16.45 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.222 0 CA-C-O 121.317 0.579 . . . . 0.0 111.656 -179.082 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.529 HD23 ' N ' ' A' ' 43' ' ' VAL . 1.1 tt -121.87 139.69 53.32 Favored 'General case' 0 N--CA 1.464 0.262 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 178.596 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.529 ' N ' HD23 ' A' ' 42' ' ' LEU . 18.8 m -143.72 175.15 3.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 C-N-CA 120.129 -0.628 . . . . 0.0 112.058 -178.8 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -98.13 143.98 16.99 Favored Glycine 0 CA--C 1.528 0.853 0 N-CA-C 109.224 -1.55 . . . . 0.0 109.224 177.845 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . 0.499 ' CD ' ' O ' ' A' ' 45' ' ' GLN . 0.0 OUTLIER -86.25 120.16 72.11 Favored Pre-proline 0 CA--C 1.532 0.262 0 CA-C-N 118.075 0.938 . . . . 0.0 112.046 -178.224 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_endo -86.24 159.64 9.83 Favored 'Trans proline' 0 C--N 1.308 -1.564 0 C-N-CA 121.797 1.665 . . . . 0.0 110.906 178.278 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 65.7 mt-30 -65.38 -40.23 93.25 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.315 0.487 . . . . 0.0 112.315 -178.936 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . 0.554 ' O ' ' NE1' ' A' ' 29' ' ' TRP . 29.5 m-20 -73.59 8.4 1.87 Allowed 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 111.975 0.361 . . . . 0.0 111.975 -178.71 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' TRP . . . . . 0.445 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 58.9 t-105 -59.51 69.57 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 111.914 0.338 . . . . 0.0 111.914 -179.308 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . 0.551 ' N ' ' O ' ' A' ' 48' ' ' ASP . 0.2 OUTLIER -93.39 78.92 4.41 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 120.159 -0.616 . . . . 0.0 109.953 178.729 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -142.88 159.93 27.42 Favored Glycine 0 CA--C 1.524 0.632 0 N-CA-C 111.548 -0.621 . . . . 0.0 111.548 -179.647 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -94.2 111.25 52.65 Favored Pre-proline 0 CA--C 1.536 0.422 0 CA-C-N 115.543 -0.329 . . . . 0.0 110.744 -179.817 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_exo -47.99 -23.31 4.21 Favored 'Trans proline' 0 N--CA 1.497 1.721 0 C-N-CA 122.473 2.116 . . . . 0.0 112.366 179.762 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 1.7 mm100 -78.25 -24.01 47.07 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.782 -178.96 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.558 ' O ' ' CE1' ' A' ' 57' ' ' PHE . 44.3 mtp85 -94.54 148.9 35.72 Favored Pre-proline 0 C--N 1.331 -0.232 0 C-N-CA 120.598 -0.441 . . . . 0.0 110.138 179.94 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . 0.423 ' O ' ' OE1' ' A' ' 24' ' ' GLN . 31.1 Cg_endo -63.43 160.82 33.74 Favored 'Trans proline' 0 N--CA 1.494 1.527 0 C-N-CA 122.93 2.42 . . . . 0.0 113.337 -178.598 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.558 ' CE1' ' O ' ' A' ' 55' ' ' ARG . 34.2 m-85 -130.5 158.42 39.99 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 114.8 -1.091 . . . . 0.0 108.922 179.346 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 69.3 mt-10 -121.39 135.34 55.08 Favored 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 108.644 -0.873 . . . . 0.0 108.644 178.175 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . 0.563 ' HB2' ' CD1' ' A' ' 73' ' ' ILE . . . -118.02 138.15 52.41 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.281 0.562 . . . . 0.0 111.645 -177.958 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 47.6 mtm180 -124.71 128.11 48.29 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 178.024 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 10.2 mt -107.16 143.0 35.97 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 120.431 -0.508 . . . . 0.0 111.098 -178.522 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' TYR . . . . . 0.473 ' CD1' ' N ' ' A' ' 62' ' ' TYR . 7.7 m-85 -125.93 107.78 10.79 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.242 179.471 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.486 ' C ' HD23 ' A' ' 63' ' ' LEU . 1.9 tt -104.53 -85.37 0.47 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.441 -0.799 . . . . 0.0 109.436 179.688 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.447 ' H ' ' HB ' ' A' ' 67' ' ' VAL . . . -74.23 178.09 44.79 Favored Glycine 0 CA--C 1.522 0.482 0 N-CA-C 109.139 -1.584 . . . . 0.0 109.139 178.403 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.66 ' N ' HD12 ' A' ' 65' ' ' LEU . 7.9 mp -74.63 -31.44 61.98 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 119.846 -0.742 . . . . 0.0 110.151 -179.777 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -103.84 9.5 36.86 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 123.054 0.542 . . . . 0.0 110.798 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . 0.521 ' O ' HG12 ' A' ' 67' ' ' VAL . 20.7 t -105.71 96.06 4.3 Favored 'Isoleucine or valine' 0 C--O 1.234 0.277 0 CA-C-O 121.206 0.527 . . . . 0.0 111.855 -178.929 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 3.8 tp -113.14 117.3 31.55 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 108.128 -1.064 . . . . 0.0 108.128 178.405 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.471 HG23 ' CB ' ' A' ' 94' ' ' SER . 17.7 mm -112.5 143.82 21.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 120.926 0.393 . . . . 0.0 111.049 -178.677 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.473 ' C ' ' HG2' ' A' ' 71' ' ' MET . 59.2 mtp180 -127.64 130.31 48.74 Favored 'General case' 0 C--O 1.239 0.516 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.374 179.3 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . 0.739 ' SD ' HD12 ' A' ' 90' ' ' ILE . 0.1 OUTLIER -142.4 147.69 36.61 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.223 -0.898 . . . . 0.0 109.476 -179.576 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -102.05 128.89 48.31 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 108.017 -1.105 . . . . 0.0 108.017 178.587 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.588 HG21 HG21 ' A' ' 41' ' ' ILE . 25.9 pt -136.77 157.62 36.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 C-N-CA 119.836 -0.746 . . . . 0.0 112.836 -177.611 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 2.0 p -122.63 155.41 36.42 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 115.068 -0.969 . . . . 0.0 109.414 178.393 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.524 ' CD1' ' CZ ' ' A' ' 85' ' ' PHE . 7.1 tp -70.43 126.13 28.76 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.591 0.71 . . . . 0.0 110.782 -179.752 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -98.36 -43.66 6.84 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 114.515 -1.22 . . . . 0.0 111.138 178.103 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' TRP . . . . . 0.674 ' NE1' ' HA3' ' A' ' 84' ' ' GLY . 69.3 p-90 -167.71 172.4 9.28 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.425 -178.884 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -151.36 123.69 8.32 Favored 'General case' 0 N--CA 1.467 0.39 0 N-CA-C 110.032 -0.358 . . . . 0.0 110.032 178.373 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 61.4 ttt180 -152.58 133.54 14.11 Favored 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 112.91 0.708 . . . . 0.0 112.91 179.842 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 25.7 t0 56.71 47.22 18.66 Favored 'General case' 0 N--CA 1.464 0.229 0 N-CA-C 114.055 1.132 . . . . 0.0 114.055 176.154 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 83.98 -27.51 4.41 Favored Glycine 0 CA--C 1.522 0.529 0 C-N-CA 120.385 -0.912 . . . . 0.0 113.242 177.128 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 4.4 mt -89.52 161.26 16.31 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 117.664 0.732 . . . . 0.0 110.41 -178.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.406 HD11 ' CB ' ' A' ' 45' ' ' GLN . 42.3 mt -133.93 135.36 43.52 Favored 'General case' 0 CA--C 1.518 -0.272 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.242 -179.236 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . 0.674 ' HA3' ' NE1' ' A' ' 77' ' ' TRP . . . -94.84 152.36 20.47 Favored Glycine 0 N--CA 1.451 -0.331 0 N-CA-C 109.962 -1.255 . . . . 0.0 109.962 178.999 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' PHE . . . . . 0.524 ' CZ ' ' CD1' ' A' ' 75' ' ' LEU . 29.0 m-85 -145.47 133.77 21.75 Favored 'General case' 0 C--N 1.319 -0.754 0 C-N-CA 120.985 -0.286 . . . . 0.0 110.492 -179.602 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -103.8 127.93 51.25 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 108.555 -0.905 . . . . 0.0 108.555 179.242 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . 0.565 ' HA ' HG22 ' A' ' 73' ' ' ILE . 2.3 t -67.69 119.89 13.16 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.925 0.393 . . . . 0.0 111.704 -178.595 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -89.33 -36.35 15.59 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.973 179.782 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . 0.485 ' ND1' ' C ' ' A' ' 89' ' ' HIS . 0.0 OUTLIER -166.43 147.8 6.45 Favored 'General case' 0 C--O 1.224 -0.237 0 CA-C-N 116.028 -0.533 . . . . 0.0 109.921 179.371 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.739 HD12 ' SD ' ' A' ' 71' ' ' MET . 10.4 tt -145.27 141.1 22.7 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-O 121.418 0.628 . . . . 0.0 110.568 -178.984 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . 0.504 ' CB ' ' OG ' ' A' ' 94' ' ' SER . 0.0 OUTLIER -55.6 141.56 37.04 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 115.045 -0.98 . . . . 0.0 112.27 -178.077 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 5.2 tp -54.72 -42.33 71.42 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.192 -0.913 . . . . 0.0 110.294 -179.937 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -68.62 -42.9 77.43 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.264 -0.425 . . . . 0.0 109.93 179.625 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' SER . . . . . 0.504 ' OG ' ' CB ' ' A' ' 91' ' ' ASP . 1.5 p -60.24 -36.32 77.47 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.022 -0.536 . . . . 0.0 109.918 179.303 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . 0.412 ' CG1' HG23 ' A' ' 90' ' ' ILE . 38.2 mt -60.35 -38.77 78.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.16 179.894 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -70.44 -37.53 74.39 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 120.342 -0.543 . . . . 0.0 110.852 -178.856 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 67.2 m-70 . . . . . 0 C--N 1.323 -0.548 0 C-N-CA 119.666 -0.814 . . . . 0.0 109.385 179.668 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 41.1 mm . . . . . 0 CA--C 1.52 -0.204 0 CA-C-O 120.654 0.264 . . . . 0.0 110.386 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -91.82 120.22 32.33 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.416 0.627 . . . . 0.0 110.99 179.907 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 3.1 p90 -149.8 158.65 44.37 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.034 -0.984 . . . . 0.0 108.423 178.18 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 3.1 p30 -95.34 144.67 25.7 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 120.184 -0.606 . . . . 0.0 110.051 -179.62 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -177.49 175.7 1.39 Allowed 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 179.697 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -96.37 134.24 39.77 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.704 -179.716 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.542 ' O ' ' O ' ' A' ' 31' ' ' VAL . 10.7 p -134.04 152.7 51.95 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.109 0.481 . . . . 0.0 110.293 178.851 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 12.0 mm-40 -129.5 141.53 50.98 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 179.625 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -122.21 135.72 61.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 C-N-CA 120.096 -0.642 . . . . 0.0 110.371 179.771 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.432 ' H ' HD12 ' A' ' 23' ' ' LEU . 0.1 OUTLIER -126.12 123.15 37.66 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.32 -0.854 . . . . 0.0 110.934 -179.133 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.582 ' OE1' ' CE2' ' A' ' 57' ' ' PHE . 22.2 tt0 -128.79 101.82 6.28 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.245 -0.889 . . . . 0.0 109.678 178.849 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 80.11 -126.77 7.59 Favored Glycine 0 CA--C 1.523 0.55 0 N-CA-C 110.138 -1.185 . . . . 0.0 110.138 -178.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -99.65 11.31 39.53 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.844 0.354 . . . . 0.0 110.325 179.57 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.551 ' HB3' ' CZ2' ' A' ' 29' ' ' TRP . 67.7 mtt180 -113.24 134.97 54.32 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 112.422 0.527 . . . . 0.0 112.422 -178.369 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 28.0 ttt180 -129.29 150.62 50.58 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.51 179.65 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.551 ' CZ2' ' HB3' ' A' ' 27' ' ' ARG . 7.0 m-90 -149.0 156.5 42.35 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.675 -178.919 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 14.7 mt-10 -100.28 134.59 42.99 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.003 179.292 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.542 ' O ' ' O ' ' A' ' 20' ' ' SER . 16.8 m -145.9 158.03 12.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 121.104 0.478 . . . . 0.0 111.306 -179.628 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.957 ' H ' HD23 ' A' ' 32' ' ' LEU . 1.4 pt? -97.0 130.21 44.36 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 178.505 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.4 tt -93.29 126.63 38.5 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.27 0.557 . . . . 0.0 109.731 -179.946 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 45.8 m-70 -92.31 -26.09 18.27 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.397 -0.819 . . . . 0.0 111.923 -178.36 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -174.24 159.45 3.15 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 119.528 -0.869 . . . . 0.0 111.12 177.652 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . 0.531 HG22 ' N ' ' A' ' 37' ' ' SER . 6.7 p -142.82 168.89 13.14 Favored 'Isoleucine or valine' 0 C--O 1.231 0.099 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.84 -179.178 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . 0.531 ' N ' HG22 ' A' ' 36' ' ' VAL . 22.9 t -142.36 169.15 18.12 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 107.889 -1.152 . . . . 0.0 107.889 178.926 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 91.4 mt -66.23 -1.25 3.12 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 119.642 -0.823 . . . . 0.0 110.941 -179.438 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . 0.513 ' NE2' ' O ' ' A' ' 87' ' ' CYS . 3.7 t60 -161.32 38.98 0.14 Allowed 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 120.839 -0.344 . . . . 0.0 111.179 -179.847 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -175.77 154.67 17.98 Favored Glycine 0 CA--C 1.527 0.825 0 N-CA-C 110.929 -0.868 . . . . 0.0 110.929 179.88 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -148.04 148.87 15.82 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.345 0 CA-C-O 121.389 0.614 . . . . 0.0 111.809 -178.87 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.694 HD23 ' N ' ' A' ' 43' ' ' VAL . 1.8 tt -122.22 140.85 52.11 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 115.088 -0.96 . . . . 0.0 109.1 178.836 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.694 ' N ' HD23 ' A' ' 42' ' ' LEU . 20.8 m -145.42 174.84 2.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-O 121.12 0.486 . . . . 0.0 111.633 -179.568 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -97.9 145.77 17.93 Favored Glycine 0 CA--C 1.529 0.913 0 N-CA-C 109.961 -1.256 . . . . 0.0 109.961 178.86 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 1.6 tm0? -87.64 113.76 55.85 Favored Pre-proline 0 N--CA 1.463 0.184 0 CA-C-N 117.923 0.862 . . . . 0.0 111.841 -178.574 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 77.2 Cg_endo -85.26 163.37 11.32 Favored 'Trans proline' 0 C--N 1.305 -1.752 0 C-N-CA 121.625 1.55 . . . . 0.0 111.289 178.899 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -65.39 -40.52 93.56 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 116.519 -0.309 . . . . 0.0 111.815 -179.054 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . 0.53 ' O ' ' N ' ' A' ' 50' ' ' ASN . 86.0 m-20 -71.28 8.63 0.96 Allowed 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 111.926 0.343 . . . . 0.0 111.926 -178.819 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' TRP . . . . . 0.46 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 61.8 t-105 -61.56 67.4 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 111.856 0.317 . . . . 0.0 111.856 -179.576 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . 0.533 ' ND2' ' C ' ' A' ' 50' ' ' ASN . 0.7 OUTLIER -93.1 78.71 4.57 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 178.569 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -142.7 159.34 27.28 Favored Glycine 0 CA--C 1.523 0.583 0 N-CA-C 111.239 -0.745 . . . . 0.0 111.239 -179.581 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 14.3 t0 -92.91 121.57 65.58 Favored Pre-proline 0 CA--C 1.534 0.362 0 N-CA-C 110.321 -0.251 . . . . 0.0 110.321 179.886 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -61.29 -22.38 74.44 Favored 'Trans proline' 0 N--CA 1.495 1.587 0 C-N-CA 122.477 2.118 . . . . 0.0 112.075 -179.513 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 18.7 mt-30 -77.45 -20.08 55.04 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.12 -179.492 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.471 ' O ' ' CE1' ' A' ' 57' ' ' PHE . 1.3 mtt85 -97.85 157.32 34.82 Favored Pre-proline 0 CA--C 1.531 0.215 0 CA-C-O 120.745 0.307 . . . . 0.0 110.23 179.926 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . 0.443 ' O ' ' OE1' ' A' ' 24' ' ' GLN . 55.7 Cg_endo -70.22 161.0 47.62 Favored 'Trans proline' 0 N--CA 1.495 1.606 0 C-N-CA 122.913 2.409 . . . . 0.0 113.298 -178.766 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.582 ' CE2' ' OE1' ' A' ' 24' ' ' GLN . 53.3 m-85 -131.16 155.63 46.7 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.053 -0.976 . . . . 0.0 109.142 179.605 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -121.34 137.74 54.56 Favored 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 178.517 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -119.74 137.82 53.7 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.143 0.497 . . . . 0.0 111.963 -178.201 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.601 ' HE ' ' CD1' ' A' ' 68' ' ' LEU . 7.0 mmm-85 -123.43 127.56 48.6 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 108.404 -0.961 . . . . 0.0 108.404 177.612 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 12.4 mt -107.18 149.08 28.09 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.906 0.384 . . . . 0.0 110.836 -178.965 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 10.3 m-85 -134.14 111.8 10.61 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.711 -179.735 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.548 ' C ' HD23 ' A' ' 63' ' ' LEU . 2.9 tt -105.94 -83.35 0.52 Allowed 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 115.812 -0.631 . . . . 0.0 109.5 179.444 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.456 ' H ' ' HB ' ' A' ' 67' ' ' VAL . . . -76.81 -177.12 44.42 Favored Glycine 0 CA--C 1.521 0.436 0 N-CA-C 109.326 -1.509 . . . . 0.0 109.326 178.699 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.667 ' N ' HD12 ' A' ' 65' ' ' LEU . 7.3 mp -75.45 -33.2 60.86 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 119.988 -0.685 . . . . 0.0 110.477 -179.612 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -102.63 8.96 39.59 Favored 'General case' 0 C--N 1.332 -0.168 0 C-N-CA 122.67 0.388 . . . . 0.0 111.323 -179.902 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . 0.573 ' O ' HG12 ' A' ' 67' ' ' VAL . 9.5 t -101.49 93.56 2.89 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.245 0 CA-C-O 121.197 0.523 . . . . 0.0 111.694 -178.864 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.601 ' CD1' ' HE ' ' A' ' 60' ' ' ARG . 1.9 tp -111.69 117.81 33.9 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 108.446 -0.946 . . . . 0.0 108.446 178.62 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.653 HG23 ' OG ' ' A' ' 94' ' ' SER . 3.6 mt -115.28 144.78 22.09 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.247 0 CA-C-O 120.945 0.402 . . . . 0.0 111.155 -178.815 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -128.46 134.42 48.73 Favored 'General case' 0 C--O 1.238 0.492 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.251 179.417 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . 0.55 ' HE3' HD12 ' A' ' 90' ' ' ILE . 0.1 OUTLIER -143.75 148.15 35.22 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.439 -0.8 . . . . 0.0 109.557 179.472 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -110.82 121.49 45.47 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 107.975 -1.12 . . . . 0.0 107.975 178.509 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.683 HD12 ' CB ' ' A' ' 85' ' ' PHE . 4.2 pt -132.19 165.41 32.12 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 N-CA-C 113.627 0.973 . . . . 0.0 113.627 -176.621 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 3.3 p -120.09 148.96 42.96 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 114.926 -1.033 . . . . 0.0 109.642 178.71 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.535 HD12 ' CE1' ' A' ' 85' ' ' PHE . 14.2 tp -66.1 124.4 22.48 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-O 121.239 0.542 . . . . 0.0 110.542 -179.002 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -98.58 -44.89 6.28 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 115.307 -0.861 . . . . 0.0 111.429 178.205 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' TRP . . . . . 0.581 ' NE1' ' HA3' ' A' ' 84' ' ' GLY . 69.2 p-90 -164.91 172.34 12.96 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.808 -179.091 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -151.3 123.78 8.4 Favored 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 178.117 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . 0.547 ' O ' ' OD1' ' A' ' 80' ' ' ASP . 5.2 ttm180 -152.2 131.81 13.1 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 119.916 -0.713 . . . . 0.0 112.617 179.891 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . 0.563 ' OD2' ' O ' ' A' ' 80' ' ' ASP . 0.6 OUTLIER 53.61 46.76 25.36 Favored 'General case' 0 N--CA 1.467 0.418 0 N-CA-C 113.699 0.999 . . . . 0.0 113.699 177.117 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 72.32 12.15 76.38 Favored Glycine 0 CA--C 1.521 0.461 0 C-N-CA 120.433 -0.889 . . . . 0.0 111.856 178.114 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 52.4 mt -116.24 140.27 49.49 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 178.734 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 35.2 mt -128.17 135.72 50.13 Favored 'General case' 0 CA--C 1.512 -0.501 0 C-N-CA 120.715 -0.394 . . . . 0.0 111.339 -178.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . 0.581 ' HA3' ' NE1' ' A' ' 77' ' ' TRP . . . -110.66 156.67 15.43 Favored Glycine 0 N--CA 1.448 -0.558 0 N-CA-C 109.317 -1.513 . . . . 0.0 109.317 178.301 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' PHE . . . . . 0.683 ' CB ' HD12 ' A' ' 73' ' ' ILE . 78.4 m-85 -145.37 143.94 30.4 Favored 'General case' 0 C--N 1.312 -1.028 0 N-CA-C 110.001 -0.37 . . . . 0.0 110.001 -179.53 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 52.4 tt0 -103.64 130.16 51.06 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 179.355 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . 0.513 ' O ' ' NE2' ' A' ' 39' ' ' HIS . 4.6 t -69.26 118.67 12.44 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.492 0.553 . . . . 0.0 112.492 -177.926 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 58.7 mm-40 -92.43 -36.76 12.93 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.77 178.876 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . 0.449 ' ND1' ' C ' ' A' ' 89' ' ' HIS . 0.0 OUTLIER -164.0 143.79 8.06 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.966 179.955 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.602 HD11 ' OG ' ' A' ' 94' ' ' SER . 9.0 tt -145.61 141.3 22.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-O 121.254 0.55 . . . . 0.0 109.994 -179.592 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -58.5 141.04 53.03 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 115.272 -0.876 . . . . 0.0 112.434 -178.029 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 6.3 tp -54.15 -41.73 68.77 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 114.853 -1.067 . . . . 0.0 110.725 -179.491 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . 0.524 ' OD1' ' N ' ' A' ' 94' ' ' SER . 2.8 p30 -68.5 -37.18 79.86 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 179.469 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' SER . . . . . 0.653 ' OG ' HG23 ' A' ' 69' ' ' ILE . 1.6 t -67.2 -38.45 85.36 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.08 179.337 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . 0.471 ' CG1' HG23 ' A' ' 90' ' ' ILE . 56.4 mt -58.65 -37.81 67.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.324 179.886 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -70.24 -40.66 74.32 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.158 -0.617 . . . . 0.0 111.195 -178.489 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 61.2 m-70 . . . . . 0 C--N 1.326 -0.434 0 C-N-CA 119.359 -0.936 . . . . 0.0 109.207 179.767 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.752 ' N ' HD12 ' A' ' 14' ' ' ILE . 1.8 mp . . . . . 0 CA--C 1.521 -0.171 0 N-CA-C 109.863 -0.421 . . . . 0.0 109.863 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -95.19 120.5 35.53 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.506 0.669 . . . . 0.0 111.623 -179.363 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -149.73 155.57 40.39 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 114.791 -1.095 . . . . 0.0 108.363 178.022 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -95.44 146.81 24.13 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 120.159 -0.616 . . . . 0.0 110.863 -178.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.538 ' O ' HD12 ' A' ' 32' ' ' LEU . . . -179.79 176.99 0.72 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.9 -0.591 . . . . 0.0 109.926 179.598 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -96.12 133.88 39.86 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.79 -179.855 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.583 ' O ' ' O ' ' A' ' 31' ' ' VAL . 13.0 t -133.8 152.86 52.0 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.186 0.517 . . . . 0.0 110.215 178.692 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.538 ' OE1' ' NH2' ' A' ' 28' ' ' ARG . 97.0 mt-10 -129.09 155.67 45.09 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 109.136 -0.691 . . . . 0.0 109.136 179.291 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . 0.477 ' HA ' ' O ' ' A' ' 58' ' ' GLU . 34.2 mt -138.47 136.36 43.94 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.437 0 C-N-CA 120.005 -0.678 . . . . 0.0 111.263 -179.603 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.75 HD11 ' HE ' ' A' ' 60' ' ' ARG . 0.0 OUTLIER -125.29 127.79 47.23 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.419 -0.809 . . . . 0.0 111.261 -178.793 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.469 ' O ' ' OE1' ' A' ' 24' ' ' GLN . 1.6 tm0? -132.49 101.95 5.53 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.082 -0.963 . . . . 0.0 109.532 178.519 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 80.71 -126.51 7.43 Favored Glycine 0 CA--C 1.523 0.554 0 N-CA-C 110.111 -1.195 . . . . 0.0 110.111 -178.729 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.613 ' OE1' ' N ' ' A' ' 26' ' ' GLU . 6.0 pm0 -100.68 13.21 35.58 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 110.084 -0.339 . . . . 0.0 110.084 179.583 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.558 ' HB3' ' CZ2' ' A' ' 29' ' ' TRP . 33.5 mtt180 -114.54 135.83 53.69 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 112.755 0.65 . . . . 0.0 112.755 -178.312 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.538 ' NH2' ' OE1' ' A' ' 21' ' ' GLU . 26.7 ttt180 -128.74 148.7 50.87 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.174 179.206 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.558 ' CZ2' ' HB3' ' A' ' 27' ' ' ARG . 6.7 m-90 -147.2 156.13 42.7 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.655 -179.144 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 18.8 mt-10 -100.34 138.54 37.27 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 178.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.583 ' O ' ' O ' ' A' ' 20' ' ' SER . 12.0 m -148.06 157.96 8.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-O 121.223 0.535 . . . . 0.0 111.274 -179.454 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.538 HD12 ' O ' ' A' ' 18' ' ' ALA . 8.3 tp -98.31 130.03 45.0 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 108.301 -1.0 . . . . 0.0 108.301 178.816 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.537 ' N ' HD12 ' A' ' 32' ' ' LEU . 0.8 OUTLIER -92.12 125.96 37.01 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 120.334 -0.547 . . . . 0.0 109.881 179.895 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 73.3 m-70 -90.48 -28.74 18.36 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.418 -0.81 . . . . 0.0 111.742 -178.706 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -171.98 162.23 5.88 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 119.493 -0.883 . . . . 0.0 111.283 177.568 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . 0.511 HG22 ' H ' ' A' ' 37' ' ' SER . 4.8 p -146.04 168.88 6.64 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.11 0 CA-C-N 115.782 -0.645 . . . . 0.0 111.193 -178.798 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . 0.511 ' H ' HG22 ' A' ' 36' ' ' VAL . 23.0 t -142.11 168.46 19.69 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 107.632 -1.247 . . . . 0.0 107.632 178.513 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 3.6 tp -64.41 -0.6 1.36 Allowed 'General case' 0 C--N 1.322 -0.588 0 C-N-CA 119.555 -0.858 . . . . 0.0 110.795 -179.277 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 2.0 p80 -162.25 43.16 0.13 Allowed 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 120.693 -0.403 . . . . 0.0 111.41 179.747 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 179.83 156.58 18.18 Favored Glycine 0 CA--C 1.528 0.898 0 N-CA-C 111.039 -0.824 . . . . 0.0 111.039 179.765 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.45 HG21 HG21 ' A' ' 73' ' ' ILE . 0.1 OUTLIER -148.57 148.76 15.69 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.355 0 CA-C-O 121.453 0.644 . . . . 0.0 111.664 -178.745 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.434 HD23 ' N ' ' A' ' 43' ' ' VAL . 0.9 OUTLIER -121.83 132.29 54.51 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 115.069 -0.969 . . . . 0.0 108.53 178.79 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.434 ' N ' HD23 ' A' ' 42' ' ' LEU . 31.7 m -136.62 174.84 11.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 121.316 0.579 . . . . 0.0 112.078 -179.172 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -98.57 144.56 17.3 Favored Glycine 0 CA--C 1.526 0.725 0 N-CA-C 109.263 -1.535 . . . . 0.0 109.263 178.109 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . 0.516 ' CD ' ' O ' ' A' ' 45' ' ' GLN . 0.0 OUTLIER -87.16 117.73 69.01 Favored Pre-proline 0 CA--C 1.534 0.33 0 CA-C-N 118.052 0.926 . . . . 0.0 111.862 -178.284 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 74.6 Cg_endo -85.85 160.16 10.43 Favored 'Trans proline' 0 C--N 1.306 -1.673 0 C-N-CA 121.772 1.648 . . . . 0.0 111.576 178.89 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 24.0 mm-40 -65.2 -25.33 67.66 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 112.291 0.478 . . . . 0.0 112.291 -178.888 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . 0.532 ' O ' ' N ' ' A' ' 50' ' ' ASN . 3.3 m-20 -86.68 8.82 20.84 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 111.661 0.245 . . . . 0.0 111.661 -178.897 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' TRP . . . . . 0.463 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 59.3 t-105 -60.56 66.9 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 112.265 0.468 . . . . 0.0 112.265 -179.421 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . 0.584 ' C ' HD22 ' A' ' 50' ' ' ASN . 0.2 OUTLIER -93.16 78.66 4.54 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 120.047 -0.661 . . . . 0.0 109.246 178.105 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -145.65 146.25 16.24 Favored Glycine 0 CA--C 1.523 0.54 0 N-CA-C 111.601 -0.6 . . . . 0.0 111.601 -179.07 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -77.75 121.97 84.99 Favored Pre-proline 0 C--N 1.328 -0.365 0 CA-C-N 115.427 -0.386 . . . . 0.0 110.714 -179.969 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 21.5 Cg_endo -62.12 -22.41 74.16 Favored 'Trans proline' 0 N--CA 1.496 1.634 0 C-N-CA 122.61 2.207 . . . . 0.0 112.113 -179.757 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 15.8 mt-30 -77.19 -24.19 51.41 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 120.477 -0.489 . . . . 0.0 111.429 -179.2 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.535 ' O ' ' CE1' ' A' ' 57' ' ' PHE . 17.1 mtp85 -92.88 155.42 41.56 Favored Pre-proline 0 C--N 1.331 -0.223 0 C-N-CA 120.836 -0.345 . . . . 0.0 110.383 -179.955 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_endo -68.0 161.16 45.42 Favored 'Trans proline' 0 N--CA 1.497 1.694 0 C-N-CA 123.059 2.506 . . . . 0.0 113.03 -179.057 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.535 ' CE1' ' O ' ' A' ' 55' ' ' ARG . 43.5 m-85 -131.09 157.31 43.42 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.35 -0.841 . . . . 0.0 109.415 179.595 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.477 ' O ' ' HA ' ' A' ' 22' ' ' ILE . 42.0 mt-10 -123.13 139.23 54.28 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 109.095 -0.706 . . . . 0.0 109.095 178.319 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -124.92 142.08 51.7 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 112.817 0.673 . . . . 0.0 112.817 -177.531 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.75 ' HE ' HD11 ' A' ' 23' ' ' LEU . 0.0 OUTLIER -124.95 128.08 48.05 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.115 -0.948 . . . . 0.0 109.288 177.215 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.538 HD11 ' SD ' ' A' ' 71' ' ' MET . 7.4 mt -108.59 129.38 55.32 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 120.569 -0.452 . . . . 0.0 110.431 -179.658 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' TYR . . . . . 0.43 ' CD1' ' N ' ' A' ' 62' ' ' TYR . 19.9 m-85 -110.67 109.66 20.02 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.002 0.429 . . . . 0.0 110.742 -179.957 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.526 ' C ' HD23 ' A' ' 63' ' ' LEU . 3.5 tt -104.19 -85.03 0.47 Allowed 'General case' 0 C--N 1.333 -0.116 0 CA-C-N 115.76 -0.655 . . . . 0.0 109.545 179.476 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.467 ' H ' ' HB ' ' A' ' 67' ' ' VAL . . . -76.3 176.89 51.49 Favored Glycine 0 CA--C 1.523 0.585 0 N-CA-C 109.337 -1.505 . . . . 0.0 109.337 178.7 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.725 HD13 ' C ' ' A' ' 65' ' ' LEU . 3.0 tm? -71.93 -37.31 70.05 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 120.031 -0.668 . . . . 0.0 109.604 -179.636 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . 0.427 ' OD1' ' O ' ' A' ' 66' ' ' ASP . 55.6 t0 -98.52 9.2 43.72 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.105 179.49 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . 0.558 ' O ' HG12 ' A' ' 67' ' ' VAL . 8.7 t -106.06 96.15 4.37 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.305 0 CA-C-O 121.405 0.621 . . . . 0.0 111.741 -178.875 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 7.8 tp -113.24 117.55 32.18 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 108.102 -1.073 . . . . 0.0 108.102 178.221 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.763 HG23 ' OG ' ' A' ' 94' ' ' SER . 3.6 mt -112.64 144.76 19.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 120.798 0.333 . . . . 0.0 110.948 -178.974 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 9.8 ptt180 -128.16 130.98 48.92 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.835 179.214 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . 0.538 ' SD ' HD11 ' A' ' 61' ' ' LEU . 2.0 mtp -140.18 148.14 41.16 Favored 'General case' 0 C--O 1.227 -0.117 0 CA-C-N 115.719 -0.673 . . . . 0.0 109.902 179.836 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -103.78 126.54 50.98 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 107.627 -1.249 . . . . 0.0 107.627 178.143 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.45 HG21 HG21 ' A' ' 41' ' ' ILE . 11.2 pt -134.83 157.68 41.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 N-CA-C 112.953 0.723 . . . . 0.0 112.953 -177.44 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -122.52 154.69 37.53 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.023 -0.99 . . . . 0.0 109.623 178.723 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.523 ' CD1' ' CZ ' ' A' ' 85' ' ' PHE . 5.2 tp -66.47 120.74 13.9 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.226 0.536 . . . . 0.0 110.558 -179.828 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -97.69 -41.75 7.96 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.422 177.927 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' TRP . . . . . 0.597 ' NE1' ' HA3' ' A' ' 84' ' ' GLY . 67.6 p-90 -170.45 168.52 7.81 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 115.485 -0.78 . . . . 0.0 109.898 -179.647 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -148.15 123.89 10.53 Favored 'General case' 0 N--CA 1.464 0.27 0 N-CA-C 109.932 -0.395 . . . . 0.0 109.932 178.795 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 38.4 ttt85 -152.37 133.68 14.41 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 113.215 0.82 . . . . 0.0 113.215 179.863 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 13.3 t70 56.92 47.15 18.3 Favored 'General case' 0 N--CA 1.464 0.246 0 N-CA-C 114.227 1.195 . . . . 0.0 114.227 176.405 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 83.77 -28.08 4.12 Favored Glycine 0 CA--C 1.524 0.656 0 C-N-CA 120.314 -0.946 . . . . 0.0 113.153 177.114 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 3.5 mt -89.69 157.89 17.8 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 117.637 0.719 . . . . 0.0 110.206 -179.283 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 36.5 mt -129.62 135.34 48.42 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.308 -179.078 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . 0.597 ' HA3' ' NE1' ' A' ' 77' ' ' TRP . . . -96.29 152.4 20.21 Favored Glycine 0 N--CA 1.451 -0.347 0 N-CA-C 109.894 -1.283 . . . . 0.0 109.894 178.935 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' PHE . . . . . 0.523 ' CZ ' ' CD1' ' A' ' 75' ' ' LEU . 23.8 m-85 -145.67 132.75 20.36 Favored 'General case' 0 C--N 1.318 -0.772 0 C-N-CA 120.79 -0.364 . . . . 0.0 110.892 -179.2 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.501 ' O ' ' NE2' ' A' ' 88' ' ' GLN . 42.3 tt0 -103.92 126.32 50.95 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 178.994 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . 0.431 ' C ' HE21 ' A' ' 88' ' ' GLN . 5.6 t -68.72 122.12 17.89 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.015 0.436 . . . . 0.0 112.007 -178.408 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . 0.501 ' NE2' ' O ' ' A' ' 86' ' ' GLU . 20.1 mm-40 -95.14 -34.05 12.42 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.078 179.348 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . 0.442 ' ND1' ' C ' ' A' ' 89' ' ' HIS . 0.0 OUTLIER -161.5 141.69 10.65 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.031 179.66 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.41 HD11 ' OG ' ' A' ' 94' ' ' SER . 7.1 tt -143.36 139.33 26.52 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-O 121.169 0.509 . . . . 0.0 109.988 -179.045 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -57.21 142.69 42.0 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 115.508 -0.769 . . . . 0.0 112.057 -178.312 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 3.3 tp -54.1 -42.05 68.98 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.222 -0.899 . . . . 0.0 110.457 -179.337 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . 0.522 ' OD1' ' N ' ' A' ' 94' ' ' SER . 1.4 p30 -67.07 -39.07 86.79 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 179.273 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' SER . . . . . 0.763 ' OG ' HG23 ' A' ' 69' ' ' ILE . 6.7 t -66.24 -37.0 84.47 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.573 -0.74 . . . . 0.0 110.185 179.268 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . 0.41 ' CG1' HG23 ' A' ' 90' ' ' ILE . 38.5 mt -58.61 -38.3 70.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.137 179.973 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -70.88 -41.54 71.23 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.354 -0.538 . . . . 0.0 111.203 -179.003 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 60.7 m-70 . . . . . 0 C--N 1.325 -0.465 0 C-N-CA 119.408 -0.917 . . . . 0.0 109.303 179.791 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.567 ' N ' HD12 ' A' ' 14' ' ' ILE . 2.4 mp . . . . . 0 CA--C 1.522 -0.134 0 CA-C-O 120.92 0.39 . . . . 0.0 111.043 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -95.14 120.21 34.96 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.635 179.145 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 2.2 p90 -150.11 157.82 43.52 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 108.503 -0.925 . . . . 0.0 108.503 178.02 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -95.77 143.37 27.07 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 120.139 -0.624 . . . . 0.0 110.77 -179.372 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.559 ' O ' HD12 ' A' ' 32' ' ' LEU . . . -176.48 175.23 1.79 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.665 179.091 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -96.33 134.03 39.96 Favored 'General case' 0 C--N 1.326 -0.45 0 C-N-CA 120.647 -0.421 . . . . 0.0 111.141 -179.598 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.495 ' O ' ' O ' ' A' ' 31' ' ' VAL . 11.0 p -133.52 152.39 51.9 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.019 178.588 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.442 ' CG ' HH21 ' A' ' 28' ' ' ARG . 6.1 mm-40 -131.31 136.74 48.38 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 179.814 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 1.1 mm -117.45 135.37 58.08 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.552 0 C-N-CA 120.197 -0.601 . . . . 0.0 110.338 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -130.56 122.78 28.16 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.78 -179.321 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.535 ' OE1' ' CZ ' ' A' ' 57' ' ' PHE . 24.2 tt0 -124.64 101.78 7.28 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 114.735 -1.12 . . . . 0.0 109.823 179.097 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 82.14 -124.53 6.52 Favored Glycine 0 CA--C 1.523 0.557 0 N-CA-C 110.055 -1.218 . . . . 0.0 110.055 -178.952 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -100.53 10.64 40.91 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.776 0.322 . . . . 0.0 110.197 179.555 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.53 ' HB3' ' CZ2' ' A' ' 29' ' ' TRP . 17.5 mtt180 -112.58 133.57 54.56 Favored 'General case' 0 C--N 1.332 -0.158 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 -178.502 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.442 HH21 ' CG ' ' A' ' 21' ' ' GLU . 49.2 ttt180 -128.47 152.88 47.73 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.388 179.212 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.53 ' CZ2' ' HB3' ' A' ' 27' ' ' ARG . 6.6 m-90 -151.02 156.9 42.08 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.709 -178.691 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.538 ' CD ' ' H ' ' A' ' 30' ' ' GLU . 2.3 mp0 -99.94 136.18 40.24 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 179.159 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.495 ' O ' ' O ' ' A' ' 20' ' ' SER . 30.7 m -145.36 156.65 13.35 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-O 121.049 0.452 . . . . 0.0 111.001 -179.451 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.559 HD12 ' O ' ' A' ' 18' ' ' ALA . 10.7 tp -97.41 129.71 44.61 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 108.42 -0.956 . . . . 0.0 108.42 178.811 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.472 ' N ' HD12 ' A' ' 32' ' ' LEU . 0.5 OUTLIER -90.14 124.41 34.79 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.152 0.501 . . . . 0.0 110.111 -179.729 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 75.4 m-70 -91.02 -31.56 16.26 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.375 -0.829 . . . . 0.0 111.414 -178.87 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 1.9 p30 -170.8 161.87 7.4 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 119.577 -0.849 . . . . 0.0 111.125 177.387 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . 0.512 HG22 ' N ' ' A' ' 37' ' ' SER . 5.4 p -146.78 169.11 5.16 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.168 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.307 -178.572 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . 0.512 ' N ' HG22 ' A' ' 36' ' ' VAL . 14.7 t -140.09 171.78 13.7 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 107.956 -1.127 . . . . 0.0 107.956 178.224 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 4.0 tp -68.18 0.79 3.35 Favored 'General case' 0 C--N 1.324 -0.514 0 C-N-CA 120.124 -0.63 . . . . 0.0 111.185 -179.091 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -160.78 35.21 0.15 Allowed 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.573 -0.451 . . . . 0.0 111.141 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -174.02 159.93 29.55 Favored Glycine 0 CA--C 1.524 0.656 0 N-CA-C 110.943 -0.863 . . . . 0.0 110.943 179.673 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -148.22 148.91 15.7 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.277 0 CA-C-O 121.46 0.648 . . . . 0.0 111.839 -178.664 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -121.57 134.84 55.02 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 114.839 -1.073 . . . . 0.0 108.612 178.662 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 33.3 m -139.63 175.05 7.79 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-O 121.234 0.54 . . . . 0.0 111.698 -179.444 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -99.47 143.7 16.66 Favored Glycine 0 N--CA 1.467 0.746 0 N-CA-C 108.774 -1.73 . . . . 0.0 108.774 177.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . 0.52 ' CD ' ' O ' ' A' ' 45' ' ' GLN . 0.0 OUTLIER -85.66 121.7 73.3 Favored Pre-proline 0 CA--C 1.534 0.332 0 CA-C-N 118.221 1.01 . . . . 0.0 111.659 -178.314 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 79.8 Cg_endo -86.6 161.74 9.38 Favored 'Trans proline' 0 C--N 1.303 -1.82 0 C-N-CA 121.766 1.644 . . . . 0.0 111.106 178.447 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.4 mm100 -65.72 -39.65 91.41 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 111.9 0.334 . . . . 0.0 111.9 -179.32 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . 0.528 ' O ' ' N ' ' A' ' 50' ' ' ASN . 79.2 m-20 -72.48 8.7 1.29 Allowed 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 111.912 0.338 . . . . 0.0 111.912 -178.873 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' TRP . . . . . 0.462 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 64.8 t-105 -59.84 66.72 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 112.324 0.49 . . . . 0.0 112.324 -179.344 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . 0.538 ' ND2' ' O ' ' A' ' 50' ' ' ASN . 1.8 t30 -93.07 78.71 4.59 Favored 'General case' 0 C--N 1.326 -0.43 0 C-N-CA 119.947 -0.701 . . . . 0.0 109.302 178.176 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -144.39 144.23 13.11 Favored Glycine 0 CA--C 1.525 0.682 0 N-CA-C 111.578 -0.609 . . . . 0.0 111.578 -179.199 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -78.62 121.99 84.31 Favored Pre-proline 0 CA--C 1.534 0.357 0 CA-C-N 115.795 -0.203 . . . . 0.0 110.811 -179.898 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -60.93 -22.93 75.97 Favored 'Trans proline' 0 N--CA 1.495 1.59 0 C-N-CA 122.443 2.096 . . . . 0.0 112.433 -179.576 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.589 ' C ' ' HE ' ' A' ' 55' ' ' ARG . 28.2 mt-30 -75.5 -23.73 56.78 Favored 'General case' 0 C--N 1.323 -0.544 0 C-N-CA 120.36 -0.536 . . . . 0.0 111.059 -179.634 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.589 ' HE ' ' C ' ' A' ' 54' ' ' GLN . 0.0 OUTLIER -94.11 151.45 39.64 Favored Pre-proline 0 C--N 1.33 -0.252 0 CA-C-O 120.851 0.358 . . . . 0.0 110.043 179.981 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . 0.438 ' O ' ' OE1' ' A' ' 24' ' ' GLN . 33.2 Cg_endo -64.03 160.92 35.5 Favored 'Trans proline' 0 N--CA 1.495 1.615 0 C-N-CA 123.068 2.512 . . . . 0.0 113.532 -178.833 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.535 ' CZ ' ' OE1' ' A' ' 24' ' ' GLN . 58.7 m-85 -130.79 156.38 45.09 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 114.926 -1.034 . . . . 0.0 109.191 179.366 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -123.36 136.74 54.8 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 178.537 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . 0.605 ' HB2' HD13 ' A' ' 73' ' ' ILE . . . -115.33 135.42 54.16 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.971 0.415 . . . . 0.0 111.915 -178.545 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 3.7 mmm180 -122.91 127.42 48.92 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 108.547 -0.908 . . . . 0.0 108.547 177.725 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 13.5 mt -108.35 151.24 26.26 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.908 0.385 . . . . 0.0 111.001 -178.895 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' TYR . . . . . 0.407 ' CD1' ' N ' ' A' ' 62' ' ' TYR . 12.7 m-85 -134.61 110.68 9.47 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.62 179.809 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.472 ' C ' HD23 ' A' ' 63' ' ' LEU . 1.4 tt -106.01 -81.91 0.54 Allowed 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.625 179.608 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.464 ' H ' ' HB ' ' A' ' 67' ' ' VAL . . . -79.84 -177.88 50.96 Favored Glycine 0 CA--C 1.521 0.41 0 N-CA-C 109.343 -1.503 . . . . 0.0 109.343 178.678 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 5.5 mt -76.13 -33.42 59.43 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 119.806 -0.758 . . . . 0.0 110.478 -179.535 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -101.67 8.35 41.68 Favored 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 122.616 0.367 . . . . 0.0 110.849 179.886 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . 0.563 ' O ' HG12 ' A' ' 67' ' ' VAL . 12.1 t -103.95 94.1 2.99 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.195 0 CA-C-O 121.336 0.589 . . . . 0.0 111.877 -178.769 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 5.4 tp -113.65 117.33 31.26 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 108.088 -1.079 . . . . 0.0 108.088 178.156 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.516 HG23 ' CB ' ' A' ' 94' ' ' SER . 3.9 mt -112.09 144.39 19.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-O 120.943 0.401 . . . . 0.0 111.174 -178.814 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.442 ' C ' ' HG2' ' A' ' 71' ' ' MET . 0.5 OUTLIER -128.2 130.1 47.49 Favored 'General case' 0 C--O 1.239 0.547 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.653 179.183 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . 0.769 ' SD ' HD12 ' A' ' 90' ' ' ILE . 0.0 OUTLIER -138.54 146.83 42.37 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.771 -0.649 . . . . 0.0 109.829 179.551 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . 0.454 ' OE2' ' O ' ' A' ' 57' ' ' PHE . 15.4 tp10 -99.59 132.83 44.67 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 107.551 -1.277 . . . . 0.0 107.551 178.663 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.605 HD13 ' HB2' ' A' ' 59' ' ' ALA . 2.0 pt -143.16 157.17 17.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 C-N-CA 119.182 -1.007 . . . . 0.0 113.102 -177.732 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 7.2 m -123.11 155.87 36.1 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-N 115.111 -0.95 . . . . 0.0 110.022 179.043 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.587 HD22 ' CE1' ' A' ' 85' ' ' PHE . 0.2 OUTLIER -64.56 118.33 8.67 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.793 0.33 . . . . 0.0 110.698 -179.252 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . 0.556 ' N ' HD13 ' A' ' 75' ' ' LEU . . . -97.1 -43.32 7.45 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-O 121.136 0.493 . . . . 0.0 110.022 177.659 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' TRP . . . . . 0.569 ' NE1' ' HA3' ' A' ' 84' ' ' GLY . 67.5 p-90 -171.22 167.75 6.92 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.042 179.946 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -146.96 123.73 11.23 Favored 'General case' 0 N--CA 1.465 0.278 0 N-CA-C 109.878 -0.416 . . . . 0.0 109.878 178.575 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 10.9 ttp180 -152.48 134.23 14.69 Favored 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 113.163 0.801 . . . . 0.0 113.163 -179.98 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 56.97 47.18 18.12 Favored 'General case' 0 C--N 1.333 -0.15 0 N-CA-C 113.788 1.033 . . . . 0.0 113.788 176.487 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 82.39 -27.94 3.54 Favored Glycine 0 CA--C 1.523 0.58 0 C-N-CA 120.319 -0.943 . . . . 0.0 113.033 177.268 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 4.9 mt -89.39 154.0 20.4 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 117.381 0.59 . . . . 0.0 110.335 -179.004 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.427 HD11 ' CB ' ' A' ' 45' ' ' GLN . 70.1 mt -126.87 135.67 51.28 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.402 -178.969 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . 0.569 ' HA3' ' NE1' ' A' ' 77' ' ' TRP . . . -98.49 150.84 19.46 Favored Glycine 0 N--CA 1.45 -0.375 0 N-CA-C 109.546 -1.421 . . . . 0.0 109.546 178.64 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' PHE . . . . . 0.587 ' CE1' HD22 ' A' ' 75' ' ' LEU . 45.8 m-85 -145.57 134.85 22.95 Favored 'General case' 0 C--N 1.318 -0.766 0 C-N-CA 120.863 -0.335 . . . . 0.0 110.458 -179.542 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.466 ' CD ' HE22 ' A' ' 88' ' ' GLN . 5.7 tt0 -103.97 125.73 50.57 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 179.646 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -70.38 125.44 26.8 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.979 0.419 . . . . 0.0 111.542 -178.744 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . 0.466 HE22 ' CD ' ' A' ' 86' ' ' GLU . 29.3 mm-40 -98.22 -31.94 11.82 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.302 179.468 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . 0.472 ' ND1' ' C ' ' A' ' 89' ' ' HIS . 0.0 OUTLIER -160.48 141.59 12.06 Favored 'General case' 0 C--O 1.222 -0.342 0 CA-C-N 116.043 -0.526 . . . . 0.0 109.842 179.617 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.769 HD12 ' SD ' ' A' ' 71' ' ' MET . 7.1 tt -145.26 140.72 22.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-O 121.381 0.61 . . . . 0.0 110.235 -179.13 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . 0.545 ' OD1' ' N ' ' A' ' 92' ' ' LEU . 12.9 t0 -56.88 142.42 41.29 Favored 'General case' 0 N--CA 1.462 0.131 0 CA-C-N 115.148 -0.933 . . . . 0.0 112.003 -178.294 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.545 ' N ' ' OD1' ' A' ' 91' ' ' ASP . 6.5 tt -53.87 -41.84 67.96 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 114.82 -1.082 . . . . 0.0 110.233 -179.051 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . 0.43 ' N ' ' OD1' ' A' ' 91' ' ' ASP . 0.6 OUTLIER -67.52 -42.46 82.76 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.815 -0.439 . . . . 0.0 109.815 179.254 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' SER . . . . . 0.516 ' CB ' HG23 ' A' ' 69' ' ' ILE . 6.4 m -60.79 -37.8 83.17 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.176 179.615 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . 0.403 ' CG1' HG23 ' A' ' 90' ' ' ILE . 61.4 mt -58.62 -38.32 70.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.243 -179.991 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -70.97 -40.81 71.72 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.206 -0.597 . . . . 0.0 111.337 -179.131 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 68.7 m-70 . . . . . 0 C--N 1.326 -0.428 0 C-N-CA 119.503 -0.879 . . . . 0.0 109.316 179.945 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 40.5 mm . . . . . 0 CA--C 1.521 -0.149 0 CA-C-O 120.659 0.266 . . . . 0.0 110.412 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -95.58 119.86 34.82 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.33 0.586 . . . . 0.0 111.663 -179.861 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -149.93 154.64 38.62 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.036 -0.983 . . . . 0.0 108.433 177.816 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -95.57 147.03 24.0 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 120.013 -0.675 . . . . 0.0 111.478 -178.328 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.508 ' O ' HD12 ' A' ' 32' ' ' LEU . . . -179.11 176.8 0.85 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.698 -0.683 . . . . 0.0 109.846 179.375 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 22.2 t0 -96.11 134.26 39.39 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.95 -179.737 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.594 ' O ' ' O ' ' A' ' 31' ' ' VAL . 21.5 p -134.37 154.06 51.55 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.135 0.493 . . . . 0.0 110.263 179.002 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 18.7 mt-10 -135.29 143.16 46.08 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 109.041 -0.726 . . . . 0.0 109.041 179.487 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -122.35 136.3 59.64 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 C-N-CA 120.21 -0.596 . . . . 0.0 110.986 -179.023 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.47 ' H ' HD12 ' A' ' 23' ' ' LEU . 0.2 OUTLIER -123.89 123.32 40.17 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.927 -179.44 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.547 ' OE1' ' CZ ' ' A' ' 57' ' ' PHE . 20.6 tt0 -131.15 102.7 6.11 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.32 -0.855 . . . . 0.0 109.635 178.858 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 78.56 -128.38 8.64 Favored Glycine 0 CA--C 1.522 0.524 0 N-CA-C 109.77 -1.332 . . . . 0.0 109.77 -178.94 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -98.89 11.24 39.42 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.675 0.274 . . . . 0.0 110.456 179.612 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.586 ' HB3' ' CZ2' ' A' ' 29' ' ' TRP . 0.6 OUTLIER -111.78 132.5 54.62 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 121.007 0.432 . . . . 0.0 112.011 -179.056 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.417 ' HG2' ' N ' ' A' ' 29' ' ' TRP . 4.5 ttt85 -126.79 147.43 50.01 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.8 -0.637 . . . . 0.0 109.947 178.931 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.623 ' HE1' ' CG ' ' A' ' 48' ' ' ASP . 6.5 m-90 -145.85 155.44 42.9 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.497 -179.0 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.52 ' OE1' ' N ' ' A' ' 30' ' ' GLU . 0.0 OUTLIER -99.33 138.53 36.3 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 178.982 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.594 ' O ' ' O ' ' A' ' 20' ' ' SER . 17.7 m -149.12 157.82 6.67 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-O 121.226 0.536 . . . . 0.0 110.947 -179.335 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.544 HD12 ' N ' ' A' ' 33' ' ' LEU . 8.2 tp -98.24 129.84 44.97 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 107.975 -1.12 . . . . 0.0 107.975 178.511 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.544 ' N ' HD12 ' A' ' 32' ' ' LEU . 1.9 tt -92.17 126.46 37.26 Favored 'General case' 0 C--N 1.325 -0.489 0 C-N-CA 120.271 -0.572 . . . . 0.0 109.61 -179.922 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 73.4 m-70 -90.46 -28.16 18.78 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.428 -0.805 . . . . 0.0 111.732 -178.299 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -172.44 161.46 5.11 Favored 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 119.635 -0.826 . . . . 0.0 111.205 177.578 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . 0.532 HG22 ' H ' ' A' ' 37' ' ' SER . 4.8 p -144.92 168.99 8.57 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.165 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.949 -179.026 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . 0.532 ' H ' HG22 ' A' ' 36' ' ' VAL . 9.4 t -141.88 170.55 15.5 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 107.924 -1.139 . . . . 0.0 107.924 178.717 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.916 HD23 ' O ' ' A' ' 38' ' ' LEU . 4.0 tt -67.13 -1.08 3.85 Favored 'General case' 0 C--N 1.322 -0.611 0 C-N-CA 119.691 -0.804 . . . . 0.0 110.58 -179.243 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . 0.539 ' CE1' ' O ' ' A' ' 87' ' ' CYS . 26.1 t60 -159.86 35.4 0.18 Allowed 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 120.642 -0.423 . . . . 0.0 111.609 179.926 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -171.83 155.59 24.17 Favored Glycine 0 CA--C 1.528 0.862 0 N-CA-C 111.135 -0.786 . . . . 0.0 111.135 179.79 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -147.33 149.09 15.89 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.454 0 CA-C-O 121.368 0.604 . . . . 0.0 111.774 -179.182 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -122.7 139.58 53.8 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 115.205 -0.907 . . . . 0.0 109.185 178.984 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.0 m -144.1 175.29 3.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 121.178 0.514 . . . . 0.0 111.709 -179.474 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -97.18 145.47 17.87 Favored Glycine 0 CA--C 1.531 1.073 0 N-CA-C 109.692 -1.363 . . . . 0.0 109.692 178.545 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . 0.541 ' NE2' ' O ' ' A' ' 46' ' ' PRO . 17.9 tm0? -87.65 114.3 58.32 Favored Pre-proline 0 N--CA 1.467 0.411 0 CA-C-N 117.954 0.877 . . . . 0.0 112.06 -178.467 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.541 ' O ' ' NE2' ' A' ' 45' ' ' GLN . 83.7 Cg_endo -84.24 161.5 13.26 Favored 'Trans proline' 0 C--N 1.308 -1.557 0 C-N-CA 121.569 1.513 . . . . 0.0 110.97 178.524 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -65.26 -40.17 93.62 Favored 'General case' 0 N--CA 1.465 0.317 0 N-CA-C 112.7 0.629 . . . . 0.0 112.7 -178.621 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . 0.623 ' CG ' ' HE1' ' A' ' 29' ' ' TRP . 38.5 t0 -73.95 8.84 1.79 Allowed 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 112.068 0.396 . . . . 0.0 112.068 -178.571 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' TRP . . . . . 0.475 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 65.2 t-105 -59.17 69.32 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 111.636 0.235 . . . . 0.0 111.636 -179.781 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . 0.547 ' N ' ' O ' ' A' ' 48' ' ' ASP . 0.5 OUTLIER -93.41 78.82 4.4 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 120.203 -0.599 . . . . 0.0 110.019 178.913 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -142.52 159.48 27.22 Favored Glycine 0 CA--C 1.526 0.731 0 N-CA-C 111.22 -0.752 . . . . 0.0 111.22 -179.765 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 45.3 t0 -95.26 109.05 42.85 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-N 115.759 -0.22 . . . . 0.0 111.022 -179.544 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 78.1 Cg_exo -47.27 -22.69 2.59 Favored 'Trans proline' 0 N--CA 1.493 1.485 0 C-N-CA 122.358 2.039 . . . . 0.0 112.077 179.532 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.51 -23.84 53.7 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.285 -179.386 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.487 ' O ' ' CE1' ' A' ' 57' ' ' PHE . 26.6 mtm180 -95.26 155.22 39.1 Favored Pre-proline 0 N--CA 1.463 0.207 0 C-N-CA 120.616 -0.434 . . . . 0.0 110.22 179.635 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . 0.409 ' O ' ' OE1' ' A' ' 24' ' ' GLN . 9.3 Cg_exo -66.92 160.73 45.63 Favored 'Trans proline' 0 N--CA 1.493 1.49 0 C-N-CA 122.685 2.256 . . . . 0.0 113.305 -178.864 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.547 ' CZ ' ' OE1' ' A' ' 24' ' ' GLN . 49.3 m-85 -130.76 155.31 46.86 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 114.851 -1.068 . . . . 0.0 108.937 179.313 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -122.16 139.17 54.06 Favored 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 178.326 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -119.77 137.69 53.8 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 112.217 0.451 . . . . 0.0 112.217 -178.059 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 13.0 mtt180 -123.17 127.6 48.88 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 108.623 -0.88 . . . . 0.0 108.623 177.385 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.478 HD11 ' SD ' ' A' ' 71' ' ' MET . 9.7 mt -109.39 150.98 27.25 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.942 0.401 . . . . 0.0 110.757 -178.966 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' TYR . . . . . 0.425 ' CD1' ' N ' ' A' ' 62' ' ' TYR . 20.1 m-85 -132.61 109.68 9.91 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.438 179.73 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.484 ' C ' HD23 ' A' ' 63' ' ' LEU . 1.9 tt -104.55 -82.48 0.51 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.731 -0.668 . . . . 0.0 109.398 179.501 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.471 ' H ' ' HB ' ' A' ' 67' ' ' VAL . . . -78.68 179.01 52.82 Favored Glycine 0 CA--C 1.522 0.497 0 N-CA-C 109.156 -1.578 . . . . 0.0 109.156 178.423 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.698 HD22 ' N ' ' A' ' 65' ' ' LEU . 3.1 mm? -74.22 -33.06 63.25 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 119.827 -0.749 . . . . 0.0 110.118 -179.498 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -101.96 9.32 40.61 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.95 179.929 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . 0.564 ' O ' HG12 ' A' ' 67' ' ' VAL . 8.9 t -106.08 95.91 4.18 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.242 0 CA-C-O 121.309 0.576 . . . . 0.0 111.807 -178.621 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 6.5 tp -113.1 117.46 32.03 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 108.169 -1.049 . . . . 0.0 108.169 178.176 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.502 HG23 ' HB3' ' A' ' 94' ' ' SER . 3.5 mt -111.04 142.92 22.02 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-O 120.97 0.414 . . . . 0.0 110.836 -178.962 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 5.7 ttp180 -128.2 130.97 48.83 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.734 179.572 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . 0.478 ' SD ' HD11 ' A' ' 61' ' ' LEU . 0.0 OUTLIER -139.64 147.4 40.98 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.643 179.846 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -106.38 123.74 48.53 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 107.52 -1.289 . . . . 0.0 107.52 178.257 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.713 HD12 ' CB ' ' A' ' 85' ' ' PHE . 3.8 pt -134.47 162.35 39.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 N-CA-C 113.348 0.87 . . . . 0.0 113.348 -176.923 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 1.9 t -119.0 148.58 42.84 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 114.808 -1.087 . . . . 0.0 108.71 178.251 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.429 ' HA ' ' CD1' ' A' ' 85' ' ' PHE . 2.3 tt -66.46 126.74 29.79 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.569 0.7 . . . . 0.0 110.119 -179.127 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -98.2 -41.39 7.92 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 114.923 -1.035 . . . . 0.0 110.928 178.284 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' TRP . . . . . 0.545 ' NE1' ' HA3' ' A' ' 84' ' ' GLY . 69.2 p-90 -169.59 171.94 7.24 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.096 -179.409 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -149.19 123.13 9.37 Favored 'General case' 0 N--CA 1.465 0.301 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 177.725 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 20.4 ttt-85 -152.91 134.66 14.59 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 119.775 -0.77 . . . . 0.0 113.033 -179.882 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 56.54 46.84 19.78 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 113.372 0.878 . . . . 0.0 113.372 176.586 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 80.82 -25.22 3.53 Favored Glycine 0 CA--C 1.524 0.632 0 C-N-CA 120.485 -0.864 . . . . 0.0 113.082 177.479 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 7.6 mt -89.76 161.41 16.05 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 117.882 0.841 . . . . 0.0 110.825 -178.948 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 54.3 mt -136.37 136.24 39.48 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.278 -179.308 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . 0.545 ' HA3' ' NE1' ' A' ' 77' ' ' TRP . . . -109.61 156.2 15.72 Favored Glycine 0 N--CA 1.451 -0.316 0 N-CA-C 109.294 -1.522 . . . . 0.0 109.294 178.169 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' PHE . . . . . 0.713 ' CB ' HD12 ' A' ' 73' ' ' ILE . 81.4 m-85 -145.46 143.3 29.94 Favored 'General case' 0 C--N 1.318 -0.788 0 C-N-CA 120.829 -0.348 . . . . 0.0 110.214 -179.655 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.485 ' OE2' ' CD2' ' A' ' 39' ' ' HIS . 14.5 tm-20 -103.37 128.74 50.4 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 179.276 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . 0.539 ' O ' ' CE1' ' A' ' 39' ' ' HIS . 41.0 t -78.28 127.14 31.8 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 112.267 0.469 . . . . 0.0 112.267 -178.236 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -102.98 -27.99 12.28 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.462 179.367 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . 0.558 ' ND1' ' N ' ' A' ' 90' ' ' ILE . 0.0 OUTLIER -160.46 141.28 11.88 Favored 'General case' 0 C--O 1.227 -0.104 0 CA-C-O 121.019 0.438 . . . . 0.0 110.55 179.433 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.558 ' N ' ' ND1' ' A' ' 89' ' ' HIS . 9.3 tt -145.74 141.16 21.99 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.966 -179.843 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 5.5 t0 -54.67 141.9 30.38 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 115.334 -0.848 . . . . 0.0 112.23 -178.248 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.434 ' HA ' HD12 ' A' ' 95' ' ' ILE . 57.3 tp -54.12 -41.97 68.93 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 114.929 -1.032 . . . . 0.0 109.979 -179.704 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -68.89 -41.53 78.15 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 109.558 -0.534 . . . . 0.0 109.558 179.228 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' SER . . . . . 0.502 ' HB3' HG23 ' A' ' 69' ' ' ILE . 13.4 m -61.39 -37.3 82.93 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.863 -0.608 . . . . 0.0 109.878 179.325 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . 0.457 ' CG1' HG23 ' A' ' 90' ' ' ILE . 47.6 mt -58.62 -38.03 68.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 115.635 -0.712 . . . . 0.0 110.011 179.74 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -70.86 -37.79 73.11 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 120.266 -0.574 . . . . 0.0 110.686 -179.465 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 73.5 m-70 . . . . . 0 C--N 1.326 -0.448 0 C-N-CA 119.657 -0.817 . . . . 0.0 109.235 179.491 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 42.2 mm . . . . . 0 CA--C 1.522 -0.121 0 CA-C-O 120.566 0.222 . . . . 0.0 110.887 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -93.75 120.39 33.96 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.315 0.579 . . . . 0.0 111.19 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 2.3 p90 -149.76 157.66 43.42 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.164 -0.926 . . . . 0.0 108.683 178.045 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -95.6 146.21 24.65 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 120.343 -0.543 . . . . 0.0 110.502 -179.472 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . 179.32 174.45 0.76 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.367 179.703 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -96.15 133.84 39.94 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.544 179.924 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.531 ' O ' ' O ' ' A' ' 31' ' ' VAL . 3.3 p -134.64 154.11 51.66 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.976 0.417 . . . . 0.0 110.18 179.076 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -132.93 143.67 49.63 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.172 -0.677 . . . . 0.0 109.172 179.427 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 53.3 mt -124.33 136.41 60.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 C-N-CA 120.176 -0.61 . . . . 0.0 111.184 -179.477 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.596 ' H ' HD12 ' A' ' 23' ' ' LEU . 0.0 OUTLIER -121.11 123.39 42.2 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.659 -179.34 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.607 HE22 ' N ' ' A' ' 52' ' ' ASP . 3.4 tt0 -130.78 101.9 5.86 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.135 -0.939 . . . . 0.0 109.551 179.361 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 78.37 -129.08 9.1 Favored Glycine 0 CA--C 1.523 0.553 0 N-CA-C 109.785 -1.326 . . . . 0.0 109.785 -178.668 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 19.2 pt-20 -98.81 11.49 38.56 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.903 0.382 . . . . 0.0 110.21 179.367 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.486 ' HB3' ' CZ2' ' A' ' 29' ' ' TRP . 1.1 mpt_? -112.42 133.79 54.31 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.074 -0.512 . . . . 0.0 112.01 -178.922 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 17.2 ttt180 -127.12 149.58 49.88 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.873 -0.603 . . . . 0.0 109.764 178.777 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.566 ' NE1' ' O ' ' A' ' 48' ' ' ASP . 6.1 m-90 -147.74 156.45 42.76 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.769 -178.927 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 78.1 mt-10 -99.3 131.3 45.42 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.693 -0.685 . . . . 0.0 109.212 178.81 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.531 ' O ' ' O ' ' A' ' 20' ' ' SER . 14.4 m -137.15 154.7 31.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-O 121.256 0.551 . . . . 0.0 111.214 -179.504 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 13.0 tp -95.23 126.57 40.64 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 108.531 -0.914 . . . . 0.0 108.531 178.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.471 ' HG ' ' N ' ' A' ' 34' ' ' HIS . 2.3 tt -83.02 150.75 26.15 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 179.631 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' HIS . . . . . 0.471 ' N ' ' HG ' ' A' ' 33' ' ' LEU . 64.7 m-70 -123.01 -28.33 4.08 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.155 179.604 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -173.83 160.62 3.65 Favored 'General case' 0 C--N 1.327 -0.413 0 C-N-CA 119.802 -0.759 . . . . 0.0 111.109 176.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . 0.538 HG22 ' N ' ' A' ' 37' ' ' SER . 6.5 p -145.24 169.08 7.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.146 -179.06 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . 0.538 ' N ' HG22 ' A' ' 36' ' ' VAL . 29.8 t -142.17 167.68 21.55 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 107.985 -1.117 . . . . 0.0 107.985 178.6 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 2.7 pp -62.99 -0.16 0.65 Allowed 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 119.758 -0.777 . . . . 0.0 110.963 -179.157 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . 0.427 ' H ' ' C ' ' A' ' 37' ' ' SER . 0.4 OUTLIER -165.61 43.04 0.07 Allowed 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 120.793 -0.363 . . . . 0.0 111.467 -179.91 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -178.85 154.95 15.09 Favored Glycine 0 CA--C 1.528 0.881 0 N-CA-C 110.816 -0.914 . . . . 0.0 110.816 179.812 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.426 ' CG2' HG21 ' A' ' 73' ' ' ILE . 0.1 OUTLIER -148.21 148.77 15.84 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.238 0 CA-C-O 121.469 0.652 . . . . 0.0 111.873 -178.9 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.458 HD23 ' N ' ' A' ' 43' ' ' VAL . 0.9 OUTLIER -120.79 132.42 55.02 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 114.813 -1.085 . . . . 0.0 108.187 178.355 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.458 ' N ' HD23 ' A' ' 42' ' ' LEU . 5.4 m -139.26 175.9 6.88 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-O 121.368 0.604 . . . . 0.0 111.821 -178.737 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -98.0 143.87 16.94 Favored Glycine 0 CA--C 1.529 0.968 0 N-CA-C 109.758 -1.337 . . . . 0.0 109.758 178.148 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . 0.483 ' O ' ' OE1' ' A' ' 45' ' ' GLN . 1.7 tm0? -85.78 117.73 69.26 Favored Pre-proline 0 N--CA 1.466 0.345 0 CA-C-N 117.625 0.713 . . . . 0.0 111.686 -178.78 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_endo -86.79 161.76 9.1 Favored 'Trans proline' 0 C--N 1.311 -1.446 0 C-N-CA 121.628 1.552 . . . . 0.0 111.037 178.687 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.579 ' CD ' ' H ' ' A' ' 47' ' ' GLN . 1.2 mp0 -65.49 -40.63 93.31 Favored 'General case' 0 N--CA 1.467 0.407 0 N-CA-C 112.604 0.594 . . . . 0.0 112.604 -178.877 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . 0.566 ' O ' ' NE1' ' A' ' 29' ' ' TRP . 1.2 m-20 -72.2 8.56 1.27 Allowed 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 111.866 0.321 . . . . 0.0 111.866 -178.371 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' TRP . . . . . 0.463 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 63.5 t-105 -60.13 68.9 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.55 -0.295 . . . . 0.0 111.717 -179.521 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . 0.551 ' C ' HD22 ' A' ' 50' ' ' ASN . 0.7 OUTLIER -93.35 78.76 4.44 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 120.074 -0.651 . . . . 0.0 109.806 178.737 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . 0.474 ' CA ' HE22 ' A' ' 24' ' ' GLN . . . -143.93 151.22 23.19 Favored Glycine 0 CA--C 1.525 0.707 0 N-CA-C 110.896 -0.882 . . . . 0.0 110.896 -179.729 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . 0.607 ' N ' HE22 ' A' ' 24' ' ' GLN . 11.0 t0 -88.17 114.18 58.29 Favored Pre-proline 0 CA--C 1.536 0.415 0 CA-C-O 120.339 0.114 . . . . 0.0 111.014 -179.677 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_exo -46.93 -22.42 2.0 Favored 'Trans proline' 0 N--CA 1.497 1.694 0 C-N-CA 122.735 2.29 . . . . 0.0 112.671 179.618 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -78.27 -24.12 46.94 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 120.571 -0.452 . . . . 0.0 111.894 -178.632 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.553 ' O ' ' CE1' ' A' ' 57' ' ' PHE . 12.7 mtp85 -93.9 152.59 40.69 Favored Pre-proline 0 C--N 1.33 -0.247 0 C-N-CA 120.598 -0.441 . . . . 0.0 110.177 179.839 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_endo -65.01 160.57 40.89 Favored 'Trans proline' 0 N--CA 1.495 1.565 0 C-N-CA 122.734 2.289 . . . . 0.0 112.93 -178.912 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.553 ' CE1' ' O ' ' A' ' 55' ' ' ARG . 43.1 m-85 -130.41 156.43 44.76 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.094 -0.957 . . . . 0.0 109.17 179.469 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.428 ' O ' HD12 ' A' ' 23' ' ' LEU . 35.8 mt-10 -123.1 136.8 54.95 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 178.357 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . 0.602 ' HB2' ' CD1' ' A' ' 73' ' ' ILE . . . -116.66 136.08 53.26 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.097 0.475 . . . . 0.0 111.931 -178.152 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 16.1 mmm-85 -123.02 127.56 48.95 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 177.864 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 6.9 mt -105.99 151.06 25.1 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.063 0.458 . . . . 0.0 111.243 -178.43 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' TYR . . . . . 0.478 ' CD1' ' N ' ' A' ' 62' ' ' TYR . 13.6 m-85 -135.88 108.9 7.66 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.002 179.291 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -105.34 -81.3 0.54 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.681 -0.69 . . . . 0.0 109.589 179.911 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.472 ' H ' ' HB ' ' A' ' 67' ' ' VAL . . . -78.82 -176.44 47.93 Favored Glycine 0 CA--C 1.521 0.428 0 N-CA-C 109.254 -1.538 . . . . 0.0 109.254 178.421 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.616 ' H ' HD23 ' A' ' 65' ' ' LEU . 0.3 OUTLIER -76.39 -33.34 58.88 Favored 'General case' 0 C--N 1.329 -0.326 0 C-N-CA 119.918 -0.713 . . . . 0.0 110.59 -179.62 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . 0.41 ' OD1' ' O ' ' A' ' 66' ' ' ASP . 48.2 t0 -103.06 9.21 38.64 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 122.753 0.421 . . . . 0.0 111.075 -179.789 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . 0.472 ' HB ' ' H ' ' A' ' 64' ' ' GLY . 28.7 t -103.33 95.21 3.66 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.249 0 CA-C-O 121.288 0.566 . . . . 0.0 111.698 -178.652 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.661 HD12 ' N ' ' A' ' 69' ' ' ILE . 1.3 tp -114.2 117.6 31.65 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 178.917 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.661 ' N ' HD12 ' A' ' 68' ' ' LEU . 18.7 mm -113.15 145.24 19.35 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.252 0 CA-C-O 121.012 0.434 . . . . 0.0 111.726 -178.422 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 3.2 ptm180 -128.51 133.42 48.44 Favored 'General case' 0 C--O 1.239 0.502 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.078 179.133 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -146.16 150.42 35.84 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.273 -0.876 . . . . 0.0 110.144 -179.765 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -103.81 128.2 51.25 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 107.851 -1.166 . . . . 0.0 107.851 178.335 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.602 ' CD1' ' HB2' ' A' ' 59' ' ' ALA . 14.5 pt -135.97 156.98 38.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 C-N-CA 119.995 -0.682 . . . . 0.0 112.757 -177.594 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 31.3 t -122.41 151.35 41.34 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 114.781 -1.1 . . . . 0.0 109.903 179.195 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.56 HD12 ' CE1' ' A' ' 85' ' ' PHE . 7.1 tp -66.21 121.2 14.66 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.184 0.516 . . . . 0.0 110.365 -179.68 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -97.57 -42.57 7.62 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 115.454 -0.793 . . . . 0.0 110.522 178.175 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' TRP . . . . . 0.586 ' NE1' ' HA3' ' A' ' 84' ' ' GLY . 66.8 p-90 -168.52 167.37 11.69 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 115.419 -0.809 . . . . 0.0 110.084 -179.357 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -147.51 123.77 10.89 Favored 'General case' 0 N--CA 1.465 0.325 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 178.612 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 33.9 ttt85 -152.4 134.29 14.81 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 119.789 -0.764 . . . . 0.0 113.043 179.87 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 57.05 47.3 17.7 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 113.781 1.03 . . . . 0.0 113.781 176.839 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 82.78 -27.48 3.82 Favored Glycine 0 CA--C 1.522 0.495 0 C-N-CA 120.292 -0.956 . . . . 0.0 113.28 177.075 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 3.9 mt -89.67 158.85 17.4 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 117.744 0.772 . . . . 0.0 110.153 -179.096 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 63.4 mt -130.68 135.44 47.83 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.387 -179.119 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . 0.586 ' HA3' ' NE1' ' A' ' 77' ' ' TRP . . . -93.93 151.69 20.38 Favored Glycine 0 N--CA 1.448 -0.561 0 N-CA-C 109.477 -1.449 . . . . 0.0 109.477 178.434 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' PHE . . . . . 0.56 ' CE1' HD12 ' A' ' 75' ' ' LEU . 26.8 m-85 -145.81 131.3 18.73 Favored 'General case' 0 C--N 1.317 -0.823 0 C-N-CA 120.647 -0.421 . . . . 0.0 110.692 -179.234 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.527 ' OE1' ' NE2' ' A' ' 88' ' ' GLN . 4.0 tt0 -103.76 127.56 51.23 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 179.664 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . 0.531 ' HA ' HG22 ' A' ' 73' ' ' ILE . 4.9 t -70.67 122.77 20.42 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.929 0.395 . . . . 0.0 111.907 -178.616 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . 0.527 ' NE2' ' OE1' ' A' ' 86' ' ' GLU . 32.0 mm-40 -94.74 -32.43 13.33 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.898 -0.592 . . . . 0.0 109.774 179.16 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . 0.498 ' ND1' ' N ' ' A' ' 90' ' ' ILE . 0.0 OUTLIER -163.38 143.72 8.93 Favored 'General case' 0 C--O 1.223 -0.316 0 CA-C-N 115.74 -0.664 . . . . 0.0 109.984 179.751 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.498 ' N ' ' ND1' ' A' ' 89' ' ' HIS . 10.7 tt -144.89 141.06 23.32 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-O 121.379 0.609 . . . . 0.0 109.918 -179.83 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . 0.553 ' O ' ' OG ' ' A' ' 94' ' ' SER . 4.7 t0 -56.43 142.11 39.8 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-N 115.209 -0.905 . . . . 0.0 112.1 -177.903 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 3.7 tp -54.44 -41.56 69.55 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 114.885 -1.052 . . . . 0.0 109.895 -179.635 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -70.51 -37.71 74.2 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.208 179.45 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' SER . . . . . 0.553 ' OG ' ' O ' ' A' ' 91' ' ' ASP . 2.2 p -63.16 -35.18 79.44 Favored 'General case' 0 C--N 1.333 -0.149 0 N-CA-C 109.841 -0.429 . . . . 0.0 109.841 179.706 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 36.2 mt -62.08 -39.16 82.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.209 179.539 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -70.53 -42.73 70.83 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.386 -0.526 . . . . 0.0 111.785 -178.371 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 57.4 m-70 . . . . . 0 C--N 1.323 -0.567 0 C-N-CA 119.153 -1.019 . . . . 0.0 109.264 -179.778 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.782 ' N ' HD12 ' A' ' 14' ' ' ILE . 1.9 mp . . . . . 0 CA--C 1.519 -0.215 0 N-CA-C 110.276 -0.268 . . . . 0.0 110.276 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -93.0 120.57 33.43 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.297 0.57 . . . . 0.0 111.402 -179.524 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 2.0 p90 -149.68 157.06 42.88 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.135 -0.939 . . . . 0.0 108.565 178.134 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -95.55 147.22 23.8 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 120.341 -0.544 . . . . 0.0 110.62 -179.223 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . 178.94 176.2 0.57 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.241 179.795 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -96.43 134.51 39.51 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.933 -179.608 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.654 ' O ' ' O ' ' A' ' 31' ' ' VAL . 11.5 p -136.48 159.93 40.29 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.07 179.092 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.474 ' OE2' HD21 ' A' ' 23' ' ' LEU . 0.3 OUTLIER -148.29 145.2 28.07 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 108.717 -0.845 . . . . 0.0 108.717 178.772 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . 0.471 ' N ' ' OE1' ' A' ' 21' ' ' GLU . 61.6 mt -119.58 136.73 55.77 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.323 0 CA-C-O 121.237 0.542 . . . . 0.0 112.056 -177.776 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.758 ' H ' HD12 ' A' ' 23' ' ' LEU . 0.0 OUTLIER -117.8 123.24 45.46 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.492 -0.776 . . . . 0.0 110.443 179.678 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.433 ' HG3' ' O ' ' A' ' 56' ' ' PRO . 38.1 tt0 -129.26 101.42 5.99 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.446 -0.797 . . . . 0.0 109.823 179.101 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 78.09 -126.78 7.84 Favored Glycine 0 CA--C 1.521 0.418 0 N-CA-C 109.877 -1.289 . . . . 0.0 109.877 -179.089 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.457 ' OE1' ' O ' ' A' ' 26' ' ' GLU . 0.0 OUTLIER -100.24 9.82 42.16 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.894 0.378 . . . . 0.0 110.084 179.53 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.496 ' HB3' ' CZ2' ' A' ' 29' ' ' TRP . 36.7 mtt85 -112.37 134.62 53.81 Favored 'General case' 0 CA--C 1.521 -0.15 0 CA-C-N 116.06 -0.518 . . . . 0.0 112.066 -178.806 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.405 ' HG2' ' N ' ' A' ' 29' ' ' TRP . 60.1 ttt-85 -129.24 150.15 50.74 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.346 179.852 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.528 ' NE1' ' O ' ' A' ' 48' ' ' ASP . 6.5 m-90 -147.49 155.01 41.48 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.171 -179.169 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.608 ' CD ' ' H ' ' A' ' 30' ' ' GLU . 1.4 mp0 -101.23 140.32 35.69 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 179.517 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.654 ' O ' ' O ' ' A' ' 20' ' ' SER . 18.9 m -148.89 157.11 7.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-O 121.149 0.499 . . . . 0.0 111.121 -179.466 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 1.093 ' H ' HD23 ' A' ' 32' ' ' LEU . 1.2 pt? -95.71 129.82 42.81 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 108.456 -0.942 . . . . 0.0 108.456 178.294 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.423 HD13 HD21 ' A' ' 61' ' ' LEU . 1.4 tt -93.57 126.11 38.54 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.403 0.62 . . . . 0.0 110.239 -179.255 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 50.2 m-70 -90.65 -25.75 19.95 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.009 -0.996 . . . . 0.0 111.863 -178.375 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -175.2 161.78 2.89 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 119.721 -0.792 . . . . 0.0 111.341 177.78 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . 0.528 HG22 ' H ' ' A' ' 37' ' ' SER . 4.3 p -143.42 168.37 12.47 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.157 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.871 -179.472 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . 0.528 ' H ' HG22 ' A' ' 36' ' ' VAL . 25.3 t -142.92 167.06 22.97 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 107.789 -1.189 . . . . 0.0 107.789 178.399 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.488 ' C ' ' CG ' ' A' ' 39' ' ' HIS . 1.0 OUTLIER -63.28 -1.32 1.04 Allowed 'General case' 0 C--N 1.322 -0.588 0 C-N-CA 119.602 -0.839 . . . . 0.0 110.31 -179.811 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . 0.488 ' CG ' ' C ' ' A' ' 38' ' ' LEU . 0.0 OUTLIER -163.3 46.31 0.13 Allowed 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 120.713 -0.395 . . . . 0.0 111.301 179.995 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 177.14 153.58 11.05 Favored Glycine 0 CA--C 1.528 0.86 0 N-CA-C 111.221 -0.752 . . . . 0.0 111.221 179.568 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -148.77 149.36 15.08 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.255 0 CA-C-O 121.33 0.586 . . . . 0.0 111.64 -179.198 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -121.18 136.47 54.97 Favored 'General case' 0 N--CA 1.464 0.27 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 178.685 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 19.3 m -140.22 175.29 6.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 C-N-CA 120.226 -0.589 . . . . 0.0 111.887 -179.561 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -97.3 144.36 17.28 Favored Glycine 0 CA--C 1.527 0.829 0 N-CA-C 109.247 -1.541 . . . . 0.0 109.247 177.938 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 60.4 tt0 -86.82 114.66 59.23 Favored Pre-proline 0 N--CA 1.466 0.349 0 CA-C-N 117.938 0.869 . . . . 0.0 111.839 -178.504 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 93.8 Cg_endo -84.85 162.7 12.03 Favored 'Trans proline' 0 C--N 1.31 -1.488 0 C-N-CA 121.81 1.674 . . . . 0.0 111.774 178.938 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.705 ' NE2' ' H ' ' A' ' 48' ' ' ASP . 0.4 OUTLIER -65.54 -40.1 92.5 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 112.438 0.532 . . . . 0.0 112.438 -178.981 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . 0.705 ' H ' ' NE2' ' A' ' 47' ' ' GLN . 37.6 m-20 -74.21 8.79 1.93 Allowed 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 111.895 0.331 . . . . 0.0 111.895 -178.645 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' TRP . . . . . 0.48 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 62.3 t-105 -60.79 69.01 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 112.006 0.373 . . . . 0.0 112.006 -179.525 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . 0.579 HD22 ' C ' ' A' ' 50' ' ' ASN . 0.2 OUTLIER -92.96 80.07 4.61 Favored 'General case' 0 C--N 1.326 -0.43 0 C-N-CA 119.84 -0.744 . . . . 0.0 109.439 178.476 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -143.17 146.08 16.53 Favored Glycine 0 CA--C 1.524 0.596 0 N-CA-C 111.341 -0.703 . . . . 0.0 111.341 -179.301 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 53.9 t0 -84.42 113.95 51.92 Favored Pre-proline 0 CA--C 1.533 0.305 0 CA-C-N 115.96 -0.12 . . . . 0.0 110.705 179.817 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_exo -48.0 -22.33 3.41 Favored 'Trans proline' 0 N--CA 1.497 1.716 0 C-N-CA 122.517 2.144 . . . . 0.0 112.194 179.854 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 34.5 mm-40 -77.63 -24.11 49.6 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.132 -0.485 . . . . 0.0 112.044 -178.703 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.564 ' O ' ' CE1' ' A' ' 57' ' ' PHE . 39.1 mtp85 -95.15 151.64 38.91 Favored Pre-proline 0 N--CA 1.464 0.245 0 C-N-CA 120.573 -0.451 . . . . 0.0 110.436 -179.703 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . 0.433 ' O ' ' HG3' ' A' ' 24' ' ' GLN . 38.3 Cg_endo -65.59 161.09 40.09 Favored 'Trans proline' 0 N--CA 1.498 1.751 0 C-N-CA 123.156 2.571 . . . . 0.0 113.072 -178.855 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.564 ' CE1' ' O ' ' A' ' 55' ' ' ARG . 42.7 m-85 -131.59 156.29 46.04 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.344 -0.843 . . . . 0.0 109.572 179.587 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.508 ' O ' HD12 ' A' ' 23' ' ' LEU . 29.2 mt-10 -120.35 133.95 55.35 Favored 'General case' 0 N--CA 1.469 0.475 0 N-CA-C 108.913 -0.773 . . . . 0.0 108.913 178.043 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . 0.687 ' HB2' HD11 ' A' ' 73' ' ' ILE . . . -114.36 136.28 53.16 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.149 0.5 . . . . 0.0 111.998 -178.332 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.663 ' HG3' HD11 ' A' ' 23' ' ' LEU . 12.1 mmt180 -123.12 127.86 49.29 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 108.352 -0.981 . . . . 0.0 108.352 177.644 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.568 HD12 ' C ' ' A' ' 60' ' ' ARG . 10.7 mp -108.16 147.14 31.7 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 120.33 -0.548 . . . . 0.0 110.683 -179.316 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' TYR . . . . . 0.513 ' CD1' ' N ' ' A' ' 62' ' ' TYR . 4.2 m-85 -130.6 111.1 11.91 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.353 179.77 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 1.8 tt -106.57 -79.33 0.57 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.852 -0.613 . . . . 0.0 109.938 179.781 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.451 ' H ' ' HB ' ' A' ' 67' ' ' VAL . . . -80.99 -177.33 51.58 Favored Glycine 0 CA--C 1.52 0.404 0 N-CA-C 109.372 -1.491 . . . . 0.0 109.372 178.643 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 12.1 mt -76.07 -32.62 59.35 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 119.725 -0.79 . . . . 0.0 110.452 -179.441 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -104.16 8.91 36.38 Favored 'General case' 0 C--N 1.332 -0.185 0 C-N-CA 122.656 0.382 . . . . 0.0 111.222 -179.825 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . 0.451 ' HB ' ' H ' ' A' ' 64' ' ' GLY . 37.6 t -104.8 96.29 4.48 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.294 0 CA-C-O 121.37 0.605 . . . . 0.0 111.654 -179.072 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.503 HD12 ' N ' ' A' ' 69' ' ' ILE . 3.1 tp -116.06 117.52 30.33 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 107.95 -1.13 . . . . 0.0 107.95 178.659 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.503 ' N ' HD12 ' A' ' 68' ' ' LEU . 20.9 mm -111.8 146.3 16.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.639 -178.29 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.426 ' C ' ' HG2' ' A' ' 71' ' ' MET . 0.0 OUTLIER -128.36 130.49 47.82 Favored 'General case' 0 C--O 1.238 0.481 0 CA-C-O 121.25 0.548 . . . . 0.0 111.134 178.817 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . 0.802 ' SD ' HD12 ' A' ' 90' ' ' ILE . 1.2 mtm -140.66 148.2 40.46 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.494 -0.775 . . . . 0.0 110.002 179.629 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . 0.457 ' OE2' ' O ' ' A' ' 57' ' ' PHE . 10.6 tp10 -100.74 128.47 46.77 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 107.678 -1.23 . . . . 0.0 107.678 178.666 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.687 HD11 ' HB2' ' A' ' 59' ' ' ALA . 9.2 pt -138.83 157.23 29.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 C-N-CA 119.601 -0.84 . . . . 0.0 112.965 -177.644 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -121.82 150.99 41.11 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 114.787 -1.097 . . . . 0.0 109.613 178.765 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.526 HD12 ' CE1' ' A' ' 85' ' ' PHE . 7.3 tp -66.48 123.46 20.08 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.425 0.631 . . . . 0.0 110.457 -179.666 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -98.18 -43.63 6.92 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 114.959 -1.019 . . . . 0.0 111.115 178.168 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' TRP . . . . . 0.589 ' NE1' ' HA3' ' A' ' 84' ' ' GLY . 68.7 p-90 -167.56 171.21 10.52 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.436 -179.124 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -151.09 123.87 8.58 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 116.541 -0.3 . . . . 0.0 110.305 178.776 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 8.1 ttt85 -152.33 133.6 14.38 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 112.821 0.674 . . . . 0.0 112.821 179.494 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . 0.414 ' O ' ' OD1' ' A' ' 80' ' ' ASP . 8.3 t70 56.4 47.41 19.02 Favored 'General case' 0 N--CA 1.464 0.26 0 N-CA-C 113.528 0.936 . . . . 0.0 113.528 176.506 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 69.43 12.72 66.93 Favored Glycine 0 CA--C 1.523 0.558 0 C-N-CA 120.305 -0.95 . . . . 0.0 111.931 178.188 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 49.5 mt -117.65 139.67 50.7 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 108.739 -0.837 . . . . 0.0 108.739 178.665 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 44.9 mt -122.72 135.06 54.46 Favored 'General case' 0 CA--C 1.513 -0.455 0 C-N-CA 120.359 -0.536 . . . . 0.0 111.179 -179.311 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . 0.589 ' HA3' ' NE1' ' A' ' 77' ' ' TRP . . . -97.81 153.63 20.14 Favored Glycine 0 N--CA 1.448 -0.558 0 N-CA-C 109.474 -1.451 . . . . 0.0 109.474 178.868 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' PHE . . . . . 0.537 ' CG ' HD12 ' A' ' 73' ' ' ILE . 27.8 m-85 -145.44 132.16 19.99 Favored 'General case' 0 C--N 1.314 -0.966 0 C-N-CA 120.788 -0.365 . . . . 0.0 110.668 -179.183 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 55.9 tt0 -103.92 127.88 51.44 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 179.726 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . 0.519 ' HA ' HG22 ' A' ' 73' ' ' ILE . 0.5 OUTLIER -76.62 125.86 29.98 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.065 0.459 . . . . 0.0 111.626 -178.715 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -103.46 -29.26 11.29 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.236 179.701 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . 0.459 ' ND1' ' C ' ' A' ' 89' ' ' HIS . 0.0 OUTLIER -160.35 141.2 11.97 Favored 'General case' 0 C--O 1.223 -0.318 0 CA-C-O 120.947 0.403 . . . . 0.0 110.462 179.542 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.802 HD12 ' SD ' ' A' ' 71' ' ' MET . 7.5 tt -146.01 141.06 21.6 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.131 -179.619 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -56.75 138.82 52.42 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 115.194 -0.912 . . . . 0.0 111.864 -178.321 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 1.8 tt -54.09 -41.46 68.28 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 115.078 -0.965 . . . . 0.0 110.304 -179.849 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -67.88 -36.1 79.67 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 179.321 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 3.9 m -68.62 -37.39 79.72 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.869 179.355 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . 0.405 ' CG1' HG23 ' A' ' 90' ' ' ILE . 54.7 mt -58.9 -38.75 75.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.721 -179.757 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -70.67 -41.21 72.38 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 120.332 -0.547 . . . . 0.0 111.502 -178.385 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 58.5 m-70 . . . . . 0 C--N 1.324 -0.507 0 C-N-CA 119.272 -0.971 . . . . 0.0 109.216 179.875 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.806 ' N ' HD12 ' A' ' 14' ' ' ILE . 1.8 mp . . . . . 0 CA--C 1.52 -0.208 0 N-CA-C 109.944 -0.391 . . . . 0.0 109.944 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -93.35 120.4 33.6 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.358 0.599 . . . . 0.0 111.435 -179.493 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -149.7 156.19 41.46 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.029 -0.987 . . . . 0.0 108.509 178.01 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -95.38 148.04 22.87 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 120.271 -0.571 . . . . 0.0 110.646 -178.888 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.502 ' O ' HD12 ' A' ' 32' ' ' LEU . . . 178.73 178.69 0.42 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.695 -0.684 . . . . 0.0 109.852 179.565 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 63.1 t0 -96.63 133.78 40.7 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.76 179.946 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.573 ' O ' ' O ' ' A' ' 31' ' ' VAL . 13.0 p -134.11 154.03 51.45 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.013 0.435 . . . . 0.0 110.164 178.818 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -135.36 145.99 47.93 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 179.519 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . 0.489 ' CD1' HD11 ' A' ' 73' ' ' ILE . 1.1 mm -124.83 136.28 61.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-O 121.278 0.561 . . . . 0.0 110.865 -179.092 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.475 HD13 ' NE ' ' A' ' 60' ' ' ARG . 0.3 OUTLIER -123.0 124.1 42.38 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.85 -179.615 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.523 ' O ' ' OE1' ' A' ' 24' ' ' GLN . 1.7 tm0? -130.92 102.2 5.95 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.418 -0.81 . . . . 0.0 109.459 178.774 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 79.04 -128.03 8.34 Favored Glycine 0 CA--C 1.525 0.659 0 N-CA-C 110.016 -1.234 . . . . 0.0 110.016 -178.705 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -99.75 12.07 37.6 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.732 0.301 . . . . 0.0 110.373 179.567 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.505 ' HB3' ' CZ2' ' A' ' 29' ' ' TRP . 0.0 OUTLIER -112.68 133.56 54.64 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.25 -0.432 . . . . 0.0 112.04 -178.815 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.44 ' HG2' ' N ' ' A' ' 29' ' ' TRP . 2.5 ttt85 -126.98 147.45 50.12 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.967 -0.56 . . . . 0.0 109.896 179.146 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.55 ' NE1' ' O ' ' A' ' 48' ' ' ASP . 6.6 m-90 -146.13 155.64 42.88 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.538 -0.755 . . . . 0.0 110.541 -179.214 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -100.19 137.49 38.55 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 179.144 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.573 ' O ' ' O ' ' A' ' 20' ' ' SER . 16.7 m -146.14 156.65 12.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-O 121.2 0.524 . . . . 0.0 111.077 -179.429 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.502 HD12 ' O ' ' A' ' 18' ' ' ALA . 10.2 tp -95.67 129.95 42.71 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 108.042 -1.096 . . . . 0.0 108.042 178.421 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.479 ' N ' HD12 ' A' ' 32' ' ' LEU . 1.3 tt -92.35 124.89 36.74 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.334 0.587 . . . . 0.0 109.99 -179.89 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 72.6 m-70 -90.29 -27.86 19.16 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.287 -0.87 . . . . 0.0 111.864 -178.429 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -172.91 161.91 4.62 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 119.531 -0.867 . . . . 0.0 111.331 177.732 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . 0.533 HG22 ' H ' ' A' ' 37' ' ' SER . 4.6 p -144.95 168.76 8.8 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.161 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.121 -179.186 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . 0.533 ' H ' HG22 ' A' ' 36' ' ' VAL . 26.4 t -141.97 168.32 20.02 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 107.919 -1.141 . . . . 0.0 107.919 178.73 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 22.4 tp -64.92 -1.61 2.12 Favored 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 119.64 -0.824 . . . . 0.0 110.281 -179.495 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 3.2 p-80 -161.1 41.24 0.15 Allowed 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 120.569 -0.452 . . . . 0.0 111.857 179.655 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -178.76 155.96 17.65 Favored Glycine 0 CA--C 1.528 0.863 0 N-CA-C 111.255 -0.738 . . . . 0.0 111.255 179.635 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.461 ' CG2' HG21 ' A' ' 73' ' ' ILE . 0.1 OUTLIER -147.29 148.72 16.26 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.321 0 CA-C-O 121.332 0.587 . . . . 0.0 111.991 -178.995 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.465 HD23 ' N ' ' A' ' 43' ' ' VAL . 1.0 OUTLIER -121.76 133.53 54.92 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 114.941 -1.027 . . . . 0.0 108.498 178.735 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.465 ' N ' HD23 ' A' ' 42' ' ' LEU . 32.2 m -138.76 175.19 8.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-O 121.278 0.561 . . . . 0.0 111.891 -179.036 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -97.58 144.18 17.15 Favored Glycine 0 CA--C 1.527 0.842 0 N-CA-C 109.161 -1.575 . . . . 0.0 109.161 177.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . 0.495 ' CD ' ' O ' ' A' ' 45' ' ' GLN . 0.0 OUTLIER -87.34 118.63 70.17 Favored Pre-proline 0 CA--C 1.534 0.342 0 CA-C-N 118.159 0.98 . . . . 0.0 111.941 -178.339 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 95.6 Cg_endo -86.45 162.19 9.61 Favored 'Trans proline' 0 C--N 1.307 -1.608 0 C-N-CA 121.586 1.524 . . . . 0.0 111.196 178.649 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 4.0 mm100 -65.45 -40.23 92.98 Favored 'General case' 0 CA--C 1.533 0.322 0 N-CA-C 112.347 0.499 . . . . 0.0 112.347 -178.959 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . 0.55 ' O ' ' NE1' ' A' ' 29' ' ' TRP . 7.7 m-20 -71.78 8.83 1.04 Allowed 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.059 0.392 . . . . 0.0 112.059 -178.677 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' TRP . . . . . 0.471 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 64.0 t-105 -60.28 67.77 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 112.054 0.39 . . . . 0.0 112.054 -179.425 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . 0.549 ' ND2' ' C ' ' A' ' 50' ' ' ASN . 0.6 OUTLIER -93.29 78.56 4.48 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 120.195 -0.602 . . . . 0.0 109.394 178.395 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -144.6 145.41 14.84 Favored Glycine 0 CA--C 1.527 0.822 0 C-N-CA 121.165 -0.541 . . . . 0.0 111.807 -179.326 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 45.7 t0 -78.02 122.41 85.39 Favored Pre-proline 0 CA--C 1.536 0.419 0 CA-C-N 115.505 -0.348 . . . . 0.0 110.824 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 20.6 Cg_endo -60.96 -22.3 74.05 Favored 'Trans proline' 0 N--CA 1.498 1.769 0 C-N-CA 122.805 2.336 . . . . 0.0 112.079 -179.576 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 32.1 mt-30 -78.72 -23.53 45.45 Favored 'General case' 0 C--N 1.324 -0.54 0 C-N-CA 120.633 -0.427 . . . . 0.0 111.374 -179.264 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.567 ' O ' ' CE1' ' A' ' 57' ' ' PHE . 34.3 mtp85 -93.85 147.31 33.3 Favored Pre-proline 0 C--N 1.332 -0.186 0 C-N-CA 120.876 -0.33 . . . . 0.0 110.492 -179.741 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -60.71 160.96 22.8 Favored 'Trans proline' 0 N--CA 1.496 1.67 0 C-N-CA 123.041 2.494 . . . . 0.0 113.399 -178.817 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.567 ' CE1' ' O ' ' A' ' 55' ' ' ARG . 39.1 m-85 -130.44 157.14 43.44 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 115.162 -0.927 . . . . 0.0 109.117 179.414 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -124.02 137.62 54.57 Favored 'General case' 0 N--CA 1.469 0.523 0 N-CA-C 109.486 -0.561 . . . . 0.0 109.486 178.683 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -118.55 136.7 53.7 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 112.41 0.522 . . . . 0.0 112.41 -178.093 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.475 ' NE ' HD13 ' A' ' 23' ' ' LEU . 0.6 OUTLIER -121.55 127.43 50.95 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 108.075 -1.083 . . . . 0.0 108.075 176.631 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.494 HD11 ' SD ' ' A' ' 71' ' ' MET . 12.6 mt -110.11 151.18 27.55 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.93 0.395 . . . . 0.0 110.977 -178.63 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 55.6 m-85 -132.31 108.58 9.3 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.528 179.938 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.555 ' C ' HD23 ' A' ' 63' ' ' LEU . 3.9 tt -104.17 -82.83 0.5 Allowed 'General case' 0 C--N 1.333 -0.121 0 CA-C-N 115.65 -0.705 . . . . 0.0 109.359 179.238 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.453 ' H ' ' HB ' ' A' ' 67' ' ' VAL . . . -77.59 176.11 53.85 Favored Glycine 0 CA--C 1.521 0.418 0 N-CA-C 109.094 -1.602 . . . . 0.0 109.094 178.279 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.718 HD13 ' C ' ' A' ' 65' ' ' LEU . 3.1 tm? -72.2 -35.91 69.06 Favored 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 119.852 -0.739 . . . . 0.0 109.768 -179.693 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . 0.478 ' OD1' ' O ' ' A' ' 66' ' ' ASP . 15.2 t0 -98.55 9.51 43.05 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.15 179.608 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . 0.539 ' O ' HG12 ' A' ' 67' ' ' VAL . 15.0 t -107.1 96.47 4.66 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.296 0 CA-C-O 121.453 0.644 . . . . 0.0 112.069 -178.719 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -112.53 118.19 34.44 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 108.173 -1.047 . . . . 0.0 108.173 178.208 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.792 HG23 ' OG ' ' A' ' 94' ' ' SER . 3.3 mt -113.37 144.21 21.48 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.233 0 CA-C-O 121.065 0.46 . . . . 0.0 111.373 -178.694 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.43 ' HD3' ' N ' ' A' ' 70' ' ' ARG . 0.0 OUTLIER -128.14 131.53 48.96 Favored 'General case' 0 C--O 1.239 0.508 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.868 179.407 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . 0.494 ' SD ' HD11 ' A' ' 61' ' ' LEU . 0.0 OUTLIER -143.26 149.74 38.31 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.11 -179.628 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -104.88 127.24 52.63 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 107.945 -1.131 . . . . 0.0 107.945 178.307 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.656 HD12 ' CG ' ' A' ' 85' ' ' PHE . 14.0 pt -134.9 157.91 41.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 N-CA-C 112.888 0.699 . . . . 0.0 112.888 -177.507 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 9.2 p -122.69 156.06 35.14 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.045 -0.98 . . . . 0.0 109.911 179.032 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.447 ' HA ' HD12 ' A' ' 75' ' ' LEU . 7.2 tp -65.42 119.05 10.3 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.885 0.374 . . . . 0.0 111.054 -179.447 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -97.63 -41.98 7.87 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.554 177.614 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' TRP . . . . . 0.597 ' NE1' ' HA3' ' A' ' 84' ' ' GLY . 67.7 p-90 -171.01 170.02 6.39 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 115.828 -0.624 . . . . 0.0 109.894 -179.741 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -151.32 124.02 8.52 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 110.017 -0.364 . . . . 0.0 110.017 178.84 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . 0.448 ' NH1' ' OD2' ' A' ' 80' ' ' ASP . 1.0 OUTLIER -152.15 133.64 14.58 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 119.833 -0.747 . . . . 0.0 112.91 179.67 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . 0.448 ' OD2' ' NH1' ' A' ' 79' ' ' ARG . 61.5 m-20 56.75 47.43 18.16 Favored 'General case' 0 N--CA 1.462 0.168 0 N-CA-C 114.131 1.16 . . . . 0.0 114.131 176.357 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 84.97 -28.35 4.59 Favored Glycine 0 CA--C 1.524 0.649 0 C-N-CA 120.425 -0.893 . . . . 0.0 113.311 177.043 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 4.5 mt -89.84 158.03 17.65 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 117.705 0.752 . . . . 0.0 110.567 -178.915 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 58.4 mt -129.95 135.59 48.49 Favored 'General case' 0 CA--C 1.517 -0.301 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.443 -179.13 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . 0.597 ' HA3' ' NE1' ' A' ' 77' ' ' TRP . . . -96.86 151.77 19.93 Favored Glycine 0 N--CA 1.451 -0.323 0 N-CA-C 109.517 -1.433 . . . . 0.0 109.517 178.522 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' PHE . . . . . 0.656 ' CG ' HD12 ' A' ' 73' ' ' ILE . 25.2 m-85 -145.56 132.32 20.03 Favored 'General case' 0 C--N 1.318 -0.804 0 C-N-CA 120.711 -0.396 . . . . 0.0 110.884 -179.205 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.464 ' O ' ' NE2' ' A' ' 88' ' ' GLN . 34.3 tt0 -104.04 126.58 51.27 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 179.614 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . 0.573 ' HA ' HG22 ' A' ' 73' ' ' ILE . 39.1 t -69.23 122.2 18.37 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.005 0.431 . . . . 0.0 112.083 -178.486 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . 0.464 ' NE2' ' O ' ' A' ' 86' ' ' GLU . 51.6 mm-40 -95.28 -33.31 12.61 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.14 179.113 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -162.11 141.92 9.88 Favored 'General case' 0 C--O 1.223 -0.313 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.067 179.974 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.617 HD11 ' OG ' ' A' ' 94' ' ' SER . 10.5 tt -145.05 141.17 23.01 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-O 121.237 0.541 . . . . 0.0 110.049 -179.467 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -59.44 141.52 54.48 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 115.319 -0.855 . . . . 0.0 112.382 -177.987 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.508 ' HA ' HD12 ' A' ' 95' ' ' ILE . 14.6 tp -54.21 -41.71 68.94 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 114.963 -1.017 . . . . 0.0 110.669 -179.549 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -65.49 -40.13 92.74 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 179.339 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' SER . . . . . 0.792 ' OG ' HG23 ' A' ' 69' ' ' ILE . 2.3 t -69.54 -35.01 75.06 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.149 179.392 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . 0.508 HD12 ' HA ' ' A' ' 92' ' ' LEU . 36.1 mt -58.37 -38.35 68.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.802 -0.636 . . . . 0.0 109.821 -179.906 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -70.75 -37.98 73.46 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 120.383 -0.527 . . . . 0.0 111.051 -179.202 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 61.9 m-70 . . . . . 0 C--N 1.326 -0.426 0 C-N-CA 119.381 -0.927 . . . . 0.0 109.112 179.772 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.644 ' N ' HD12 ' A' ' 14' ' ' ILE . 1.4 mp . . . . . 0 CA--C 1.52 -0.178 0 CA-C-O 120.656 0.265 . . . . 0.0 110.455 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -95.46 119.72 34.46 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.459 0.647 . . . . 0.0 111.55 -179.883 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -150.02 155.12 39.35 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 114.904 -1.044 . . . . 0.0 108.293 177.891 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . 0.53 ' OD1' ' N ' ' A' ' 17' ' ' ASP . 17.9 p-10 -95.6 146.22 24.64 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 120.09 -0.644 . . . . 0.0 111.005 -178.626 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -178.65 174.9 1.14 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.244 179.588 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 3.5 t0 -96.07 133.91 39.75 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.854 -179.669 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.539 ' O ' ' O ' ' A' ' 31' ' ' VAL . 27.7 p -133.71 152.51 51.9 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.253 0.549 . . . . 0.0 110.358 178.729 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.482 ' OE1' ' NH2' ' A' ' 28' ' ' ARG . 6.7 mm-40 -131.34 151.96 51.04 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 108.976 -0.75 . . . . 0.0 108.976 179.533 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . 0.428 ' HA ' ' O ' ' A' ' 58' ' ' GLU . 22.6 mt -134.44 136.25 53.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 C-N-CA 120.053 -0.659 . . . . 0.0 111.304 -179.376 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -124.16 123.27 39.93 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.473 -0.785 . . . . 0.0 111.402 -179.142 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.536 ' OE1' ' CZ ' ' A' ' 57' ' ' PHE . 24.1 tt0 -128.12 102.07 6.56 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.538 -0.755 . . . . 0.0 109.811 178.61 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 80.97 -125.8 7.06 Favored Glycine 0 CA--C 1.522 0.528 0 N-CA-C 109.974 -1.25 . . . . 0.0 109.974 -178.894 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -100.55 12.19 37.86 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.954 0.407 . . . . 0.0 110.014 179.489 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.595 ' HB3' ' CZ2' ' A' ' 29' ' ' TRP . 24.1 mtt85 -114.27 135.84 53.62 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 112.968 0.729 . . . . 0.0 112.968 -178.062 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.482 ' NH2' ' OE1' ' A' ' 21' ' ' GLU . 72.0 ttt-85 -128.69 151.38 49.59 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.017 178.77 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.595 ' CZ2' ' HB3' ' A' ' 27' ' ' ARG . 6.5 m-90 -149.25 156.56 42.31 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.59 -179.249 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -100.83 140.07 35.64 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.09 -0.504 . . . . 0.0 109.676 179.321 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.539 ' O ' ' O ' ' A' ' 20' ' ' SER . 12.5 m -149.92 158.45 5.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-O 121.324 0.583 . . . . 0.0 111.19 -179.267 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 1.049 ' H ' HD23 ' A' ' 32' ' ' LEU . 1.0 OUTLIER -99.02 129.95 45.33 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 108.577 -0.897 . . . . 0.0 108.577 178.556 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.2 tt -95.18 125.51 39.87 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 120.306 -0.558 . . . . 0.0 109.787 -179.62 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 20.3 m-70 -90.62 -26.17 19.77 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.402 -0.817 . . . . 0.0 111.714 -178.455 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -172.16 161.31 5.42 Favored 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 119.544 -0.862 . . . . 0.0 111.271 177.403 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . 0.545 HG22 ' N ' ' A' ' 37' ' ' SER . 8.4 p -145.17 168.59 8.59 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.823 -178.792 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . 0.545 ' N ' HG22 ' A' ' 36' ' ' VAL . 6.4 t -141.77 169.66 17.17 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 108.045 -1.094 . . . . 0.0 108.045 178.801 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.476 HD23 ' O ' ' A' ' 38' ' ' LEU . 5.7 tt -67.69 -1.97 6.13 Favored 'General case' 0 C--N 1.323 -0.556 0 C-N-CA 119.872 -0.731 . . . . 0.0 110.69 -179.325 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . 0.569 ' CE1' ' O ' ' A' ' 87' ' ' CYS . 58.1 t60 -156.98 35.42 0.29 Allowed 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 120.777 -0.369 . . . . 0.0 111.501 -179.756 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -175.96 158.98 26.17 Favored Glycine 0 CA--C 1.527 0.787 0 N-CA-C 111.241 -0.744 . . . . 0.0 111.241 179.811 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -149.36 149.58 14.65 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.388 0 CA-C-O 121.104 0.478 . . . . 0.0 111.532 -178.963 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.803 HD23 ' N ' ' A' ' 43' ' ' VAL . 2.7 tt -122.09 141.86 50.96 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 115.527 -0.761 . . . . 0.0 109.105 178.519 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.803 ' N ' HD23 ' A' ' 42' ' ' LEU . 20.0 m -145.26 174.98 2.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-O 121.263 0.554 . . . . 0.0 111.684 -179.562 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -98.72 145.63 17.8 Favored Glycine 0 CA--C 1.528 0.846 0 N-CA-C 109.808 -1.317 . . . . 0.0 109.808 178.811 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 47.5 tt0 -87.22 113.27 53.0 Favored Pre-proline 0 N--CA 1.463 0.22 0 CA-C-N 117.611 0.706 . . . . 0.0 111.699 -178.654 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 96.9 Cg_endo -83.96 161.35 13.82 Favored 'Trans proline' 0 C--N 1.306 -1.682 0 C-N-CA 121.56 1.507 . . . . 0.0 111.372 179.031 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.612 ' CD ' ' H ' ' A' ' 47' ' ' GLN . 0.0 OUTLIER -65.12 -26.24 68.11 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 112.388 0.514 . . . . 0.0 112.388 -178.797 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . 0.534 ' O ' ' N ' ' A' ' 50' ' ' ASN . 1.3 p30 -86.65 8.42 22.45 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 112.085 0.402 . . . . 0.0 112.085 -178.619 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' TRP . . . . . 0.435 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 58.9 t-105 -60.52 68.56 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 111.786 0.291 . . . . 0.0 111.786 -179.69 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . 0.534 ' N ' ' O ' ' A' ' 48' ' ' ASP . 0.3 OUTLIER -93.15 78.77 4.54 Favored 'General case' 0 C--N 1.324 -0.509 0 C-N-CA 120.129 -0.628 . . . . 0.0 109.763 178.607 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -145.02 160.17 27.99 Favored Glycine 0 CA--C 1.525 0.708 0 N-CA-C 111.047 -0.821 . . . . 0.0 111.047 -179.611 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 30.1 t0 -95.31 110.89 52.98 Favored Pre-proline 0 CA--C 1.533 0.296 0 C-N-CA 121.267 -0.173 . . . . 0.0 110.924 -179.646 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_exo -47.79 -22.35 3.13 Favored 'Trans proline' 0 N--CA 1.493 1.485 0 C-N-CA 122.362 2.041 . . . . 0.0 112.357 179.614 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 83.7 mt-30 -76.77 -23.85 52.93 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.382 -179.411 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.521 ' O ' ' CE1' ' A' ' 57' ' ' PHE . 15.9 mtp180 -95.46 151.88 38.89 Favored Pre-proline 0 CA--C 1.531 0.227 0 N-CA-C 110.08 -0.341 . . . . 0.0 110.08 179.987 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . 0.454 ' O ' ' OE1' ' A' ' 24' ' ' GLN . 35.4 Cg_endo -64.85 160.87 38.8 Favored 'Trans proline' 0 N--CA 1.495 1.579 0 C-N-CA 122.852 2.368 . . . . 0.0 113.331 -178.497 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.536 ' CZ ' ' OE1' ' A' ' 24' ' ' GLN . 57.8 m-85 -130.71 154.66 47.72 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 114.997 -1.001 . . . . 0.0 109.192 179.486 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.428 ' O ' ' HA ' ' A' ' 22' ' ' ILE . 16.5 mt-10 -119.31 136.01 54.44 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 108.863 -0.792 . . . . 0.0 108.863 178.667 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . 0.533 ' C ' ' HE ' ' A' ' 60' ' ' ARG . . . -120.47 139.43 52.88 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.281 0.563 . . . . 0.0 112.507 -177.871 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.533 ' HE ' ' C ' ' A' ' 59' ' ' ALA . 2.4 mmp_? -123.96 127.67 48.29 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 108.418 -0.956 . . . . 0.0 108.418 177.304 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.422 HD12 ' C ' ' A' ' 60' ' ' ARG . 9.6 mp -105.78 150.36 25.61 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 120.701 -0.4 . . . . 0.0 110.386 -179.234 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' TYR . . . . . 0.446 ' CD1' ' N ' ' A' ' 62' ' ' TYR . 18.3 m-85 -133.9 108.99 8.75 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.46 179.643 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.54 ' C ' HD23 ' A' ' 63' ' ' LEU . 2.4 tt -104.97 -84.7 0.49 Allowed 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.582 -0.736 . . . . 0.0 109.207 179.382 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.436 ' H ' ' HB ' ' A' ' 67' ' ' VAL . . . -75.72 178.11 48.69 Favored Glycine 0 CA--C 1.52 0.384 0 N-CA-C 109.23 -1.548 . . . . 0.0 109.23 178.508 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 11.6 mt -73.34 -33.8 65.31 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 119.949 -0.7 . . . . 0.0 110.31 -179.588 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -100.87 9.31 42.48 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.822 179.913 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . 0.579 ' O ' HG12 ' A' ' 67' ' ' VAL . 8.7 t -104.94 94.97 3.43 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-O 121.334 0.588 . . . . 0.0 111.901 -178.824 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 6.1 tp -112.37 117.46 32.51 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 177.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.716 HG23 ' OG ' ' A' ' 94' ' ' SER . 3.4 mt -112.63 144.78 19.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 120.946 0.403 . . . . 0.0 111.148 -178.942 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 5.9 mtt85 -127.98 131.6 49.24 Favored 'General case' 0 C--O 1.239 0.506 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.75 179.344 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -142.95 149.03 37.85 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.211 -179.822 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 17.6 tp10 -100.44 134.2 43.74 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 107.635 -1.246 . . . . 0.0 107.635 178.123 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.59 HD12 ' CB ' ' A' ' 85' ' ' PHE . 4.5 pt -144.1 157.34 15.63 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.157 0 C-N-CA 119.084 -1.046 . . . . 0.0 113.138 -177.707 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 29.7 m -122.06 152.86 39.36 Favored 'General case' 0 N--CA 1.463 0.225 0 CA-C-N 115.012 -0.995 . . . . 0.0 109.965 178.877 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.589 HD22 ' CE1' ' A' ' 85' ' ' PHE . 0.2 OUTLIER -65.31 120.31 12.55 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-O 120.964 0.411 . . . . 0.0 110.398 -179.197 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . 0.575 ' N ' HD13 ' A' ' 75' ' ' LEU . . . -97.31 -37.63 9.97 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.166 177.53 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' TRP . . . . . 0.728 ' NE1' ' HA3' ' A' ' 84' ' ' GLY . 69.6 p-90 -171.12 169.91 6.33 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.745 179.725 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -151.45 123.9 8.37 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.178 178.459 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 21.6 ttm-85 -152.36 131.44 12.66 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 120.308 -0.557 . . . . 0.0 112.35 179.441 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 19.5 t70 55.95 47.28 20.31 Favored 'General case' 0 N--CA 1.466 0.325 0 N-CA-C 113.634 0.976 . . . . 0.0 113.634 176.257 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 68.74 12.28 64.2 Favored Glycine 0 CA--C 1.523 0.549 0 C-N-CA 120.325 -0.941 . . . . 0.0 111.594 178.603 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 32.4 mt -114.36 139.93 49.07 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 178.156 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 27.6 mt -128.45 135.28 49.26 Favored 'General case' 0 CA--C 1.512 -0.515 0 C-N-CA 120.298 -0.561 . . . . 0.0 111.51 -178.805 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . 0.728 ' HA3' ' NE1' ' A' ' 77' ' ' TRP . . . -103.49 155.39 17.92 Favored Glycine 0 N--CA 1.446 -0.667 0 N-CA-C 109.179 -1.568 . . . . 0.0 109.179 178.436 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' PHE . . . . . 0.59 ' CB ' HD12 ' A' ' 73' ' ' ILE . 49.6 m-85 -145.75 136.79 24.66 Favored 'General case' 0 C--N 1.311 -1.093 0 C-N-CA 120.792 -0.363 . . . . 0.0 110.417 -179.535 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.444 ' O ' ' NE2' ' A' ' 88' ' ' GLN . 4.6 pt-20 -103.89 127.76 51.4 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 179.232 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . 0.569 ' O ' ' CE1' ' A' ' 39' ' ' HIS . 4.8 t -75.73 126.08 30.3 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.889 0.376 . . . . 0.0 111.985 -178.305 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . 0.444 ' NE2' ' O ' ' A' ' 86' ' ' GLU . 0.0 OUTLIER -102.1 -28.5 12.3 Favored 'General case' 0 N--CA 1.462 0.143 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.49 179.318 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . 0.554 ' ND1' ' N ' ' A' ' 90' ' ' ILE . 0.1 OUTLIER -161.0 141.26 11.1 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.958 0.409 . . . . 0.0 110.377 179.712 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.826 HD11 ' OG ' ' A' ' 94' ' ' SER . 7.9 tt -146.01 141.34 21.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.186 -179.422 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . 0.526 ' N ' ' OD1' ' A' ' 91' ' ' ASP . 0.3 OUTLIER -55.24 143.15 28.88 Favored 'General case' 0 N--CA 1.462 0.139 0 CA-C-N 115.381 -0.827 . . . . 0.0 111.98 -178.293 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.509 ' HA ' HD12 ' A' ' 95' ' ' ILE . 59.2 tp -54.08 -41.66 68.46 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.066 -0.97 . . . . 0.0 109.705 -179.579 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -67.88 -38.33 82.91 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.001 -0.545 . . . . 0.0 109.554 179.081 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' SER . . . . . 0.826 ' OG ' HD11 ' A' ' 90' ' ' ILE . 5.6 t -68.25 -35.14 77.45 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.946 179.368 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . 0.509 HD12 ' HA ' ' A' ' 92' ' ' LEU . 44.2 mt -58.74 -38.26 70.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.786 -0.643 . . . . 0.0 109.702 179.507 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -71.42 -42.11 68.7 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.947 -179.728 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 61.3 m-70 . . . . . 0 C--N 1.325 -0.475 0 C-N-CA 119.745 -0.782 . . . . 0.0 109.718 -179.996 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 41.8 mm . . . . . 0 CA--C 1.521 -0.169 0 CA-C-O 120.594 0.235 . . . . 0.0 110.491 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -93.83 119.96 33.46 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.274 0.559 . . . . 0.0 110.95 179.834 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 5.0 p90 -149.99 158.08 43.8 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 108.522 -0.918 . . . . 0.0 108.522 178.07 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 17.8 p-10 -95.6 145.92 24.87 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 120.185 -0.606 . . . . 0.0 110.746 -179.126 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -178.94 177.08 0.86 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.99 -0.55 . . . . 0.0 109.81 179.52 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 37.3 t0 -96.39 133.27 41.01 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 120.763 -0.375 . . . . 0.0 110.783 -179.679 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.56 ' O ' ' O ' ' A' ' 31' ' ' VAL . 2.9 p -132.97 150.61 52.15 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.371 0.605 . . . . 0.0 110.106 178.734 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 28.9 mm-40 -129.44 135.74 49.05 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.453 -0.794 . . . . 0.0 108.962 179.82 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -117.59 136.13 55.76 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.438 0 C-N-CA 120.227 -0.589 . . . . 0.0 110.376 -179.66 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.506 ' H ' HD12 ' A' ' 23' ' ' LEU . 0.1 OUTLIER -125.38 123.2 38.81 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.518 -0.764 . . . . 0.0 111.08 -179.167 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.527 ' OE1' ' CZ ' ' A' ' 57' ' ' PHE . 20.1 tt0 -130.05 102.71 6.38 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.382 -0.826 . . . . 0.0 109.493 178.419 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 78.31 -127.93 8.44 Favored Glycine 0 CA--C 1.522 0.476 0 N-CA-C 109.672 -1.371 . . . . 0.0 109.672 -178.69 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.47 ' OE1' ' O ' ' A' ' 26' ' ' GLU . 2.5 pp20? -99.77 11.25 39.72 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.627 0.251 . . . . 0.0 110.387 179.468 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.562 ' HB3' ' CZ2' ' A' ' 29' ' ' TRP . 2.5 mpt_? -110.89 132.08 54.51 Favored 'General case' 0 CA--C 1.522 -0.134 0 CA-C-O 121.032 0.444 . . . . 0.0 111.872 -179.536 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.597 ' NH2' ' NH2' ' A' ' 60' ' ' ARG . 5.9 ttt180 -126.88 146.49 50.27 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.767 -0.651 . . . . 0.0 109.776 179.227 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.562 ' CZ2' ' HB3' ' A' ' 27' ' ' ARG . 6.5 m-90 -144.63 155.1 43.45 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.464 -179.097 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -100.24 128.62 46.27 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.785 -0.643 . . . . 0.0 109.934 179.734 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.56 ' O ' ' O ' ' A' ' 20' ' ' SER . 35.3 m -140.83 155.83 22.36 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-O 121.109 0.481 . . . . 0.0 111.202 -179.703 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.571 ' H ' HD23 ' A' ' 32' ' ' LEU . 0.3 OUTLIER -94.03 131.34 39.62 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 108.553 -0.906 . . . . 0.0 108.553 178.375 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.5 tt -89.91 127.22 35.97 Favored 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 120.298 -0.561 . . . . 0.0 109.852 -179.735 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' HIS . . . . . 0.417 ' NE2' HD12 ' A' ' 32' ' ' LEU . 74.0 m-70 -92.45 -27.32 17.54 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.501 -0.772 . . . . 0.0 111.581 -178.634 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 -175.16 162.32 2.99 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 119.693 -0.803 . . . . 0.0 111.536 177.599 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . 0.5 HG22 ' H ' ' A' ' 37' ' ' SER . 4.5 p -145.29 168.55 8.4 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.179 0 CA-C-N 115.503 -0.771 . . . . 0.0 111.094 -179.182 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . 0.5 ' H ' HG22 ' A' ' 36' ' ' VAL . 20.1 t -142.08 169.71 17.07 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 107.738 -1.208 . . . . 0.0 107.738 178.474 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.611 ' H ' HD23 ' A' ' 38' ' ' LEU . 0.3 OUTLIER -66.31 -0.72 2.78 Favored 'General case' 0 C--N 1.322 -0.598 0 C-N-CA 119.552 -0.859 . . . . 0.0 110.874 -179.256 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . 0.5 ' CE1' ' O ' ' A' ' 87' ' ' CYS . 47.6 t60 -158.9 38.16 0.22 Allowed 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 120.639 -0.424 . . . . 0.0 111.566 -179.828 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -177.46 158.16 23.33 Favored Glycine 0 CA--C 1.528 0.906 0 C-N-CA 120.606 -0.807 . . . . 0.0 111.422 179.871 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -148.49 148.95 15.56 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.374 0 CA-C-O 121.421 0.629 . . . . 0.0 111.768 -178.736 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -122.39 138.5 54.51 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 115.01 -0.996 . . . . 0.0 108.947 178.96 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 23.6 m -142.83 174.58 5.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-O 121.16 0.505 . . . . 0.0 111.491 -179.695 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -95.13 144.9 17.47 Favored Glycine 0 CA--C 1.529 0.923 0 N-CA-C 109.528 -1.429 . . . . 0.0 109.528 178.285 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . 0.557 ' NE2' ' O ' ' A' ' 46' ' ' PRO . 18.0 tm0? -87.58 115.5 63.07 Favored Pre-proline 0 N--CA 1.464 0.264 0 CA-C-N 118.121 0.96 . . . . 0.0 112.099 -178.523 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.557 ' O ' ' NE2' ' A' ' 45' ' ' GLN . 96.1 Cg_endo -85.97 161.96 10.31 Favored 'Trans proline' 0 C--N 1.308 -1.588 0 C-N-CA 121.562 1.508 . . . . 0.0 111.213 178.587 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.2 mt-30 -65.14 -40.36 94.29 Favored 'General case' 0 N--CA 1.466 0.37 0 N-CA-C 112.585 0.587 . . . . 0.0 112.585 -178.709 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . 0.572 ' O ' ' N ' ' A' ' 50' ' ' ASN . 6.4 m-20 -72.89 8.88 1.33 Allowed 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 112.035 0.383 . . . . 0.0 112.035 -178.479 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' TRP . . . . . 0.46 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 64.5 t-105 -58.97 69.06 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.729 -0.214 . . . . 0.0 111.531 -179.878 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . 0.572 ' N ' ' O ' ' A' ' 48' ' ' ASP . 0.1 OUTLIER -93.25 78.55 4.5 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 120.201 -0.6 . . . . 0.0 109.531 178.812 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . 0.436 ' CA ' HE21 ' A' ' 24' ' ' GLN . . . -142.54 160.16 27.3 Favored Glycine 0 CA--C 1.52 0.401 0 N-CA-C 111.295 -0.722 . . . . 0.0 111.295 -179.557 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -95.02 121.97 61.21 Favored Pre-proline 0 C--N 1.325 -0.465 0 CA-C-N 115.367 -0.416 . . . . 0.0 110.662 -179.637 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 17.4 Cg_endo -60.15 -22.48 70.17 Favored 'Trans proline' 0 N--CA 1.494 1.519 0 C-N-CA 122.259 1.973 . . . . 0.0 111.564 -179.742 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 6.4 mm-40 -77.73 -21.68 51.52 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.472 179.927 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.511 ' O ' ' CE1' ' A' ' 57' ' ' PHE . 72.2 mtt-85 -97.65 149.86 36.17 Favored Pre-proline 0 CA--C 1.53 0.208 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.108 179.74 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . 0.411 ' O ' ' OE1' ' A' ' 24' ' ' GLN . 37.5 Cg_endo -65.56 160.93 40.74 Favored 'Trans proline' 0 N--CA 1.497 1.683 0 C-N-CA 123.116 2.544 . . . . 0.0 113.476 -179.093 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.527 ' CZ ' ' OE1' ' A' ' 24' ' ' GLN . 26.9 m-85 -129.58 156.61 43.91 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 114.905 -1.043 . . . . 0.0 108.599 179.076 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.403 ' O ' HD12 ' A' ' 23' ' ' LEU . 58.6 mt-10 -122.54 139.67 53.63 Favored 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 109.238 -0.652 . . . . 0.0 109.238 178.604 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -121.06 137.4 54.67 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.117 0.484 . . . . 0.0 111.74 -178.223 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.597 ' NH2' ' NH2' ' A' ' 28' ' ' ARG . 51.9 mtm-85 -123.19 127.84 49.2 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 177.524 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.487 HD11 ' SD ' ' A' ' 71' ' ' MET . 0.1 OUTLIER -107.9 151.1 26.23 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 120.493 -0.483 . . . . 0.0 111.066 -178.614 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 28.9 m-85 -134.0 109.67 9.15 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.17 179.527 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 1.6 tt -104.63 -82.7 0.51 Allowed 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 115.838 -0.619 . . . . 0.0 109.398 179.529 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.464 ' H ' ' HB ' ' A' ' 67' ' ' VAL . . . -77.76 179.27 51.3 Favored Glycine 0 CA--C 1.523 0.533 0 N-CA-C 109.416 -1.474 . . . . 0.0 109.416 178.568 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.812 HD22 ' N ' ' A' ' 65' ' ' LEU . 1.9 mm? -73.78 -31.89 63.52 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 119.925 -0.71 . . . . 0.0 110.129 -179.752 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.9 p30 -103.44 9.22 37.83 Favored 'General case' 0 C--N 1.332 -0.17 0 C-N-CA 122.775 0.43 . . . . 0.0 111.198 -179.927 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . 0.538 ' O ' HG12 ' A' ' 67' ' ' VAL . 8.7 t -105.07 96.37 4.54 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.37 0 CA-C-O 121.2 0.524 . . . . 0.0 111.807 -178.78 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.443 HD12 ' N ' ' A' ' 69' ' ' ILE . 1.8 tp -114.37 118.48 33.98 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 178.678 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.443 ' N ' HD12 ' A' ' 68' ' ' LEU . 2.9 mt -113.9 145.0 20.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.339 -0.392 . . . . 0.0 111.353 -178.791 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 8.4 ptm180 -128.41 131.06 48.48 Favored 'General case' 0 C--O 1.24 0.562 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.078 179.033 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . 0.487 ' SD ' HD11 ' A' ' 61' ' ' LEU . 0.4 OUTLIER -139.59 147.98 41.88 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.607 -0.724 . . . . 0.0 109.953 179.451 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -112.57 118.46 35.16 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 107.661 -1.237 . . . . 0.0 107.661 178.077 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.702 HD12 ' CB ' ' A' ' 85' ' ' PHE . 3.3 pt -129.32 168.02 23.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 N-CA-C 113.466 0.913 . . . . 0.0 113.466 -176.146 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 58.7 m -121.94 150.74 41.58 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 114.961 -1.018 . . . . 0.0 109.807 178.837 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.537 HD12 ' CE1' ' A' ' 85' ' ' PHE . 14.3 tp -66.6 123.58 20.47 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 121.268 0.556 . . . . 0.0 110.175 -179.837 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -98.15 -45.1 6.34 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 115.448 -0.796 . . . . 0.0 111.306 178.533 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' TRP . . . . . 0.507 ' CE2' ' HA3' ' A' ' 84' ' ' GLY . 66.5 p-90 -167.82 167.41 13.05 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.224 -178.965 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -146.4 123.85 11.7 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 109.824 -0.435 . . . . 0.0 109.824 178.622 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 41.4 ttt180 -152.11 133.54 14.54 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 119.917 -0.713 . . . . 0.0 112.804 179.843 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 56.77 46.91 19.1 Favored 'General case' 0 N--CA 1.464 0.233 0 N-CA-C 114.034 1.124 . . . . 0.0 114.034 176.763 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 83.16 -26.82 4.21 Favored Glycine 0 CA--C 1.523 0.569 0 C-N-CA 120.417 -0.897 . . . . 0.0 113.01 177.166 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 4.7 mt -89.56 153.34 20.85 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 117.528 0.664 . . . . 0.0 110.514 -179.06 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 79.4 mt -126.88 135.62 51.21 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.995 -179.256 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . 0.507 ' HA3' ' CE2' ' A' ' 77' ' ' TRP . . . -106.07 149.14 16.61 Favored Glycine 0 N--CA 1.454 -0.123 0 N-CA-C 109.75 -1.34 . . . . 0.0 109.75 178.906 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' PHE . . . . . 0.702 ' CB ' HD12 ' A' ' 73' ' ' ILE . 78.7 m-85 -142.05 142.93 32.89 Favored 'General case' 0 C--N 1.32 -0.697 0 C-N-CA 120.824 -0.35 . . . . 0.0 110.626 -179.748 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 23.9 tt0 -103.73 128.59 51.08 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 179.246 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . 0.503 ' HA ' HG22 ' A' ' 73' ' ' ILE . 14.7 t -68.43 120.85 15.17 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.087 0.47 . . . . 0.0 111.84 -178.463 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -95.52 -36.98 11.08 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.366 179.561 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . 0.569 ' ND1' ' N ' ' A' ' 90' ' ' ILE . 0.0 OUTLIER -161.74 141.92 10.43 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.185 179.981 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.569 ' N ' ' ND1' ' A' ' 89' ' ' HIS . 6.3 tt -145.22 140.87 22.74 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-O 121.239 0.543 . . . . 0.0 110.058 -179.251 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -55.44 143.62 28.41 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-N 115.244 -0.889 . . . . 0.0 112.109 -178.325 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 3.8 tt -54.49 -42.07 70.31 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.166 -0.925 . . . . 0.0 109.956 -179.686 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -68.89 -38.7 79.8 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.604 -0.517 . . . . 0.0 109.604 179.206 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' SER . . . . . 0.421 ' HB3' HG23 ' A' ' 69' ' ' ILE . 7.4 m -64.75 -36.2 83.52 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.779 -0.646 . . . . 0.0 109.59 179.14 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 24.1 mt -59.0 -38.36 73.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.648 -0.705 . . . . 0.0 109.998 179.677 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -71.25 -42.29 69.0 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 120.312 -0.555 . . . . 0.0 111.283 -179.189 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 62.0 m-70 . . . . . 0 C--N 1.325 -0.486 0 C-N-CA 119.638 -0.825 . . . . 0.0 109.49 -179.757 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 39.5 mm . . . . . 0 C--O 1.231 0.111 0 N-CA-C 110.02 -0.363 . . . . 0.0 110.02 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -95.07 120.04 34.6 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.513 0.673 . . . . 0.0 111.649 -179.351 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 2.2 p90 -149.99 158.05 43.77 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 108.146 -1.057 . . . . 0.0 108.146 177.659 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . 0.482 ' OD1' ' N ' ' A' ' 18' ' ' ALA . 23.7 t0 -95.62 146.18 24.68 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 120.049 -0.661 . . . . 0.0 111.085 -178.822 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.482 ' N ' ' OD1' ' A' ' 17' ' ' ASP . . . -179.16 175.79 0.93 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.06 179.392 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -96.17 134.11 39.65 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.688 -179.676 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.639 ' O ' ' O ' ' A' ' 31' ' ' VAL . 5.8 p -135.47 157.21 47.46 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.142 179.044 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.519 ' HB3' ' NH1' ' A' ' 28' ' ' ARG . 50.2 mt-10 -142.04 145.56 34.52 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 179.168 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 28.1 mt -123.01 136.39 59.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-O 121.168 0.508 . . . . 0.0 111.787 -178.235 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.493 ' H ' HD12 ' A' ' 23' ' ' LEU . 0.2 OUTLIER -119.58 123.38 43.79 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.562 -0.744 . . . . 0.0 110.603 179.919 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.425 ' O ' ' OE1' ' A' ' 24' ' ' GLN . 1.5 tm0? -130.51 101.91 5.92 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.404 -0.817 . . . . 0.0 109.671 178.929 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 80.33 -126.79 7.59 Favored Glycine 0 CA--C 1.524 0.624 0 N-CA-C 109.949 -1.26 . . . . 0.0 109.949 -178.715 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.3 pt-20 -100.66 11.96 38.42 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.872 0.367 . . . . 0.0 110.047 179.57 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.52 ' HB3' ' CZ2' ' A' ' 29' ' ' TRP . 38.4 mtt-85 -114.58 136.0 53.52 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 112.771 0.656 . . . . 0.0 112.771 -178.036 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.777 ' CG ' HH11 ' A' ' 28' ' ' ARG . 0.0 OUTLIER -128.11 149.64 50.32 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.261 179.1 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.539 ' NE1' ' O ' ' A' ' 48' ' ' ASP . 6.7 m-90 -146.74 155.03 42.08 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.454 -0.794 . . . . 0.0 110.297 -179.477 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 11.9 mt-10 -100.33 136.61 39.95 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.042 -0.526 . . . . 0.0 109.912 179.502 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.639 ' O ' ' O ' ' A' ' 20' ' ' SER . 17.1 m -147.38 156.93 9.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-O 121.25 0.547 . . . . 0.0 111.167 -179.552 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 1.072 ' H ' HD23 ' A' ' 32' ' ' LEU . 1.4 pt? -95.88 130.29 42.88 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 108.817 -0.808 . . . . 0.0 108.817 178.498 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.6 tt -91.7 126.0 36.63 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.267 0.556 . . . . 0.0 110.092 -179.527 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 74.5 m-70 -91.95 -27.45 17.87 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.276 -0.875 . . . . 0.0 111.803 -178.531 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -173.7 161.14 3.85 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 119.574 -0.85 . . . . 0.0 111.317 177.576 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . 0.525 HG22 ' N ' ' A' ' 37' ' ' SER . 5.6 p -144.57 168.84 9.51 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.118 0 CA-C-N 115.584 -0.735 . . . . 0.0 111.067 -179.09 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . 0.525 ' N ' HG22 ' A' ' 36' ' ' VAL . 10.8 m -142.28 169.65 17.19 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 107.982 -1.118 . . . . 0.0 107.982 178.518 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.586 ' H ' HD12 ' A' ' 38' ' ' LEU . 2.0 mp -65.57 -1.21 2.45 Favored 'General case' 0 C--N 1.324 -0.517 0 C-N-CA 119.583 -0.847 . . . . 0.0 110.305 -179.803 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . 0.479 ' CD2' ' O ' ' A' ' 39' ' ' HIS . 47.7 p-80 -163.11 41.25 0.1 Allowed 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 120.748 -0.381 . . . . 0.0 111.469 179.813 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -176.07 152.24 12.66 Favored Glycine 0 CA--C 1.525 0.661 0 N-CA-C 110.997 -0.841 . . . . 0.0 110.997 179.835 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -147.31 148.67 16.31 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.208 0 CA-C-O 121.495 0.664 . . . . 0.0 111.647 -179.135 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -121.76 140.33 52.47 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 114.836 -1.075 . . . . 0.0 108.719 178.977 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.2 m -144.11 175.13 3.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-O 121.328 0.585 . . . . 0.0 111.752 -179.441 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -97.15 144.57 17.41 Favored Glycine 0 CA--C 1.529 0.938 0 N-CA-C 109.247 -1.541 . . . . 0.0 109.247 178.01 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . 0.551 HE21 ' C ' ' A' ' 45' ' ' GLN . 0.0 OUTLIER -87.42 115.6 63.33 Favored Pre-proline 0 N--CA 1.464 0.274 0 CA-C-N 118.127 0.963 . . . . 0.0 111.75 -178.431 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 79.4 Cg_endo -86.07 162.22 10.16 Favored 'Trans proline' 0 C--N 1.307 -1.65 0 C-N-CA 121.765 1.643 . . . . 0.0 111.462 178.931 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.498 ' OE1' ' N ' ' A' ' 47' ' ' GLN . 25.9 mp0 -65.28 -40.24 93.64 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 112.153 0.427 . . . . 0.0 112.153 -179.0 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . 0.539 ' O ' ' NE1' ' A' ' 29' ' ' TRP . 16.4 m-20 -72.56 8.41 1.44 Allowed 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.05 0.389 . . . . 0.0 112.05 -178.538 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' TRP . . . . . 0.448 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 60.7 t-105 -61.45 68.43 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 111.696 0.258 . . . . 0.0 111.696 -179.657 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . 0.52 ' N ' ' O ' ' A' ' 48' ' ' ASP . 0.5 OUTLIER -93.28 78.98 4.47 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 120.023 -0.671 . . . . 0.0 109.682 178.688 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -141.77 158.22 26.57 Favored Glycine 0 CA--C 1.525 0.696 0 N-CA-C 111.369 -0.692 . . . . 0.0 111.369 -179.501 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 33.7 t0 -93.99 111.49 53.26 Favored Pre-proline 0 CA--C 1.533 0.311 0 CA-C-N 115.744 -0.228 . . . . 0.0 110.774 -179.89 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 76.7 Cg_exo -47.24 -22.28 2.31 Favored 'Trans proline' 0 N--CA 1.496 1.63 0 C-N-CA 122.597 2.198 . . . . 0.0 112.413 179.858 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 37.3 mt-30 -79.13 -24.01 43.64 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.82 -178.581 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.55 ' O ' ' CE1' ' A' ' 57' ' ' PHE . 3.0 mpt_? -94.82 151.4 38.99 Favored Pre-proline 0 C--N 1.33 -0.257 0 C-N-CA 120.581 -0.448 . . . . 0.0 109.962 179.69 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 35.3 Cg_endo -64.3 160.86 36.83 Favored 'Trans proline' 0 N--CA 1.495 1.6 0 C-N-CA 122.816 2.344 . . . . 0.0 113.285 -178.77 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.55 ' CE1' ' O ' ' A' ' 55' ' ' ARG . 44.5 m-85 -130.5 155.68 46.06 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 114.991 -1.004 . . . . 0.0 109.005 179.419 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -121.61 134.46 55.0 Favored 'General case' 0 C--O 1.22 -0.452 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 178.728 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . 0.555 ' HB2' HD13 ' A' ' 73' ' ' ILE . . . -115.86 135.66 53.79 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.113 0.483 . . . . 0.0 112.108 -178.454 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.46 ' NE ' HD13 ' A' ' 23' ' ' LEU . 2.4 mpt_? -121.35 127.72 51.54 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 177.361 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 10.6 mt -108.93 137.15 47.3 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.914 0.387 . . . . 0.0 110.636 -179.061 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' TYR . . . . . 0.613 ' CD1' ' N ' ' A' ' 62' ' ' TYR . 1.0 OUTLIER -120.34 110.21 16.28 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.348 179.785 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.528 ' C ' HD23 ' A' ' 63' ' ' LEU . 2.2 tt -104.54 -84.55 0.48 Allowed 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.413 179.401 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.45 ' H ' ' HB ' ' A' ' 67' ' ' VAL . . . -76.52 -176.89 43.17 Favored Glycine 0 CA--C 1.521 0.455 0 N-CA-C 109.503 -1.439 . . . . 0.0 109.503 178.62 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 3.2 mt -76.11 -32.22 59.07 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.015 -0.674 . . . . 0.0 110.319 -179.703 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . 0.446 ' N ' ' OD1' ' A' ' 66' ' ' ASP . 1.3 m-20 -104.06 8.8 36.58 Favored 'General case' 0 C--N 1.332 -0.191 0 C-N-CA 122.759 0.424 . . . . 0.0 111.105 -179.913 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . 0.55 ' O ' HG12 ' A' ' 67' ' ' VAL . 9.3 t -103.34 95.05 3.54 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.296 0 CA-C-O 121.529 0.681 . . . . 0.0 111.8 -178.759 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -112.15 117.74 33.43 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 114.753 -1.112 . . . . 0.0 108.259 178.208 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.534 HG23 ' CB ' ' A' ' 94' ' ' SER . 6.0 mt -113.9 143.62 23.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.887 0.375 . . . . 0.0 110.562 -179.043 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 11.6 mtm180 -128.26 131.26 48.76 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.914 179.191 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 2.2 mtp -140.39 148.88 41.92 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.917 -0.583 . . . . 0.0 109.945 179.651 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . 0.417 ' HB2' ' CD2' ' A' ' 89' ' ' HIS . 12.0 tm-20 -102.39 134.71 45.26 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 107.48 -1.304 . . . . 0.0 107.48 178.247 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.555 HD13 ' HB2' ' A' ' 59' ' ' ALA . 5.3 pt -143.97 157.46 15.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 N-CA-C 113.472 0.916 . . . . 0.0 113.472 -177.352 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -121.18 150.17 41.71 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 114.759 -1.109 . . . . 0.0 109.444 178.604 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.572 HD12 ' CE1' ' A' ' 85' ' ' PHE . 8.7 tp -66.71 123.76 21.01 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.265 0.555 . . . . 0.0 110.242 -179.638 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -98.0 -43.99 6.84 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 115.05 -0.977 . . . . 0.0 111.011 178.138 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' TRP . . . . . 0.586 ' NE1' ' HA3' ' A' ' 84' ' ' GLY . 68.0 p-90 -168.63 168.06 11.06 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.047 -179.13 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -146.45 123.72 11.57 Favored 'General case' 0 N--CA 1.464 0.257 0 N-CA-C 109.804 -0.443 . . . . 0.0 109.804 178.291 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 6.7 ttt-85 -152.26 133.93 14.69 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 119.922 -0.711 . . . . 0.0 112.906 179.979 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 56.64 47.16 18.95 Favored 'General case' 0 N--CA 1.465 0.285 0 N-CA-C 113.649 0.981 . . . . 0.0 113.649 176.752 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 81.78 -26.49 3.66 Favored Glycine 0 CA--C 1.522 0.529 0 C-N-CA 120.506 -0.854 . . . . 0.0 113.104 177.386 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 4.7 mt -89.6 153.79 20.48 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 117.685 0.742 . . . . 0.0 110.447 -179.289 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 43.5 mt -126.27 135.5 51.62 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.981 -179.395 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . 0.586 ' HA3' ' NE1' ' A' ' 77' ' ' TRP . . . -98.83 152.61 19.72 Favored Glycine 0 N--CA 1.451 -0.31 0 N-CA-C 109.949 -1.26 . . . . 0.0 109.949 178.963 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' PHE . . . . . 0.572 ' CE1' HD12 ' A' ' 75' ' ' LEU . 40.7 m-85 -145.51 136.69 24.85 Favored 'General case' 0 C--N 1.319 -0.753 0 C-N-CA 120.673 -0.411 . . . . 0.0 111.017 -179.227 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.458 ' O ' ' NE2' ' A' ' 88' ' ' GLN . 31.5 tt0 -103.66 127.61 51.08 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 179.231 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 3.7 t -73.76 124.81 26.76 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.062 0.458 . . . . 0.0 112.042 -178.445 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . 0.458 ' NE2' ' O ' ' A' ' 86' ' ' GLU . 39.1 mm-40 -99.41 -32.12 11.31 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.692 -0.685 . . . . 0.0 110.228 179.277 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . 0.57 ' ND1' ' C ' ' A' ' 89' ' ' HIS . 0.0 OUTLIER -161.75 141.8 10.35 Favored 'General case' 0 C--O 1.225 -0.222 0 CA-C-O 121.033 0.444 . . . . 0.0 110.151 179.433 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.452 HG23 ' CG1' ' A' ' 95' ' ' ILE . 5.7 tt -145.66 141.29 22.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-O 121.436 0.636 . . . . 0.0 110.151 -179.577 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . 0.509 ' N ' ' OD1' ' A' ' 91' ' ' ASP . 0.0 OUTLIER -54.07 140.28 32.27 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 114.873 -1.058 . . . . 0.0 112.125 -178.39 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 16.6 tp -54.18 -41.87 69.04 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.043 -0.98 . . . . 0.0 110.01 -179.78 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -69.67 -40.2 76.55 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 179.252 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' SER . . . . . 0.534 ' CB ' HG23 ' A' ' 69' ' ' ILE . 4.0 m -64.48 -35.87 82.35 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.956 179.459 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . 0.452 ' CG1' HG23 ' A' ' 90' ' ' ILE . 30.4 mt -58.51 -37.41 64.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 115.888 -0.597 . . . . 0.0 109.786 179.487 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -70.74 -41.86 71.27 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.148 -179.121 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 64.3 m-70 . . . . . 0 C--N 1.327 -0.406 0 C-N-CA 119.41 -0.916 . . . . 0.0 109.365 179.941 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.626 ' N ' HD12 ' A' ' 14' ' ' ILE . 1.3 mp . . . . . 0 CA--C 1.519 -0.224 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -95.65 120.06 35.23 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.486 0.66 . . . . 0.0 112.134 -179.039 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 6.4 p90 -149.85 158.6 44.32 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 107.968 -1.123 . . . . 0.0 107.968 177.183 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -95.33 146.32 24.46 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 120.138 -0.625 . . . . 0.0 110.943 -178.809 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -178.92 176.37 0.92 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.863 179.427 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -96.62 133.82 40.63 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.831 -179.829 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.572 ' O ' ' O ' ' A' ' 31' ' ' VAL . 13.0 t -133.74 152.92 52.01 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 121.103 0.478 . . . . 0.0 110.255 178.617 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 91.0 mt-10 -132.32 151.8 51.68 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 179.497 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . 0.406 ' HA ' ' O ' ' A' ' 58' ' ' GLU . 79.5 mt -132.71 136.38 55.92 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.468 0 C-N-CA 120.066 -0.654 . . . . 0.0 111.427 -179.568 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.522 HD13 ' NE ' ' A' ' 60' ' ' ARG . 0.2 OUTLIER -123.45 123.35 40.46 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.33 -0.85 . . . . 0.0 111.054 -179.398 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.548 ' OE1' ' CE2' ' A' ' 57' ' ' PHE . 18.8 tt0 -129.58 102.05 6.2 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.428 -0.805 . . . . 0.0 109.614 178.472 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 80.3 -127.22 7.82 Favored Glycine 0 CA--C 1.523 0.561 0 N-CA-C 109.847 -1.301 . . . . 0.0 109.847 -178.781 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.434 ' OE1' ' O ' ' A' ' 26' ' ' GLU . 2.9 pp20? -100.04 12.2 37.48 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.969 0.414 . . . . 0.0 110.095 179.434 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.521 ' HB3' ' CZ2' ' A' ' 29' ' ' TRP . 27.5 mtt-85 -113.77 135.25 54.16 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.883 -0.599 . . . . 0.0 112.605 -178.401 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.435 ' HG3' ' N ' ' A' ' 29' ' ' TRP . 11.1 ttt-85 -129.01 150.48 50.4 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.169 179.132 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.521 ' CZ2' ' HB3' ' A' ' 27' ' ' ARG . 6.7 m-90 -147.94 156.18 42.39 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.518 -179.365 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 12.4 mt-10 -99.9 138.09 37.45 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 178.978 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.572 ' O ' ' O ' ' A' ' 20' ' ' SER . 11.0 m -147.77 157.37 9.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-O 121.255 0.55 . . . . 0.0 111.214 -179.255 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 1.009 ' H ' HD23 ' A' ' 32' ' ' LEU . 0.6 OUTLIER -98.01 130.61 44.83 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 108.428 -0.953 . . . . 0.0 108.428 178.499 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.6 tt -94.35 125.05 38.75 Favored 'General case' 0 C--N 1.324 -0.524 0 C-N-CA 120.385 -0.526 . . . . 0.0 109.786 -179.679 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 16.1 m-70 -90.7 -27.16 19.17 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.469 -0.787 . . . . 0.0 111.764 -178.341 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 -172.62 160.81 4.75 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 119.566 -0.854 . . . . 0.0 111.084 177.498 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . 0.54 HG22 ' H ' ' A' ' 37' ' ' SER . 4.8 p -145.33 169.34 7.45 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.004 -178.965 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . 0.54 ' H ' HG22 ' A' ' 36' ' ' VAL . 24.9 t -141.64 167.84 21.19 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 107.883 -1.154 . . . . 0.0 107.883 178.262 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.634 ' H ' HD23 ' A' ' 38' ' ' LEU . 0.1 OUTLIER -64.77 -1.57 2.01 Favored 'General case' 0 C--N 1.321 -0.669 0 C-N-CA 119.95 -0.7 . . . . 0.0 110.562 -179.259 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . 0.553 ' NE2' ' O ' ' A' ' 87' ' ' CYS . 19.9 t60 -159.14 41.68 0.23 Allowed 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 120.786 -0.366 . . . . 0.0 111.397 -179.523 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 177.77 158.69 21.26 Favored Glycine 0 CA--C 1.527 0.798 0 N-CA-C 111.165 -0.774 . . . . 0.0 111.165 179.697 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.409 HG21 HG21 ' A' ' 73' ' ' ILE . 0.1 OUTLIER -148.56 148.95 15.53 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.321 0 CA-C-O 121.342 0.591 . . . . 0.0 111.584 -178.856 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.615 HD23 ' N ' ' A' ' 43' ' ' VAL . 1.6 tt -121.59 136.19 54.96 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 115.177 -0.92 . . . . 0.0 108.706 178.729 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.615 ' N ' HD23 ' A' ' 42' ' ' LEU . 24.0 m -141.33 174.84 6.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-O 121.294 0.568 . . . . 0.0 111.964 -179.295 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -98.19 144.81 17.47 Favored Glycine 0 CA--C 1.529 0.912 0 N-CA-C 109.215 -1.554 . . . . 0.0 109.215 178.049 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . 0.578 ' CD ' ' O ' ' A' ' 45' ' ' GLN . 3.8 pp0? -88.03 116.72 67.05 Favored Pre-proline 0 CA--C 1.535 0.37 0 CA-C-N 118.078 0.939 . . . . 0.0 111.723 -178.349 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -84.82 162.57 12.09 Favored 'Trans proline' 0 C--N 1.305 -1.73 0 C-N-CA 121.384 1.389 . . . . 0.0 110.91 178.595 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 7.5 mp0 -64.52 -40.18 95.16 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.698 0.285 . . . . 0.0 111.539 -178.965 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . 0.521 ' O ' ' NE1' ' A' ' 29' ' ' TRP . 1.0 OUTLIER -70.45 8.64 0.77 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.821 -179.058 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' TRP . . . . . 0.461 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 60.7 t-105 -63.3 67.72 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 120.742 -0.383 . . . . 0.0 111.725 -179.39 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . 0.573 ' C ' HD22 ' A' ' 50' ' ' ASN . 0.5 OUTLIER -93.08 78.84 4.58 Favored 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 120.332 -0.547 . . . . 0.0 109.932 178.857 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -141.21 160.16 26.76 Favored Glycine 0 CA--C 1.525 0.696 0 N-CA-C 111.462 -0.655 . . . . 0.0 111.462 -179.528 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . 0.436 ' OD1' ' OE1' ' A' ' 54' ' ' GLN . 25.7 t0 -95.46 110.73 52.39 Favored Pre-proline 0 CA--C 1.533 0.326 0 CA-C-N 115.79 -0.205 . . . . 0.0 110.739 -179.873 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 71.4 Cg_exo -46.66 -22.66 1.92 Allowed 'Trans proline' 0 N--CA 1.496 1.671 0 C-N-CA 122.626 2.217 . . . . 0.0 112.751 -179.811 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.436 ' OE1' ' OD1' ' A' ' 52' ' ' ASP . 11.0 mp0 -80.29 -23.91 40.39 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 120.541 -0.464 . . . . 0.0 111.818 -178.968 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.539 ' O ' ' CE1' ' A' ' 57' ' ' PHE . 18.2 mtt-85 -92.72 151.03 40.63 Favored Pre-proline 0 C--N 1.331 -0.224 0 C-N-CA 120.354 -0.538 . . . . 0.0 109.736 179.563 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . 0.431 ' O ' ' OE1' ' A' ' 24' ' ' GLN . 35.7 Cg_endo -64.76 160.88 38.45 Favored 'Trans proline' 0 C--N 1.308 -1.594 0 C-N-CA 122.723 2.282 . . . . 0.0 113.187 -178.735 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.548 ' CE2' ' OE1' ' A' ' 24' ' ' GLN . 42.9 m-85 -130.34 154.4 47.7 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 114.889 -1.051 . . . . 0.0 108.897 179.178 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.406 ' O ' ' HA ' ' A' ' 22' ' ' ILE . 83.4 mt-10 -120.6 134.96 55.23 Favored 'General case' 0 N--CA 1.467 0.392 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 178.469 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . 0.486 ' HB2' ' CD1' ' A' ' 73' ' ' ILE . . . -117.0 137.28 52.33 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.212 0.529 . . . . 0.0 112.296 -178.187 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.522 ' NE ' HD13 ' A' ' 23' ' ' LEU . 0.9 OUTLIER -122.72 127.66 49.52 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.214 -0.903 . . . . 0.0 108.681 177.254 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 7.8 mt -110.66 139.01 46.32 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 120.73 -0.388 . . . . 0.0 110.419 -179.348 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' TYR . . . . . 0.5 ' CD1' ' N ' ' A' ' 62' ' ' TYR . 6.7 m-85 -120.27 111.24 17.54 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.935 -179.871 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.572 ' C ' HD23 ' A' ' 63' ' ' LEU . 5.8 tt -105.09 -83.51 0.51 Allowed 'General case' 0 N--CA 1.462 0.15 0 CA-C-N 115.849 -0.614 . . . . 0.0 109.492 179.14 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.453 ' H ' ' HB ' ' A' ' 67' ' ' VAL . . . -77.81 178.85 51.81 Favored Glycine 0 CA--C 1.523 0.542 0 N-CA-C 109.523 -1.431 . . . . 0.0 109.523 178.786 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.532 ' O ' HD23 ' A' ' 65' ' ' LEU . 0.9 OUTLIER -73.81 -33.23 64.09 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 119.898 -0.721 . . . . 0.0 110.119 -179.627 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 39.3 t0 -102.88 8.65 39.15 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.097 179.881 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . 0.566 ' O ' HG12 ' A' ' 67' ' ' VAL . 7.7 t -104.75 96.27 4.46 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.284 0 CA-C-O 121.308 0.575 . . . . 0.0 111.927 -178.812 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 6.0 tp -113.01 117.17 31.28 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 108.172 -1.048 . . . . 0.0 108.172 178.1 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.495 HG23 ' CB ' ' A' ' 94' ' ' SER . 3.3 mt -111.91 143.69 21.2 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-O 120.818 0.342 . . . . 0.0 110.498 -179.061 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.412 ' C ' ' HG2' ' A' ' 71' ' ' MET . 24.7 mtm-85 -128.35 130.46 47.79 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.878 179.257 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . 0.807 ' SD ' HD12 ' A' ' 90' ' ' ILE . 0.9 OUTLIER -139.48 148.78 43.16 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.858 -0.61 . . . . 0.0 109.741 179.575 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 72.1 tt0 -102.28 129.48 48.71 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 107.798 -1.186 . . . . 0.0 107.798 178.448 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.486 ' CD1' ' HB2' ' A' ' 59' ' ' ALA . 13.8 pt -138.16 157.54 31.79 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 C-N-CA 119.637 -0.825 . . . . 0.0 113.138 -177.491 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . 0.587 ' N ' ' OE1' ' A' ' 88' ' ' GLN . 95.6 p -121.44 151.23 40.45 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 114.74 -1.118 . . . . 0.0 109.61 178.521 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.48 ' CD1' ' CZ ' ' A' ' 85' ' ' PHE . 8.0 tp -66.53 123.05 18.98 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.105 0.479 . . . . 0.0 110.431 -179.449 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -98.1 -44.38 6.64 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.964 178.042 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' TRP . . . . . 0.709 ' NE1' ' HA3' ' A' ' 84' ' ' GLY . 69.3 p-90 -164.95 170.55 15.11 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.185 -179.454 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -151.34 124.43 8.72 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 121.155 -0.218 . . . . 0.0 110.732 179.117 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . 0.5 ' CG ' HH11 ' A' ' 79' ' ' ARG . 0.0 OUTLIER -151.95 131.68 13.19 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 112.933 0.716 . . . . 0.0 112.933 179.245 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 54.26 47.06 23.91 Favored 'General case' 0 N--CA 1.468 0.425 0 N-CA-C 113.791 1.034 . . . . 0.0 113.791 176.069 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 72.15 13.06 76.36 Favored Glycine 0 CA--C 1.522 0.503 0 C-N-CA 120.18 -1.01 . . . . 0.0 111.739 178.338 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 48.8 mt -116.91 138.06 51.79 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 178.818 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.488 HD11 ' CB ' ' A' ' 45' ' ' GLN . 29.7 mt -125.78 135.02 51.55 Favored 'General case' 0 CA--C 1.513 -0.456 0 C-N-CA 120.382 -0.527 . . . . 0.0 111.491 -178.98 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . 0.709 ' HA3' ' NE1' ' A' ' 77' ' ' TRP . . . -98.4 153.95 20.02 Favored Glycine 0 N--CA 1.447 -0.629 0 N-CA-C 109.334 -1.506 . . . . 0.0 109.334 178.381 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' PHE . . . . . 0.484 ' CG ' HD12 ' A' ' 73' ' ' ILE . 28.8 m-85 -145.39 131.94 19.82 Favored 'General case' 0 C--N 1.312 -1.045 0 C-N-CA 120.794 -0.362 . . . . 0.0 110.568 -179.274 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.501 ' O ' ' NE2' ' A' ' 88' ' ' GLN . 20.3 pt-20 -103.6 128.77 50.82 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 179.692 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . 0.553 ' O ' ' NE2' ' A' ' 39' ' ' HIS . 5.2 t -75.71 124.52 27.4 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 112.234 0.457 . . . . 0.0 112.234 -178.028 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . 0.695 ' CA ' HE21 ' A' ' 88' ' ' GLN . 0.0 OUTLIER -102.12 -30.42 11.16 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.088 179.124 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . 0.609 ' ND1' ' N ' ' A' ' 90' ' ' ILE . 0.0 OUTLIER -158.77 140.47 13.53 Favored 'General case' 0 C--O 1.225 -0.198 0 CA-C-O 120.989 0.424 . . . . 0.0 110.202 179.298 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.807 HD12 ' SD ' ' A' ' 71' ' ' MET . 6.2 tt -146.18 140.73 21.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.043 -179.384 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . 0.529 ' O ' ' OG ' ' A' ' 94' ' ' SER . 0.1 OUTLIER -53.94 142.27 25.14 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 115.308 -0.86 . . . . 0.0 111.993 -178.534 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 8.0 tp -54.37 -42.3 70.17 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.238 -0.892 . . . . 0.0 110.168 -179.831 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 3.6 p30 -69.03 -42.08 76.83 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.02 179.499 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' SER . . . . . 0.529 ' OG ' ' O ' ' A' ' 91' ' ' ASP . 2.0 p -60.26 -37.74 81.37 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.975 179.606 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 63.5 mt -58.77 -38.12 70.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.128 179.53 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -70.42 -40.44 73.84 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 120.292 -0.563 . . . . 0.0 110.988 -178.87 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 68.1 m-70 . . . . . 0 C--N 1.327 -0.384 0 C-N-CA 119.978 -0.689 . . . . 0.0 109.847 179.923 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.523 ' N ' HD12 ' A' ' 14' ' ' ILE . 1.7 mp . . . . . 0 CA--C 1.521 -0.17 0 N-CA-C 110.093 -0.336 . . . . 0.0 110.093 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -95.14 119.76 34.2 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.307 0.575 . . . . 0.0 111.039 -179.755 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -149.66 149.26 30.36 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.109 -0.95 . . . . 0.0 108.442 178.631 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -95.54 149.28 21.6 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 120.116 -0.634 . . . . 0.0 111.335 -178.19 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.515 ' O ' HD12 ' A' ' 32' ' ' LEU . . . 179.06 177.96 0.49 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.466 -0.788 . . . . 0.0 109.891 179.802 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -96.22 133.94 39.93 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.622 179.95 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.58 ' O ' ' O ' ' A' ' 31' ' ' VAL . 20.5 p -134.03 154.34 51.21 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.992 0.425 . . . . 0.0 110.209 178.688 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 16.3 mt-10 -136.24 146.6 46.92 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 108.798 -0.816 . . . . 0.0 108.798 179.409 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . 0.439 ' HA ' ' O ' ' A' ' 58' ' ' GLU . 39.8 mt -125.75 136.24 61.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 C-N-CA 120.037 -0.665 . . . . 0.0 111.329 -178.982 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.476 ' H ' HD12 ' A' ' 23' ' ' LEU . 0.1 OUTLIER -120.67 123.75 43.52 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.329 -0.85 . . . . 0.0 110.846 -179.497 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.491 ' O ' ' OE1' ' A' ' 24' ' ' GLN . 1.6 tm0? -131.49 102.2 5.84 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.513 -0.767 . . . . 0.0 109.606 178.811 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 78.97 -128.15 8.42 Favored Glycine 0 CA--C 1.525 0.664 0 N-CA-C 109.912 -1.275 . . . . 0.0 109.912 -178.711 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -99.14 12.32 36.47 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.865 0.364 . . . . 0.0 110.144 179.417 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.562 ' HB3' ' CZ2' ' A' ' 29' ' ' TRP . 18.6 mtt180 -113.41 135.43 53.87 Favored 'General case' 0 C--N 1.332 -0.177 0 N-CA-C 112.439 0.533 . . . . 0.0 112.439 -178.514 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.432 ' HG2' ' N ' ' A' ' 29' ' ' TRP . 7.0 ttt85 -128.86 148.25 50.88 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.184 179.282 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.562 ' CZ2' ' HB3' ' A' ' 27' ' ' ARG . 6.9 m-90 -146.65 155.82 42.73 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.628 -179.087 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 21.5 mt-10 -100.06 137.28 38.72 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 179.124 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.58 ' O ' ' O ' ' A' ' 20' ' ' SER . 17.3 m -146.88 157.69 10.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 121.31 0.576 . . . . 0.0 111.437 -179.361 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.515 HD12 ' O ' ' A' ' 18' ' ' ALA . 10.7 tp -96.55 128.88 43.89 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 178.576 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.445 ' N ' HD12 ' A' ' 32' ' ' LEU . 2.0 tt -93.37 124.99 37.74 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.232 0.539 . . . . 0.0 109.758 179.789 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 66.3 m-70 -91.24 -24.67 19.81 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.535 -0.757 . . . . 0.0 111.776 -178.434 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -174.59 163.61 3.58 Favored 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 119.579 -0.849 . . . . 0.0 111.635 177.516 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . 0.523 HG22 ' H ' ' A' ' 37' ' ' SER . 5.0 p -147.17 168.8 4.78 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.123 0 CA-C-N 115.434 -0.803 . . . . 0.0 111.275 -178.903 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . 0.523 ' H ' HG22 ' A' ' 36' ' ' VAL . 5.8 t -142.34 170.45 15.68 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 107.867 -1.16 . . . . 0.0 107.867 178.473 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.638 ' H ' HD23 ' A' ' 38' ' ' LEU . 0.1 OUTLIER -67.44 -2.58 6.56 Favored 'General case' 0 C--N 1.323 -0.566 0 C-N-CA 119.617 -0.833 . . . . 0.0 110.333 -179.687 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . 0.55 ' CD2' ' O ' ' A' ' 87' ' ' CYS . 1.6 t60 -156.67 37.97 0.32 Allowed 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 120.634 -0.426 . . . . 0.0 111.578 -179.627 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -178.73 158.4 22.74 Favored Glycine 0 CA--C 1.529 0.941 0 C-N-CA 120.505 -0.855 . . . . 0.0 111.526 179.795 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -149.82 150.17 13.97 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.362 0 CA-C-O 121.353 0.597 . . . . 0.0 111.565 -179.006 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.617 HD23 ' N ' ' A' ' 43' ' ' VAL . 1.5 tt -122.24 141.28 51.65 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 115.06 -0.973 . . . . 0.0 108.783 178.815 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.617 ' N ' HD23 ' A' ' 42' ' ' LEU . 15.9 m -145.34 175.03 2.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-O 121.202 0.525 . . . . 0.0 111.88 -179.242 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -99.56 144.85 17.25 Favored Glycine 0 CA--C 1.53 1.004 0 N-CA-C 109.68 -1.368 . . . . 0.0 109.68 178.423 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . 0.555 ' O ' ' NE2' ' A' ' 45' ' ' GLN . 0.0 OUTLIER -86.77 116.79 67.26 Favored Pre-proline 0 N--CA 1.465 0.307 0 CA-C-N 117.85 0.825 . . . . 0.0 111.939 -178.505 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 76.3 Cg_endo -87.1 151.65 8.22 Favored 'Trans proline' 0 C--N 1.309 -1.526 0 C-N-CA 121.567 1.511 . . . . 0.0 111.32 178.527 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -56.44 -13.74 2.5 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 112.658 0.614 . . . . 0.0 112.658 -178.76 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . 0.53 ' O ' ' N ' ' A' ' 50' ' ' ASN . 81.9 m-20 -97.52 8.81 43.94 Favored 'General case' 0 N--CA 1.467 0.398 0 N-CA-C 112.324 0.49 . . . . 0.0 112.324 -178.432 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' TRP . . . . . 0.444 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 58.4 t-105 -60.55 67.67 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 112.119 0.415 . . . . 0.0 112.119 -179.358 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . 0.53 ' N ' ' O ' ' A' ' 48' ' ' ASP . 0.3 OUTLIER -93.53 78.64 4.35 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 178.042 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -142.81 162.99 27.38 Favored Glycine 0 CA--C 1.524 0.609 0 N-CA-C 111.538 -0.625 . . . . 0.0 111.538 -179.146 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . 0.516 ' OD2' ' NH1' ' A' ' 55' ' ' ARG . 15.8 t0 -95.95 122.05 59.38 Favored Pre-proline 0 CA--C 1.534 0.328 0 CA-C-N 115.608 -0.296 . . . . 0.0 110.423 180.0 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -60.82 -21.71 71.28 Favored 'Trans proline' 0 N--CA 1.495 1.611 0 C-N-CA 122.472 2.115 . . . . 0.0 112.183 -179.315 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 22.9 mt-30 -78.67 -24.06 45.34 Favored 'General case' 0 C--N 1.326 -0.448 0 C-N-CA 120.435 -0.506 . . . . 0.0 111.619 -179.19 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.542 ' O ' ' CE1' ' A' ' 57' ' ' PHE . 1.2 mpp_? -93.35 153.18 41.51 Favored Pre-proline 0 N--CA 1.464 0.239 0 C-N-CA 120.595 -0.442 . . . . 0.0 110.004 179.698 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_endo -65.4 160.73 41.21 Favored 'Trans proline' 0 C--N 1.308 -1.585 0 C-N-CA 122.737 2.291 . . . . 0.0 113.273 -178.899 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.542 ' CE1' ' O ' ' A' ' 55' ' ' ARG . 48.3 m-85 -130.87 155.24 47.07 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 114.891 -1.05 . . . . 0.0 109.117 179.633 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.439 ' O ' ' HA ' ' A' ' 22' ' ' ILE . 13.2 mm-40 -123.04 138.36 54.7 Favored 'General case' 0 N--CA 1.469 0.521 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 178.753 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . 0.449 ' HB2' HD13 ' A' ' 73' ' ' ILE . . . -119.63 137.4 53.9 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.231 0.539 . . . . 0.0 112.133 -178.296 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.891 ' HE ' ' HE ' ' A' ' 70' ' ' ARG . 40.0 mtt85 -124.17 128.2 48.88 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.27 -0.877 . . . . 0.0 108.788 177.729 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.405 HD23 ' N ' ' A' ' 61' ' ' LEU . 0.0 OUTLIER -113.33 146.46 39.4 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.021 0.439 . . . . 0.0 110.634 -179.25 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' TYR . . . . . 0.449 ' CD1' ' N ' ' A' ' 62' ' ' TYR . 24.0 m-85 -124.03 108.85 12.82 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.173 179.56 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.471 ' C ' HD23 ' A' ' 63' ' ' LEU . 1.8 tt -103.13 -86.5 0.44 Allowed 'General case' 0 C--N 1.333 -0.138 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 179.551 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.447 ' H ' ' HB ' ' A' ' 67' ' ' VAL . . . -74.3 174.06 50.36 Favored Glycine 0 CA--C 1.522 0.524 0 N-CA-C 109.147 -1.581 . . . . 0.0 109.147 178.367 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.569 ' N ' HD12 ' A' ' 65' ' ' LEU . 7.9 mp -71.31 -33.16 69.42 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 119.94 -0.704 . . . . 0.0 110.018 -179.788 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -102.52 9.55 39.44 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.902 179.912 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . 0.469 ' O ' HG12 ' A' ' 67' ' ' VAL . 24.2 t -107.59 98.81 7.45 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.324 0 CA-C-O 121.204 0.526 . . . . 0.0 112.02 -178.742 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.501 HD12 ' N ' ' A' ' 69' ' ' ILE . 4.4 tp -113.86 117.77 32.35 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.268 -0.878 . . . . 0.0 108.709 178.55 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.501 ' N ' HD12 ' A' ' 68' ' ' LEU . 3.1 mt -112.15 144.28 20.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.935 0.398 . . . . 0.0 111.208 -179.04 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.891 ' HE ' ' HE ' ' A' ' 60' ' ' ARG . 1.0 OUTLIER -128.34 131.3 48.6 Favored 'General case' 0 C--O 1.237 0.421 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.677 179.277 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 2.7 mtp -140.07 149.24 42.88 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.055 179.633 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . 0.413 ' OE1' ' OE2' ' A' ' 58' ' ' GLU . 23.9 tt0 -105.01 132.4 51.29 Favored 'General case' 0 CA--C 1.516 -0.33 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 177.995 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.613 HD12 ' CB ' ' A' ' 85' ' ' PHE . 1.5 pt -141.88 158.48 20.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 C-N-CA 119.521 -0.872 . . . . 0.0 113.266 -177.465 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . 0.5 ' OG ' ' NE2' ' A' ' 88' ' ' GLN . 0.3 OUTLIER -118.91 149.16 42.05 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 114.966 -1.015 . . . . 0.0 109.205 178.35 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.518 HD12 ' CE1' ' A' ' 85' ' ' PHE . 16.2 tp -65.76 123.11 18.89 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.236 0.541 . . . . 0.0 110.199 -179.022 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -98.26 -44.62 6.5 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 115.261 -0.882 . . . . 0.0 111.257 178.423 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' TRP . . . . . 0.613 ' NE1' ' HA3' ' A' ' 84' ' ' GLY . 68.8 p-90 -166.05 169.58 14.43 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.412 -179.152 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -148.68 123.66 10.03 Favored 'General case' 0 N--CA 1.465 0.28 0 N-CA-C 109.446 -0.575 . . . . 0.0 109.446 178.222 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 37.6 ttt180 -152.37 133.54 14.3 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 119.762 -0.775 . . . . 0.0 112.809 -179.975 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 36.2 t0 57.24 47.15 17.47 Favored 'General case' 0 N--CA 1.465 0.276 0 N-CA-C 114.055 1.132 . . . . 0.0 114.055 176.845 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 82.9 -26.71 4.13 Favored Glycine 0 CA--C 1.521 0.452 0 C-N-CA 120.388 -0.911 . . . . 0.0 113.048 177.271 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 5.2 mt -89.66 161.6 16.03 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 117.689 0.744 . . . . 0.0 110.842 -179.057 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 40.5 mt -134.78 135.98 42.23 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.198 -179.25 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . 0.613 ' HA3' ' NE1' ' A' ' 77' ' ' TRP . . . -102.33 153.91 18.51 Favored Glycine 0 N--CA 1.453 -0.203 0 N-CA-C 109.741 -1.343 . . . . 0.0 109.741 178.529 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' PHE . . . . . 0.613 ' CB ' HD12 ' A' ' 73' ' ' ILE . 54.6 m-85 -145.64 139.63 26.75 Favored 'General case' 0 C--N 1.318 -0.777 0 C-N-CA 120.828 -0.349 . . . . 0.0 110.71 -179.725 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 20.4 pt-20 -103.86 130.08 51.4 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.084 -0.71 . . . . 0.0 109.084 179.764 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . 0.55 ' O ' ' CD2' ' A' ' 39' ' ' HIS . 5.2 t -77.33 124.36 27.75 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.006 0.431 . . . . 0.0 111.581 -178.556 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . 0.5 ' NE2' ' OG ' ' A' ' 74' ' ' SER . 0.0 OUTLIER -101.2 -29.67 11.97 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.206 179.685 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . 0.532 ' ND1' ' C ' ' A' ' 89' ' ' HIS . 0.0 OUTLIER -161.71 141.72 10.36 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.063 0.459 . . . . 0.0 110.273 179.471 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.451 HG23 ' CG1' ' A' ' 95' ' ' ILE . 6.6 tt -145.57 141.1 22.25 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-N 115.755 -0.657 . . . . 0.0 109.971 -179.547 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . 0.516 ' CG ' ' H ' ' A' ' 94' ' ' SER . 0.1 OUTLIER -53.69 141.05 27.5 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 115.164 -0.925 . . . . 0.0 111.747 -178.444 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.445 ' N ' ' OD1' ' A' ' 91' ' ' ASP . 3.1 tp -54.27 -42.53 70.1 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.122 -0.945 . . . . 0.0 110.593 -179.558 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 11.5 t0 -70.15 -36.83 75.01 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 179.476 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' SER . . . . . 0.516 ' H ' ' CG ' ' A' ' 91' ' ' ASP . 3.6 m -64.53 -37.85 88.98 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.661 -0.699 . . . . 0.0 109.784 179.162 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . 0.451 ' CG1' HG23 ' A' ' 90' ' ' ILE . 50.1 mt -58.74 -37.82 68.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.056 179.529 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -70.56 -41.06 72.93 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.717 -179.167 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 64.1 m-70 . . . . . 0 C--N 1.325 -0.469 0 C-N-CA 119.932 -0.707 . . . . 0.0 109.764 179.786 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 7.2 mm . . . . . 0 N--CA 1.456 -0.164 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -95.08 120.89 36.06 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.475 0.655 . . . . 0.0 111.992 -178.926 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 23.2 p90 -149.3 158.09 43.88 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 114.873 -1.058 . . . . 0.0 108.448 177.567 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -95.55 146.38 24.5 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 120.291 -0.564 . . . . 0.0 110.314 -179.591 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . 179.94 176.77 0.69 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.075 179.788 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -96.28 133.94 40.02 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.104 -179.686 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.47 ' O ' ' O ' ' A' ' 31' ' ' VAL . 11.4 p -132.94 150.32 52.17 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.081 -0.509 . . . . 0.0 109.941 178.338 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.559 ' OE1' ' NH2' ' A' ' 28' ' ' ARG . 8.3 mm-40 -132.51 138.2 47.45 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 179.59 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 43.0 mt -119.32 136.12 57.52 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 121.353 0.597 . . . . 0.0 110.987 -179.091 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.595 ' H ' HD12 ' A' ' 23' ' ' LEU . 0.1 OUTLIER -123.73 123.2 39.98 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.33 -0.85 . . . . 0.0 111.107 -179.135 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.482 ' O ' ' OE1' ' A' ' 24' ' ' GLN . 1.4 tm0? -128.65 101.57 6.2 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.328 -0.851 . . . . 0.0 109.687 178.918 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 80.99 -125.68 6.99 Favored Glycine 0 CA--C 1.525 0.662 0 N-CA-C 110.103 -1.199 . . . . 0.0 110.103 -178.664 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -101.17 11.63 39.07 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.86 0.362 . . . . 0.0 110.06 179.404 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.529 ' HB3' ' CZ2' ' A' ' 29' ' ' TRP . 36.1 mtt85 -113.5 134.65 54.56 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 112.652 0.612 . . . . 0.0 112.652 -178.146 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.559 ' NH2' ' OE1' ' A' ' 21' ' ' GLU . 70.0 ttt-85 -128.38 149.33 50.58 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.443 179.325 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.534 ' NE1' ' O ' ' A' ' 48' ' ' ASP . 7.8 m-90 -146.5 156.25 43.13 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.386 -0.825 . . . . 0.0 110.496 -179.382 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.531 ' CD ' ' H ' ' A' ' 30' ' ' GLU . 3.7 mp0 -100.77 138.85 37.27 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.975 -0.557 . . . . 0.0 109.621 179.35 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.47 ' O ' ' O ' ' A' ' 20' ' ' SER . 9.1 m -147.28 156.33 10.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-O 121.287 0.565 . . . . 0.0 110.962 -179.434 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 11.4 tp -97.04 129.92 44.42 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 108.123 -1.065 . . . . 0.0 108.123 178.631 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -92.08 124.09 35.92 Favored 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 120.29 -0.564 . . . . 0.0 110.072 -179.827 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 77.0 m-70 -90.67 -30.1 17.33 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.339 -0.846 . . . . 0.0 111.474 -178.803 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 0.401 ' OD1' ' C ' ' A' ' 35' ' ' ASP . 2.1 p30 -170.05 160.57 8.24 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 119.538 -0.865 . . . . 0.0 110.868 177.26 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . 0.537 HG22 ' H ' ' A' ' 37' ' ' SER . 3.4 p -144.75 169.17 8.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.055 -178.825 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . 0.537 ' H ' HG22 ' A' ' 36' ' ' VAL . 13.1 t -140.89 168.34 20.03 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 108.497 -0.927 . . . . 0.0 108.497 179.083 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.426 HD12 ' N ' ' A' ' 38' ' ' LEU . 0.3 OUTLIER -66.99 -2.02 4.82 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 119.92 -0.712 . . . . 0.0 110.687 -179.572 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . 0.421 ' N ' HD12 ' A' ' 38' ' ' LEU . 0.1 OUTLIER -158.71 35.91 0.22 Allowed 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 120.695 -0.402 . . . . 0.0 111.185 179.889 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -174.48 157.38 24.87 Favored Glycine 0 CA--C 1.526 0.78 0 N-CA-C 110.947 -0.861 . . . . 0.0 110.947 179.681 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -146.39 148.18 17.29 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.267 0 CA-C-O 121.484 0.659 . . . . 0.0 111.661 -179.239 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.409 HD23 ' N ' ' A' ' 43' ' ' VAL . 0.8 OUTLIER -122.15 134.79 54.74 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 114.936 -1.029 . . . . 0.0 108.896 178.776 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.409 ' N ' HD23 ' A' ' 42' ' ' LEU . 22.0 m -139.37 174.95 8.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-O 121.227 0.537 . . . . 0.0 111.837 -179.311 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -96.77 143.33 16.67 Favored Glycine 0 CA--C 1.528 0.881 0 N-CA-C 109.331 -1.508 . . . . 0.0 109.331 178.071 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . 0.44 ' O ' ' OE1' ' A' ' 45' ' ' GLN . 2.1 tm0? -85.52 115.93 63.51 Favored Pre-proline 0 N--CA 1.465 0.275 0 CA-C-N 118.041 0.921 . . . . 0.0 111.678 -178.715 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 97.8 Cg_endo -86.27 161.5 9.86 Favored 'Trans proline' 0 C--N 1.308 -1.572 0 C-N-CA 121.543 1.495 . . . . 0.0 111.241 178.732 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 19.7 mt-30 -65.41 -40.21 93.1 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 112.591 0.589 . . . . 0.0 112.591 -178.789 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . 0.534 ' O ' ' NE1' ' A' ' 29' ' ' TRP . 1.8 m-20 -71.64 8.4 1.14 Allowed 'General case' 0 N--CA 1.465 0.286 0 N-CA-C 112.013 0.375 . . . . 0.0 112.013 -178.709 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' TRP . . . . . 0.455 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 61.7 t-105 -60.56 67.84 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 111.832 0.308 . . . . 0.0 111.832 -179.426 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . 0.547 HD22 ' C ' ' A' ' 50' ' ' ASN . 0.3 OUTLIER -93.46 78.89 4.37 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 120.155 -0.618 . . . . 0.0 109.816 178.698 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -141.24 160.3 26.79 Favored Glycine 0 CA--C 1.525 0.706 0 N-CA-C 111.223 -0.751 . . . . 0.0 111.223 -179.656 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 59.2 t0 -97.32 108.03 42.12 Favored Pre-proline 0 CA--C 1.531 0.242 0 N-CA-C 110.627 -0.138 . . . . 0.0 110.627 -179.842 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -47.52 -22.54 2.87 Favored 'Trans proline' 0 C--N 1.311 -1.439 0 C-N-CA 122.167 1.911 . . . . 0.0 112.341 179.973 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 25.1 mt-30 -74.85 -23.99 58.51 Favored 'General case' 0 C--N 1.324 -0.512 0 C-N-CA 120.51 -0.476 . . . . 0.0 111.233 -179.237 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.546 ' O ' ' CE1' ' A' ' 57' ' ' PHE . 0.0 OUTLIER -96.77 150.09 36.53 Favored Pre-proline 0 C--N 1.331 -0.237 0 N-CA-C 109.863 -0.421 . . . . 0.0 109.863 -179.948 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 25.5 Cg_endo -61.62 160.78 26.92 Favored 'Trans proline' 0 N--CA 1.495 1.615 0 C-N-CA 122.824 2.349 . . . . 0.0 113.298 -178.487 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.546 ' CE1' ' O ' ' A' ' 55' ' ' ARG . 52.5 m-85 -130.98 154.69 47.89 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.012 -0.994 . . . . 0.0 109.313 179.58 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -122.16 136.39 54.9 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 109.036 -0.728 . . . . 0.0 109.036 178.372 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . 0.627 ' HB2' HD13 ' A' ' 73' ' ' ILE . . . -118.1 138.27 52.38 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.225 0.536 . . . . 0.0 112.19 -178.099 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.477 ' HG3' HD11 ' A' ' 23' ' ' LEU . 20.0 mtm-85 -124.09 127.67 48.16 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 177.813 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 12.8 mt -109.76 151.02 27.48 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.002 0.43 . . . . 0.0 111.215 -178.741 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 38.2 m-85 -132.29 108.84 9.48 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.428 179.593 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.442 ' C ' HD23 ' A' ' 63' ' ' LEU . 1.1 tt -102.84 -84.59 0.46 Allowed 'General case' 0 C--N 1.332 -0.155 0 N-CA-C 108.941 -0.763 . . . . 0.0 108.941 179.089 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.451 ' H ' ' HB ' ' A' ' 67' ' ' VAL . . . -76.65 179.35 49.27 Favored Glycine 0 CA--C 1.523 0.548 0 N-CA-C 108.819 -1.712 . . . . 0.0 108.819 178.202 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.623 ' N ' HD12 ' A' ' 65' ' ' LEU . 7.5 mp -74.07 -32.3 63.22 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 119.708 -0.797 . . . . 0.0 110.251 -179.589 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . 0.401 ' O ' ' OD1' ' A' ' 66' ' ' ASP . 51.9 t0 -102.35 9.4 39.85 Favored 'General case' 0 C--N 1.332 -0.154 0 C-N-CA 122.735 0.414 . . . . 0.0 111.166 -179.865 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . 0.572 ' O ' HG12 ' A' ' 67' ' ' VAL . 8.6 t -104.36 94.36 3.12 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.238 0 CA-C-O 121.487 0.66 . . . . 0.0 111.533 -179.172 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 6.6 tp -109.74 117.44 33.9 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 114.863 -1.062 . . . . 0.0 108.214 178.542 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.49 HG23 ' CB ' ' A' ' 94' ' ' SER . 7.6 mt -115.79 143.79 24.92 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.373 0 CA-C-O 121.047 0.451 . . . . 0.0 111.228 -178.632 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.444 ' C ' ' HG2' ' A' ' 71' ' ' MET . 0.0 OUTLIER -128.2 130.84 48.63 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.056 179.197 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . 0.776 ' SD ' HD12 ' A' ' 90' ' ' ILE . 0.0 OUTLIER -139.91 148.04 41.44 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.625 -0.716 . . . . 0.0 109.611 179.511 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -100.43 132.78 45.62 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 107.081 -1.452 . . . . 0.0 107.081 177.731 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.627 HD13 ' HB2' ' A' ' 59' ' ' ALA . 7.7 pt -141.69 157.44 21.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 C-N-CA 119.407 -0.917 . . . . 0.0 113.458 -176.813 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . 0.506 ' OG ' ' NE2' ' A' ' 88' ' ' GLN . 0.5 OUTLIER -122.78 155.97 35.45 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 114.925 -1.034 . . . . 0.0 109.877 178.736 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.512 HD13 ' N ' ' A' ' 76' ' ' ALA . 0.2 OUTLIER -65.1 119.42 10.78 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.521 -0.308 . . . . 0.0 110.632 -179.533 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . 0.512 ' N ' HD13 ' A' ' 75' ' ' LEU . . . -97.1 -40.27 8.91 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 177.344 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' TRP . . . . . 0.623 ' NE1' ' HA3' ' A' ' 84' ' ' GLY . 69.2 p-90 -171.68 169.78 5.85 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.143 179.674 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -150.53 123.52 8.75 Favored 'General case' 0 N--CA 1.463 0.184 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 178.239 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 24.4 ttt85 -152.44 133.79 14.42 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 119.934 -0.706 . . . . 0.0 112.75 -179.948 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . 0.424 ' O ' ' OD1' ' A' ' 80' ' ' ASP . 25.7 t0 57.07 47.46 17.36 Favored 'General case' 0 N--CA 1.463 0.196 0 N-CA-C 113.764 1.024 . . . . 0.0 113.764 176.747 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 83.17 -27.95 3.86 Favored Glycine 0 CA--C 1.522 0.53 0 C-N-CA 120.241 -0.981 . . . . 0.0 113.284 177.073 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 4.3 mt -89.61 159.24 17.26 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 117.83 0.815 . . . . 0.0 110.436 -178.88 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 39.8 mt -131.48 135.98 47.54 Favored 'General case' 0 CA--C 1.518 -0.288 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.541 -178.811 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . 0.623 ' HA3' ' NE1' ' A' ' 77' ' ' TRP . . . -100.11 153.08 19.38 Favored Glycine 0 N--CA 1.453 -0.233 0 N-CA-C 109.748 -1.341 . . . . 0.0 109.748 178.471 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' PHE . . . . . 0.451 ' CE1' HD22 ' A' ' 75' ' ' LEU . 33.6 m-85 -145.7 135.72 23.67 Favored 'General case' 0 C--N 1.318 -0.768 0 C-N-CA 120.734 -0.386 . . . . 0.0 110.612 -179.575 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.408 ' H ' ' HG2' ' A' ' 86' ' ' GLU . 10.3 pt-20 -104.18 127.31 51.77 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.06 -0.719 . . . . 0.0 109.06 179.363 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -74.27 125.35 28.24 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.173 0.511 . . . . 0.0 111.542 -178.638 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . 0.506 ' NE2' ' OG ' ' A' ' 74' ' ' SER . 0.0 OUTLIER -102.5 -29.82 11.36 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.032 179.817 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . 0.636 ' ND1' ' N ' ' A' ' 90' ' ' ILE . 0.0 OUTLIER -158.38 140.23 13.81 Favored 'General case' 0 C--O 1.226 -0.163 0 N-CA-C 109.891 -0.411 . . . . 0.0 109.891 178.735 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.776 HD12 ' SD ' ' A' ' 71' ' ' MET . 7.0 tt -146.15 141.08 21.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-O 121.352 0.596 . . . . 0.0 109.988 -179.444 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . 0.494 ' CB ' ' OG ' ' A' ' 94' ' ' SER . 0.1 OUTLIER -53.75 142.03 24.84 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.287 -0.87 . . . . 0.0 112.05 -178.381 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 6.0 tp -54.43 -42.36 70.45 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.178 -0.919 . . . . 0.0 109.968 -179.993 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . 0.425 ' OD2' ' OD2' ' A' ' 91' ' ' ASP . 3.5 p30 -68.36 -42.49 79.13 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.145 -0.48 . . . . 0.0 109.97 179.636 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' SER . . . . . 0.494 ' OG ' ' CB ' ' A' ' 91' ' ' ASP . 1.9 p -62.31 -36.24 81.55 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.037 -0.529 . . . . 0.0 109.998 179.373 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . 0.487 ' CG1' HG23 ' A' ' 90' ' ' ILE . 36.7 mt -58.86 -37.97 70.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.157 179.664 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -70.24 -39.71 74.89 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.257 -0.577 . . . . 0.0 110.914 -178.758 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 60.4 m-70 . . . . . 0 C--N 1.326 -0.431 0 C-N-CA 119.515 -0.874 . . . . 0.0 109.108 179.753 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.66 ' N ' HD12 ' A' ' 14' ' ' ILE . 1.7 mp . . . . . 0 CA--C 1.518 -0.264 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -94.42 120.41 34.61 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.403 0.621 . . . . 0.0 111.676 -178.963 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 1.6 p90 -149.67 158.09 43.85 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 114.768 -1.105 . . . . 0.0 108.212 177.85 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 31.4 m-20 -95.37 146.42 24.4 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 120.14 -0.624 . . . . 0.0 110.432 -179.22 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -179.27 176.83 0.82 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.967 -0.56 . . . . 0.0 109.742 179.652 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -96.66 134.43 39.91 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.195 -179.666 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.595 ' O ' ' O ' ' A' ' 31' ' ' VAL . 16.9 p -133.43 153.98 51.16 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.01 0.434 . . . . 0.0 109.875 178.445 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.4 mt-10 -134.61 140.43 46.06 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 179.658 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 2.7 mm -118.93 135.66 58.63 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-O 121.489 0.661 . . . . 0.0 110.404 -179.639 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -127.23 123.06 35.68 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.04 -0.982 . . . . 0.0 110.482 -179.254 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.581 ' O ' ' OE1' ' A' ' 24' ' ' GLN . 1.4 tm0? -128.39 102.22 6.56 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.444 -0.798 . . . . 0.0 109.485 178.935 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 80.23 -124.22 6.39 Favored Glycine 0 CA--C 1.524 0.629 0 N-CA-C 110.204 -1.158 . . . . 0.0 110.204 -178.797 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -102.38 11.62 37.76 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.78 0.324 . . . . 0.0 110.288 179.915 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.591 ' HB3' ' CZ2' ' A' ' 29' ' ' TRP . 46.5 mtt180 -114.34 136.53 52.87 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 112.844 0.683 . . . . 0.0 112.844 -177.962 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.414 ' HG2' ' N ' ' A' ' 29' ' ' TRP . 27.7 ttt180 -129.05 149.55 50.82 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.104 0.478 . . . . 0.0 110.272 179.344 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.591 ' CZ2' ' HB3' ' A' ' 27' ' ' ARG . 5.6 m-90 -150.26 125.66 10.15 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.682 -178.859 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -75.06 143.29 43.53 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 119.853 -0.739 . . . . 0.0 109.692 -179.0 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.595 ' O ' ' O ' ' A' ' 20' ' ' SER . 6.1 m -148.4 158.94 7.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-O 121.262 0.553 . . . . 0.0 111.176 -179.019 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 1.11 ' H ' HD23 ' A' ' 32' ' ' LEU . 1.5 pt? -99.05 130.35 45.37 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 108.816 -0.809 . . . . 0.0 108.816 178.729 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -94.24 124.94 38.58 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.311 0.577 . . . . 0.0 109.544 -179.939 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 71.1 m-70 -89.49 -26.18 21.05 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.379 -0.828 . . . . 0.0 111.882 -178.241 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -174.03 162.98 3.92 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 119.739 -0.784 . . . . 0.0 111.326 177.842 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . 0.51 HG22 ' H ' ' A' ' 37' ' ' SER . 4.8 p -146.71 168.81 5.49 Favored 'Isoleucine or valine' 0 C--O 1.231 0.104 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.041 -179.097 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . 0.51 ' H ' HG22 ' A' ' 36' ' ' VAL . 67.5 p -142.28 168.08 20.58 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 107.321 -1.363 . . . . 0.0 107.321 177.851 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -62.41 -0.81 0.63 Allowed 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 119.33 -0.948 . . . . 0.0 110.697 -179.239 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . 0.434 ' H ' ' C ' ' A' ' 37' ' ' SER . 0.4 OUTLIER -164.92 45.62 0.09 Allowed 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 120.628 -0.429 . . . . 0.0 111.425 179.978 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -179.17 150.98 9.81 Favored Glycine 0 CA--C 1.529 0.919 0 N-CA-C 110.812 -0.915 . . . . 0.0 110.812 179.75 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -146.36 148.14 17.35 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.267 0 CA-C-O 121.445 0.64 . . . . 0.0 111.903 -179.175 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -122.52 126.62 48.19 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 114.921 -1.036 . . . . 0.0 108.963 179.059 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 30.5 m -131.3 174.96 12.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 121.392 0.615 . . . . 0.0 111.742 -179.379 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -98.28 145.61 17.83 Favored Glycine 0 CA--C 1.528 0.883 0 N-CA-C 109.638 -1.385 . . . . 0.0 109.638 178.393 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 6.9 tt0 -87.41 113.98 56.58 Favored Pre-proline 0 N--CA 1.466 0.346 0 CA-C-N 117.886 0.843 . . . . 0.0 111.992 -178.486 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -84.58 161.37 12.57 Favored 'Trans proline' 0 C--N 1.308 -1.575 0 C-N-CA 121.663 1.575 . . . . 0.0 111.359 178.474 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 4.8 tt0 -65.43 -40.06 92.87 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 112.279 0.474 . . . . 0.0 112.279 -178.894 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . 0.524 ' O ' ' N ' ' A' ' 50' ' ' ASN . 57.7 t0 -73.18 8.39 1.68 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.528 -0.306 . . . . 0.0 111.62 -178.755 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' TRP . . . . . 0.465 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 62.6 t-105 -60.93 68.2 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.564 -0.289 . . . . 0.0 111.567 -179.667 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . 0.555 ' ND2' ' C ' ' A' ' 50' ' ' ASN . 0.6 OUTLIER -93.69 78.69 4.26 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 178.468 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -138.58 161.43 25.75 Favored Glycine 0 CA--C 1.524 0.602 0 C-N-CA 120.875 -0.679 . . . . 0.0 111.721 -179.429 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . 0.516 ' H ' ' NE2' ' A' ' 24' ' ' GLN . 0.4 OUTLIER -96.14 120.39 62.81 Favored Pre-proline 0 CA--C 1.535 0.385 0 N-CA-C 109.836 -0.431 . . . . 0.0 109.836 179.774 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_endo -63.86 -22.29 68.99 Favored 'Trans proline' 0 N--CA 1.492 1.44 0 C-N-CA 122.172 1.914 . . . . 0.0 112.48 -179.368 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 42.5 mm-40 -75.95 -23.84 55.43 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 120.353 -0.539 . . . . 0.0 111.12 -179.492 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.518 ' O ' ' CE1' ' A' ' 57' ' ' PHE . 80.6 mtt180 -96.87 146.79 31.91 Favored Pre-proline 0 CA--C 1.532 0.258 0 C-N-CA 120.748 -0.381 . . . . 0.0 110.396 179.956 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_exo -57.87 160.97 13.77 Favored 'Trans proline' 0 N--CA 1.496 1.653 0 C-N-CA 122.665 2.244 . . . . 0.0 113.177 -179.332 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.518 ' CE1' ' O ' ' A' ' 55' ' ' ARG . 33.9 m-85 -129.62 154.88 46.66 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 114.973 -1.012 . . . . 0.0 108.766 179.049 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 28.3 mt-10 -122.25 137.93 54.67 Favored 'General case' 0 N--CA 1.465 0.279 0 N-CA-C 109.319 -0.623 . . . . 0.0 109.319 178.54 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -121.41 139.47 53.41 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.033 0.444 . . . . 0.0 112.167 -178.026 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.503 ' CG ' HH11 ' A' ' 60' ' ' ARG . 1.9 mtt-85 -123.12 127.31 48.52 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 177.03 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.49 ' N ' HD12 ' A' ' 61' ' ' LEU . 9.6 mp -106.52 151.07 25.47 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 120.777 -0.369 . . . . 0.0 110.255 -179.433 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 28.4 m-85 -134.11 110.0 9.31 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.735 179.963 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.518 ' C ' HD23 ' A' ' 63' ' ' LEU . 2.2 tt -104.37 -82.39 0.51 Allowed 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 115.698 -0.683 . . . . 0.0 109.346 179.513 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.455 ' H ' ' HB ' ' A' ' 67' ' ' VAL . . . -79.43 179.18 53.23 Favored Glycine 0 CA--C 1.523 0.535 0 N-CA-C 109.343 -1.503 . . . . 0.0 109.343 178.561 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 1.6 mt -73.58 -34.5 65.14 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 119.767 -0.773 . . . . 0.0 110.426 -179.463 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -99.96 9.23 43.27 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.954 179.908 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . 0.567 ' O ' HG12 ' A' ' 67' ' ' VAL . 9.6 t -106.35 96.04 4.29 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.228 0 CA-C-O 121.168 0.509 . . . . 0.0 111.96 -178.616 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.513 HD12 ' N ' ' A' ' 69' ' ' ILE . 1.2 tp -114.97 118.06 32.38 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 178.216 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.513 ' N ' HD12 ' A' ' 68' ' ' LEU . 3.1 mt -112.46 146.15 17.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-O 120.846 0.355 . . . . 0.0 111.791 -178.193 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.482 ' NH2' ' OD2' ' A' ' 91' ' ' ASP . 33.8 ptt180 -128.04 132.23 49.1 Favored 'General case' 0 C--O 1.237 0.444 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.053 179.254 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -143.95 150.18 37.94 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.341 -0.845 . . . . 0.0 110.26 -179.965 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -106.33 126.81 52.7 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 178.332 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.593 ' C ' HE21 ' A' ' 88' ' ' GLN . 10.5 pt -134.75 158.97 41.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 C-N-CA 119.77 -0.772 . . . . 0.0 113.01 -177.521 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . 0.579 ' OG ' ' NE2' ' A' ' 88' ' ' GLN . 0.5 OUTLIER -122.77 155.87 35.64 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 115.048 -0.978 . . . . 0.0 110.172 179.209 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.491 HD22 ' CZ ' ' A' ' 85' ' ' PHE . 0.1 OUTLIER -65.66 119.23 10.78 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.311 -179.902 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . 0.416 ' N ' HD13 ' A' ' 75' ' ' LEU . . . -96.98 -40.75 8.73 Favored 'General case' 0 C--N 1.331 -0.203 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 177.648 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' TRP . . . . . 0.585 ' NE1' ' HA3' ' A' ' 84' ' ' GLY . 68.1 p-90 -171.28 169.3 6.4 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.517 -0.765 . . . . 0.0 109.809 179.8 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -149.43 123.79 9.62 Favored 'General case' 0 N--CA 1.464 0.245 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 178.728 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 26.7 ttt180 -152.35 134.36 14.91 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 119.706 -0.798 . . . . 0.0 113.017 179.791 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . 0.515 ' O ' ' OD1' ' A' ' 80' ' ' ASP . 11.8 t0 57.07 47.51 17.27 Favored 'General case' 0 N--CA 1.463 0.18 0 N-CA-C 113.861 1.06 . . . . 0.0 113.861 176.702 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 82.54 -27.61 3.68 Favored Glycine 0 CA--C 1.523 0.548 0 C-N-CA 120.356 -0.926 . . . . 0.0 113.491 177.121 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 4.7 mt -89.62 157.19 18.13 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 117.756 0.778 . . . . 0.0 110.285 -179.156 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 26.3 mt -128.22 135.43 49.69 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.0 -179.077 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . 0.585 ' HA3' ' NE1' ' A' ' 77' ' ' TRP . . . -98.39 152.52 19.8 Favored Glycine 0 N--CA 1.45 -0.378 0 N-CA-C 109.65 -1.38 . . . . 0.0 109.65 178.734 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' PHE . . . . . 0.491 ' CZ ' HD22 ' A' ' 75' ' ' LEU . 22.4 m-85 -145.66 135.31 23.32 Favored 'General case' 0 C--N 1.317 -0.819 0 C-N-CA 120.642 -0.423 . . . . 0.0 110.913 -179.199 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -104.26 126.22 51.18 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 178.843 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . 0.414 ' HA ' HG22 ' A' ' 73' ' ' ILE . 2.2 t -69.13 122.39 18.68 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.956 0.407 . . . . 0.0 111.679 -178.451 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . 0.593 HE21 ' C ' ' A' ' 73' ' ' ILE . 24.3 mt-30 -96.17 -33.52 12.01 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.18 179.411 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . 0.5 ' ND1' ' C ' ' A' ' 89' ' ' HIS . 0.0 OUTLIER -162.99 142.54 8.89 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.394 -179.905 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.468 HG23 ' CG1' ' A' ' 95' ' ' ILE . 6.2 tt -145.21 141.08 22.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-N 115.856 -0.611 . . . . 0.0 109.695 -179.844 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . 0.483 ' OD1' ' N ' ' A' ' 93' ' ' ASP . 7.0 t70 -56.6 145.72 27.52 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 115.54 -0.755 . . . . 0.0 111.807 -178.109 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.435 ' N ' ' OD1' ' A' ' 91' ' ' ASP . 48.5 tp -54.24 -42.21 69.63 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 115.272 -0.877 . . . . 0.0 110.446 -179.144 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . 0.483 ' N ' ' OD1' ' A' ' 91' ' ' ASP . 1.3 m-20 -70.16 -33.07 71.32 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 179.523 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' SER . . . . . 0.421 ' HB3' HD11 ' A' ' 90' ' ' ILE . 13.3 m -69.06 -37.81 78.73 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.838 -0.619 . . . . 0.0 109.84 179.309 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . 0.468 ' CG1' HG23 ' A' ' 90' ' ' ILE . 56.6 mt -58.87 -38.12 70.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.19 179.623 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -70.6 -42.06 71.5 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.421 -0.512 . . . . 0.0 111.364 -178.538 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 60.9 m-70 . . . . . 0 C--N 1.324 -0.53 0 C-N-CA 119.143 -1.023 . . . . 0.0 109.126 179.51 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.628 ' N ' HD12 ' A' ' 14' ' ' ILE . 1.2 mp . . . . . 0 CA--C 1.52 -0.2 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -94.96 120.25 34.86 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.582 0.706 . . . . 0.0 112.035 -178.924 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 2.5 p90 -149.77 158.79 44.5 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 114.686 -1.143 . . . . 0.0 107.959 177.605 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -95.26 147.11 23.83 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 119.981 -0.688 . . . . 0.0 110.574 -178.963 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.424 ' O ' HD12 ' A' ' 32' ' ' LEU . . . -179.67 178.48 0.64 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.902 -0.59 . . . . 0.0 109.763 179.915 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -96.55 134.04 40.26 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 120.786 -0.365 . . . . 0.0 110.976 179.987 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.583 ' O ' ' O ' ' A' ' 31' ' ' VAL . 7.6 p -135.78 157.04 47.84 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.18 179.044 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.406 ' C ' ' OE1' ' A' ' 21' ' ' GLU . 0.8 OUTLIER -144.74 144.38 31.16 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.122 -0.696 . . . . 0.0 109.122 178.702 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 1.2 mm -119.24 136.75 55.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-O 121.133 0.492 . . . . 0.0 111.591 -177.995 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.549 HD11 ' HG3' ' A' ' 60' ' ' ARG . 0.2 OUTLIER -121.63 123.15 41.24 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.617 -0.72 . . . . 0.0 111.017 -179.882 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.466 ' O ' ' OE1' ' A' ' 24' ' ' GLN . 1.4 tm0? -130.34 102.39 6.17 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.096 179.342 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 80.07 -126.06 7.24 Favored Glycine 0 CA--C 1.523 0.564 0 N-CA-C 109.821 -1.312 . . . . 0.0 109.821 -178.707 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -100.19 11.87 38.36 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 179.151 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.486 ' HB3' ' CZ2' ' A' ' 29' ' ' TRP . 2.2 mtt180 -112.74 131.25 55.76 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.846 -0.615 . . . . 0.0 112.364 -177.267 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.452 HH11 ' HD3' ' A' ' 28' ' ' ARG . 36.4 ttt180 -126.24 148.47 49.47 Favored 'General case' 0 CA--C 1.519 -0.238 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.783 178.875 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.53 ' NE1' ' O ' ' A' ' 48' ' ' ASP . 7.1 m-90 -147.47 156.44 42.85 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.459 -178.894 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.536 ' CD ' ' H ' ' A' ' 30' ' ' GLU . 3.1 mp0 -102.4 140.89 36.08 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.162 -0.472 . . . . 0.0 109.9 179.58 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.583 ' O ' ' O ' ' A' ' 20' ' ' SER . 12.4 m -150.25 157.25 6.16 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-O 121.159 0.504 . . . . 0.0 110.904 -179.697 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.507 HD12 ' N ' ' A' ' 33' ' ' LEU . 6.7 tp -94.23 128.54 40.74 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 107.475 -1.306 . . . . 0.0 107.475 178.144 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.802 ' O ' HD23 ' A' ' 33' ' ' LEU . 0.4 OUTLIER -90.22 126.01 35.68 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.57 -0.53 . . . . 0.0 109.57 -179.727 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 40.0 m-70 -93.06 -28.64 16.24 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.558 -0.747 . . . . 0.0 111.962 -178.218 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 2.0 p-10 -172.75 158.76 4.08 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 119.483 -0.887 . . . . 0.0 110.862 177.418 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . 0.538 HG22 ' N ' ' A' ' 37' ' ' SER . 7.1 p -143.54 169.27 11.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.494 -0.775 . . . . 0.0 110.878 -178.904 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . 0.538 ' N ' HG22 ' A' ' 36' ' ' VAL . 17.1 t -140.91 170.72 15.2 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 178.814 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.489 HD12 ' N ' ' A' ' 39' ' ' HIS . 1.1 pp -67.4 -0.11 3.39 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 119.976 -0.689 . . . . 0.0 111.11 -179.397 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . 0.514 ' NE2' ' O ' ' A' ' 87' ' ' CYS . 1.6 t60 -162.22 35.12 0.12 Allowed 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 120.73 -0.388 . . . . 0.0 111.217 179.776 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -171.66 156.06 25.23 Favored Glycine 0 CA--C 1.526 0.731 0 N-CA-C 110.759 -0.936 . . . . 0.0 110.759 179.903 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -148.03 150.37 14.43 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 CA-C-O 121.597 0.713 . . . . 0.0 112.606 -178.839 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.415 HD23 ' N ' ' A' ' 43' ' ' VAL . 0.6 OUTLIER -123.0 140.51 52.96 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 114.665 -1.152 . . . . 0.0 109.191 178.849 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.415 ' N ' HD23 ' A' ' 42' ' ' LEU . 10.6 m -145.58 174.99 2.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-O 121.091 0.472 . . . . 0.0 111.092 179.95 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -96.96 145.38 17.84 Favored Glycine 0 CA--C 1.526 0.775 0 N-CA-C 109.47 -1.452 . . . . 0.0 109.47 178.237 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 45.2 tt0 -86.6 115.63 62.99 Favored Pre-proline 0 N--CA 1.462 0.154 0 CA-C-N 117.732 0.766 . . . . 0.0 111.79 -178.538 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 66.4 Cg_endo -85.13 161.33 11.53 Favored 'Trans proline' 0 C--N 1.306 -1.67 0 C-N-CA 121.569 1.513 . . . . 0.0 111.134 178.856 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 58.7 mt-30 -65.17 -40.14 93.89 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 112.128 0.418 . . . . 0.0 112.128 -178.885 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . 0.562 ' O ' ' N ' ' A' ' 50' ' ' ASN . 0.9 OUTLIER -72.21 8.63 1.24 Allowed 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 111.85 0.315 . . . . 0.0 111.85 -178.794 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' TRP . . . . . 0.486 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 64.9 t-105 -59.57 67.17 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 111.825 0.305 . . . . 0.0 111.825 -179.738 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . 0.562 ' N ' ' O ' ' A' ' 48' ' ' ASP . 0.2 OUTLIER -93.33 78.34 4.47 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 120.159 -0.616 . . . . 0.0 109.59 178.325 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -144.58 144.34 13.18 Favored Glycine 0 CA--C 1.523 0.533 0 N-CA-C 111.17 -0.772 . . . . 0.0 111.17 -179.38 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 23.0 t0 -77.94 113.33 31.94 Favored Pre-proline 0 CA--C 1.533 0.318 0 CA-C-N 115.878 -0.161 . . . . 0.0 111.102 -179.709 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -50.07 -22.63 8.12 Favored 'Trans proline' 0 N--CA 1.495 1.584 0 C-N-CA 122.522 2.148 . . . . 0.0 112.673 179.578 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 16.7 mm100 -77.51 -23.99 50.12 Favored 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 120.642 -0.423 . . . . 0.0 111.769 -178.853 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.575 ' O ' ' CE1' ' A' ' 57' ' ' PHE . 66.8 mtm180 -92.94 151.04 40.34 Favored Pre-proline 0 C--N 1.33 -0.252 0 C-N-CA 120.671 -0.412 . . . . 0.0 110.077 179.741 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -62.94 160.73 32.32 Favored 'Trans proline' 0 N--CA 1.495 1.596 0 C-N-CA 122.834 2.356 . . . . 0.0 113.436 -178.701 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.575 ' CE1' ' O ' ' A' ' 55' ' ' ARG . 41.6 m-85 -130.59 155.18 46.97 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 114.897 -1.047 . . . . 0.0 109.147 179.343 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.411 ' O ' HD12 ' A' ' 23' ' ' LEU . 14.3 mt-10 -123.06 139.07 54.46 Favored 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 178.777 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . 0.429 ' HB2' HD13 ' A' ' 73' ' ' ILE . . . -118.66 135.93 54.2 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 112.501 0.556 . . . . 0.0 112.501 -177.772 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.574 ' C ' HD12 ' A' ' 61' ' ' LEU . 2.1 mmt85 -122.74 127.67 49.5 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 108.261 -1.014 . . . . 0.0 108.261 177.107 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.625 ' N ' HD12 ' A' ' 61' ' ' LEU . 7.9 mp -111.48 151.22 28.85 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 120.67 -0.412 . . . . 0.0 111.241 -178.558 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 9.8 m-85 -131.76 110.09 10.61 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.625 179.446 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.507 ' C ' HD23 ' A' ' 63' ' ' LEU . 2.0 tt -103.78 -85.43 0.46 Allowed 'General case' 0 C--N 1.333 -0.143 0 N-CA-C 108.991 -0.744 . . . . 0.0 108.991 178.968 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.45 ' H ' ' HB ' ' A' ' 67' ' ' VAL . . . -75.28 179.84 45.1 Favored Glycine 0 CA--C 1.522 0.508 0 N-CA-C 109.017 -1.633 . . . . 0.0 109.017 178.338 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.79 HD22 ' N ' ' A' ' 65' ' ' LEU . 2.5 mm? -74.42 -32.44 62.66 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 119.709 -0.796 . . . . 0.0 110.232 -179.479 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 24.7 m-20 -102.53 9.27 39.59 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 122.734 0.414 . . . . 0.0 111.063 -179.827 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . 0.574 ' O ' HG12 ' A' ' 67' ' ' VAL . 8.5 t -103.22 93.76 2.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-O 121.34 0.59 . . . . 0.0 111.667 -178.905 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 4.4 tp -109.99 117.66 34.37 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 178.272 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.55 HG23 ' OG ' ' A' ' 94' ' ' SER . 6.3 mt -115.78 143.99 24.45 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.278 0 CA-C-O 120.982 0.42 . . . . 0.0 111.374 -178.88 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.502 ' NH2' ' OD2' ' A' ' 91' ' ' ASP . 28.5 ptt-85 -128.38 130.73 48.13 Favored 'General case' 0 C--O 1.237 0.441 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.007 179.223 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . 0.699 ' SD ' HD12 ' A' ' 90' ' ' ILE . 1.5 mtm -139.95 148.19 41.58 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 115.934 -0.576 . . . . 0.0 109.691 179.453 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -101.97 132.68 47.65 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 107.87 -1.159 . . . . 0.0 107.87 178.718 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.649 HD12 ' HB2' ' A' ' 85' ' ' PHE . 4.1 pt -142.7 157.41 18.5 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 C-N-CA 119.44 -0.904 . . . . 0.0 112.977 -177.666 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . 0.656 ' N ' HE22 ' A' ' 88' ' ' GLN . 3.3 t -121.91 155.45 35.42 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 115.47 -0.786 . . . . 0.0 109.763 179.032 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.593 HD13 ' N ' ' A' ' 76' ' ' ALA . 0.2 OUTLIER -65.02 118.43 9.11 Favored 'General case' 0 CA--C 1.521 -0.162 0 CA-C-O 121.161 0.505 . . . . 0.0 110.603 -178.575 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . 0.593 ' N ' HD13 ' A' ' 75' ' ' LEU . . . -97.22 -40.99 8.51 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.064 177.446 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' TRP . . . . . 0.475 ' NE1' ' HA3' ' A' ' 84' ' ' GLY . 68.8 p-90 -170.42 169.76 7.33 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.79 -179.819 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -151.07 123.99 8.65 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 116.299 -0.409 . . . . 0.0 109.948 178.658 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -152.04 132.03 13.42 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 120.043 -0.663 . . . . 0.0 112.364 179.593 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 55.67 47.19 21.14 Favored 'General case' 0 N--CA 1.465 0.287 0 N-CA-C 113.089 0.774 . . . . 0.0 113.089 176.85 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 68.17 12.67 63.44 Favored Glycine 0 CA--C 1.523 0.547 0 C-N-CA 120.343 -0.932 . . . . 0.0 111.902 178.385 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 29.1 mt -115.74 136.13 53.36 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 108.474 -0.935 . . . . 0.0 108.474 178.488 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 37.6 mt -124.48 136.41 53.99 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.497 -178.928 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . 0.475 ' HA3' ' NE1' ' A' ' 77' ' ' TRP . . . -123.36 134.58 9.49 Favored Glycine 0 CA--C 1.519 0.337 0 N-CA-C 109.481 -1.448 . . . . 0.0 109.481 178.551 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' PHE . . . . . 0.649 ' HB2' HD12 ' A' ' 73' ' ' ILE . 26.0 m-85 -122.65 157.78 31.46 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.964 0.412 . . . . 0.0 110.096 -179.805 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -104.8 130.55 52.89 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 178.314 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . 0.514 ' O ' ' NE2' ' A' ' 39' ' ' HIS . 44.5 t -74.78 124.23 26.42 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.826 0.346 . . . . 0.0 111.336 -178.976 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . 0.656 HE22 ' N ' ' A' ' 74' ' ' SER . 0.0 OUTLIER -100.73 -31.2 11.31 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.458 179.598 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . 0.611 ' ND1' ' N ' ' A' ' 90' ' ' ILE . 0.0 OUTLIER -159.2 141.0 13.4 Favored 'General case' 0 C--O 1.225 -0.203 0 CA-C-O 120.909 0.385 . . . . 0.0 110.08 179.283 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.699 HD12 ' SD ' ' A' ' 71' ' ' MET . 7.7 tt -145.31 140.51 22.47 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-O 121.438 0.637 . . . . 0.0 110.15 -178.947 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . 0.502 ' OD2' ' NH2' ' A' ' 70' ' ' ARG . 0.1 OUTLIER -55.02 140.85 36.34 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 115.033 -0.985 . . . . 0.0 112.334 -178.058 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 6.6 tp -54.56 -42.62 71.21 Favored 'General case' 0 N--CA 1.462 0.136 0 CA-C-N 115.075 -0.966 . . . . 0.0 110.321 -179.642 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . 0.414 ' OD1' ' N ' ' A' ' 94' ' ' SER . 0.5 OUTLIER -71.93 -35.8 69.75 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 179.557 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' SER . . . . . 0.55 ' OG ' HG23 ' A' ' 69' ' ' ILE . 1.5 t -64.53 -38.26 90.39 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.427 179.078 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . 0.442 ' CG1' HG23 ' A' ' 90' ' ' ILE . 22.0 mt -59.01 -37.49 68.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.372 179.133 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -70.19 -40.12 74.83 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.096 -0.641 . . . . 0.0 110.612 -178.938 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 59.7 m-70 . . . . . 0 C--N 1.324 -0.51 0 C-N-CA 119.475 -0.89 . . . . 0.0 109.097 179.315 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.704 ' N ' HD12 ' A' ' 14' ' ' ILE . 1.5 mp . . . . . 0 C--O 1.231 0.126 0 N-CA-C 109.762 -0.459 . . . . 0.0 109.762 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -95.5 120.68 36.17 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.307 0.575 . . . . 0.0 112.497 -178.806 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 28.9 p90 -149.74 158.71 44.43 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.009 -0.996 . . . . 0.0 108.316 177.199 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -95.42 147.59 23.37 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 120.152 -0.619 . . . . 0.0 110.74 -179.174 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.617 ' O ' HD12 ' A' ' 32' ' ' LEU . . . 179.27 176.79 0.58 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.097 179.879 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -96.26 134.16 39.71 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.946 -179.927 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.492 ' O ' ' O ' ' A' ' 31' ' ' VAL . 11.7 p -134.44 153.37 51.95 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.925 0.393 . . . . 0.0 110.375 178.952 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 68.6 mt-10 -133.49 140.02 47.0 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 109.136 -0.69 . . . . 0.0 109.136 179.437 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . 0.411 ' HA ' ' O ' ' A' ' 58' ' ' GLU . 0.6 OUTLIER -119.9 135.77 59.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-O 121.311 0.577 . . . . 0.0 110.639 -179.47 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.459 ' H ' HD12 ' A' ' 23' ' ' LEU . 0.2 OUTLIER -123.71 123.26 40.14 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.407 -0.815 . . . . 0.0 111.113 -179.075 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.496 ' OE1' ' NH1' ' A' ' 27' ' ' ARG . 1.5 tm0? -129.62 102.09 6.21 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.377 -0.828 . . . . 0.0 110.042 179.079 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 81.06 -126.44 7.38 Favored Glycine 0 CA--C 1.523 0.549 0 N-CA-C 109.961 -1.256 . . . . 0.0 109.961 -178.87 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 14.7 pt-20 -100.18 11.66 38.83 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 179.269 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.496 ' NH1' ' OE1' ' A' ' 24' ' ' GLN . 0.2 OUTLIER -114.51 133.07 56.05 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.604 -0.726 . . . . 0.0 112.607 -176.443 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.433 ' O ' ' CD1' ' A' ' 29' ' ' TRP . 41.8 ttt-85 -128.12 153.0 47.33 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.334 179.555 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.433 ' CD1' ' O ' ' A' ' 28' ' ' ARG . 6.3 m-90 -150.51 156.48 41.5 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.276 -0.875 . . . . 0.0 110.501 -179.41 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.453 ' N ' ' CD ' ' A' ' 30' ' ' GLU . 4.7 mp0 -100.72 138.59 37.57 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.692 -0.485 . . . . 0.0 109.692 179.462 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.492 ' O ' ' O ' ' A' ' 20' ' ' SER . 18.4 m -148.34 158.69 7.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 121.232 0.539 . . . . 0.0 111.357 -179.241 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.617 HD12 ' O ' ' A' ' 18' ' ' ALA . 15.9 tp -96.52 128.16 43.19 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 108.392 -0.966 . . . . 0.0 108.392 178.732 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -91.08 125.85 35.99 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.249 0.547 . . . . 0.0 110.061 -179.885 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 72.2 m-70 -92.1 -28.24 17.24 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.308 -0.86 . . . . 0.0 111.76 -178.809 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 3.6 p30 -173.78 162.47 4.02 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 119.409 -0.916 . . . . 0.0 111.449 177.677 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . 0.504 HG22 ' H ' ' A' ' 37' ' ' SER . 3.3 p -145.35 168.84 7.93 Favored 'Isoleucine or valine' 0 C--O 1.231 0.124 0 CA-C-N 115.564 -0.744 . . . . 0.0 111.098 -179.063 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . 0.504 ' H ' HG22 ' A' ' 36' ' ' VAL . 30.1 t -140.99 169.32 17.84 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 107.93 -1.137 . . . . 0.0 107.93 178.694 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.68 ' H ' HD12 ' A' ' 38' ' ' LEU . 5.9 mp -64.65 0.21 1.19 Allowed 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 119.44 -0.904 . . . . 0.0 110.241 -179.256 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . 0.445 ' H ' ' C ' ' A' ' 37' ' ' SER . 32.9 p-80 -163.36 43.81 0.11 Allowed 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 120.633 -0.427 . . . . 0.0 111.581 179.995 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 178.78 158.18 20.79 Favored Glycine 0 CA--C 1.53 0.977 0 C-N-CA 120.716 -0.754 . . . . 0.0 111.525 179.784 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -149.34 149.19 15.01 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.352 0 CA-C-O 121.364 0.602 . . . . 0.0 111.751 -178.759 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.416 HD23 ' N ' ' A' ' 43' ' ' VAL . 1.1 tt -121.88 127.75 50.82 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 114.93 -1.032 . . . . 0.0 108.442 178.325 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.416 ' N ' HD23 ' A' ' 42' ' ' LEU . 23.2 m -130.9 174.72 12.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-O 121.3 0.571 . . . . 0.0 111.543 -179.028 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -96.81 144.15 17.16 Favored Glycine 0 CA--C 1.526 0.774 0 N-CA-C 109.164 -1.574 . . . . 0.0 109.164 178.062 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . 0.554 HE21 ' C ' ' A' ' 45' ' ' GLN . 0.0 OUTLIER -85.4 115.49 61.59 Favored Pre-proline 0 N--CA 1.464 0.239 0 CA-C-N 117.995 0.897 . . . . 0.0 111.713 -178.633 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 78.2 Cg_endo -85.47 160.63 11.01 Favored 'Trans proline' 0 C--N 1.307 -1.616 0 C-N-CA 121.685 1.59 . . . . 0.0 111.259 178.923 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 16.5 pt20 -65.43 -30.59 71.4 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.127 0.417 . . . . 0.0 112.127 -179.106 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . 0.543 ' O ' ' N ' ' A' ' 50' ' ' ASN . 40.7 m-20 -80.5 8.45 7.72 Favored 'General case' 0 N--CA 1.465 0.278 0 N-CA-C 111.957 0.355 . . . . 0.0 111.957 -178.699 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' TRP . . . . . 0.441 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 61.8 t-105 -60.1 66.75 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 112.089 0.403 . . . . 0.0 112.089 -179.389 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . 0.551 HD22 ' C ' ' A' ' 50' ' ' ASN . 0.2 OUTLIER -93.25 78.9 4.48 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 120.002 -0.679 . . . . 0.0 109.555 178.386 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -143.9 160.27 27.73 Favored Glycine 0 CA--C 1.523 0.535 0 N-CA-C 111.098 -0.801 . . . . 0.0 111.098 -179.45 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -95.03 109.22 43.18 Favored Pre-proline 0 CA--C 1.534 0.358 0 CA-C-N 115.63 -0.285 . . . . 0.0 110.694 -179.756 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -48.68 -22.53 4.56 Favored 'Trans proline' 0 N--CA 1.494 1.51 0 C-N-CA 122.391 2.061 . . . . 0.0 112.549 179.831 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 8.2 mt-30 -75.71 -24.02 56.18 Favored 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 120.497 -0.481 . . . . 0.0 111.413 -179.13 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.518 ' O ' ' CE1' ' A' ' 57' ' ' PHE . 21.7 mtm180 -94.77 155.79 38.92 Favored Pre-proline 0 C--N 1.33 -0.242 0 C-N-CA 120.838 -0.345 . . . . 0.0 110.085 179.777 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -67.05 160.8 45.61 Favored 'Trans proline' 0 C--N 1.308 -1.569 0 C-N-CA 122.753 2.302 . . . . 0.0 112.935 -179.063 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.518 ' CE1' ' O ' ' A' ' 55' ' ' ARG . 58.8 m-85 -130.53 156.0 45.54 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.142 -0.936 . . . . 0.0 108.953 179.418 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.411 ' O ' ' HA ' ' A' ' 22' ' ' ILE . 33.9 mt-10 -122.5 138.61 54.5 Favored 'General case' 0 C--O 1.221 -0.434 0 N-CA-C 109.063 -0.717 . . . . 0.0 109.063 178.483 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . 0.474 ' HB2' HD13 ' A' ' 73' ' ' ILE . . . -119.86 138.3 53.48 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 112.463 0.542 . . . . 0.0 112.463 -177.876 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.505 ' CZ ' ' OH ' ' A' ' 62' ' ' TYR . 31.3 mtm180 -123.92 127.68 48.34 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 177.681 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.502 HD12 ' C ' ' A' ' 60' ' ' ARG . 11.2 mp -108.73 151.16 26.57 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.0 0.429 . . . . 0.0 111.053 -178.798 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' TYR . . . . . 0.505 ' OH ' ' CZ ' ' A' ' 60' ' ' ARG . 36.8 m-85 -133.42 108.6 8.77 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.29 179.539 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.499 HD12 ' C ' ' A' ' 62' ' ' TYR . 8.8 mp -104.47 -90.11 0.4 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.165 179.436 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -70.12 177.23 32.45 Favored Glycine 0 CA--C 1.523 0.538 0 N-CA-C 109.166 -1.574 . . . . 0.0 109.166 178.304 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.75 ' H ' HD12 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -73.21 -32.61 64.88 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 119.824 -0.75 . . . . 0.0 110.219 -179.544 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -102.42 9.65 39.55 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 122.846 0.459 . . . . 0.0 111.251 -179.763 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . 0.463 ' O ' HG12 ' A' ' 67' ' ' VAL . 34.3 t -106.03 96.51 4.67 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.378 0 CA-C-O 121.441 0.639 . . . . 0.0 111.997 -178.747 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.446 HD13 ' CE2' ' A' ' 62' ' ' TYR . 6.5 tp -113.22 117.61 32.36 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.078 -0.965 . . . . 0.0 108.421 178.514 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.472 HG23 ' CB ' ' A' ' 94' ' ' SER . 3.7 mt -114.16 145.19 20.31 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-O 120.933 0.397 . . . . 0.0 111.56 -178.707 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 6.9 ptm180 -128.01 135.47 49.93 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.801 179.018 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -146.33 149.54 34.0 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.426 -179.597 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -102.96 135.62 44.29 Favored 'General case' 0 N--CA 1.463 0.184 0 N-CA-C 108.01 -1.107 . . . . 0.0 108.01 178.166 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.583 HD12 ' CB ' ' A' ' 85' ' ' PHE . 1.9 pt -144.37 157.89 15.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 C-N-CA 119.467 -0.893 . . . . 0.0 113.163 -177.59 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 1.3 t -123.07 155.86 36.07 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.067 178.805 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.618 HD13 ' N ' ' A' ' 76' ' ' ALA . 0.2 OUTLIER -65.2 118.66 9.56 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.951 0.405 . . . . 0.0 110.338 -179.65 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . 0.618 ' N ' HD13 ' A' ' 75' ' ' LEU . . . -97.1 -40.83 8.63 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.047 177.658 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' TRP . . . . . 0.547 ' NE1' ' HA3' ' A' ' 84' ' ' GLY . 67.2 p-90 -171.04 169.23 6.66 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.316 -179.956 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -151.27 123.86 8.47 Favored 'General case' 0 N--CA 1.464 0.226 0 N-CA-C 109.97 -0.382 . . . . 0.0 109.97 178.778 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 2.7 ttm180 -152.27 134.08 14.78 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 119.827 -0.749 . . . . 0.0 113.016 179.651 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 40.6 m-20 56.56 47.34 18.78 Favored 'General case' 0 N--CA 1.463 0.219 0 N-CA-C 113.983 1.105 . . . . 0.0 113.983 176.485 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 84.36 -27.76 4.52 Favored Glycine 0 CA--C 1.523 0.581 0 C-N-CA 120.408 -0.901 . . . . 0.0 113.452 177.23 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 4.0 mt -89.58 155.76 19.05 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 117.847 0.824 . . . . 0.0 110.439 -179.008 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 44.1 mt -128.62 135.57 49.5 Favored 'General case' 0 CA--C 1.52 -0.208 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.456 -179.136 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . 0.547 ' HA3' ' NE1' ' A' ' 77' ' ' TRP . . . -98.98 151.51 19.5 Favored Glycine 0 N--CA 1.453 -0.199 0 N-CA-C 109.691 -1.363 . . . . 0.0 109.691 178.615 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' PHE . . . . . 0.583 ' CB ' HD12 ' A' ' 73' ' ' ILE . 46.5 m-85 -145.97 136.77 24.35 Favored 'General case' 0 C--N 1.32 -0.702 0 C-N-CA 120.655 -0.418 . . . . 0.0 110.46 -179.716 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -104.06 127.28 51.63 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.411 -0.588 . . . . 0.0 109.411 179.822 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 43.3 t -77.55 128.31 33.96 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.071 0.462 . . . . 0.0 111.21 -179.065 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -103.98 -27.37 12.19 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.191 179.962 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . 0.601 ' ND1' ' N ' ' A' ' 90' ' ' ILE . 0.0 OUTLIER -159.67 140.74 12.55 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.063 0.458 . . . . 0.0 110.281 179.484 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.601 ' N ' ' ND1' ' A' ' 89' ' ' HIS . 8.8 tt -146.06 141.15 21.52 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 115.741 -0.663 . . . . 0.0 109.817 -179.942 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -53.71 140.41 29.61 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.086 -0.961 . . . . 0.0 112.242 -178.004 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 6.4 tt -54.63 -42.22 70.97 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.148 -0.933 . . . . 0.0 109.847 179.822 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -68.27 -36.73 79.84 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 179.225 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' SER . . . . . 0.472 ' CB ' HG23 ' A' ' 69' ' ' ILE . 4.1 m -67.59 -36.4 80.81 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.595 -0.729 . . . . 0.0 109.738 179.146 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . 0.441 HG12 HG23 ' A' ' 90' ' ' ILE . 1.0 OUTLIER -58.66 -38.55 72.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.757 -0.656 . . . . 0.0 109.936 179.284 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -70.9 -38.48 72.99 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.281 -0.568 . . . . 0.0 111.281 -178.735 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 60.4 m-70 . . . . . 0 C--N 1.323 -0.548 0 C-N-CA 118.929 -1.108 . . . . 0.0 108.821 179.456 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 20.5 mm . . . . . 0 CA--C 1.522 -0.113 0 CA-C-O 120.534 0.207 . . . . 0.0 110.53 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -95.25 119.72 34.24 Favored 'General case' 0 C--N 1.331 -0.225 0 C-N-CA 120.157 -0.617 . . . . 0.0 111.694 -179.744 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 6.2 p90 -150.36 159.03 44.75 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 114.876 -1.057 . . . . 0.0 108.201 177.206 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -94.99 146.47 24.23 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 119.935 -0.706 . . . . 0.0 111.176 -178.503 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -178.23 175.86 1.16 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.867 -0.606 . . . . 0.0 109.964 179.646 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -96.22 134.79 38.89 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.083 -179.615 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.58 ' O ' ' O ' ' A' ' 31' ' ' VAL . 11.4 p -134.87 154.07 51.8 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.035 0.445 . . . . 0.0 110.428 178.861 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -133.94 142.61 47.77 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 108.904 -0.776 . . . . 0.0 108.904 179.419 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 53.3 mt -122.61 136.8 58.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-O 121.429 0.633 . . . . 0.0 111.108 -179.541 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.676 ' H ' HD12 ' A' ' 23' ' ' LEU . 0.0 OUTLIER -121.94 123.81 42.56 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.133 -0.94 . . . . 0.0 110.949 -179.158 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.557 ' OE1' ' CE2' ' A' ' 57' ' ' PHE . 5.9 tt0 -126.77 131.2 51.35 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 107.876 -1.157 . . . . 0.0 107.876 178.339 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 47.47 -120.5 5.75 Favored Glycine 0 CA--C 1.528 0.876 0 N-CA-C 110.451 -1.06 . . . . 0.0 110.451 -179.234 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -105.08 13.21 31.18 Favored 'General case' 0 N--CA 1.463 0.225 0 N-CA-C 111.637 0.236 . . . . 0.0 111.637 -179.503 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.618 ' HB3' ' CZ2' ' A' ' 29' ' ' TRP . 2.6 mpt_? -111.95 133.1 54.35 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 -179.023 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.473 ' HG3' ' N ' ' A' ' 29' ' ' TRP . 0.0 OUTLIER -125.18 145.04 50.15 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.02 -0.536 . . . . 0.0 109.799 179.261 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.618 ' CZ2' ' HB3' ' A' ' 27' ' ' ARG . 6.3 m-90 -145.52 156.53 43.77 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.364 -0.835 . . . . 0.0 110.705 -179.03 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 16.4 mt-10 -100.6 137.94 38.34 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 178.773 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.58 ' O ' ' O ' ' A' ' 20' ' ' SER . 26.3 m -147.74 159.05 8.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-O 121.199 0.523 . . . . 0.0 111.287 -179.548 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.872 ' H ' HD23 ' A' ' 32' ' ' LEU . 1.4 pt? -98.38 130.04 45.03 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 108.79 -0.818 . . . . 0.0 108.79 178.652 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -93.31 126.58 38.5 Favored 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 120.179 -0.608 . . . . 0.0 109.661 -179.762 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 76.1 m-70 -91.82 -26.14 18.66 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.366 -0.834 . . . . 0.0 111.959 -178.31 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -174.01 161.03 3.6 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 119.38 -0.928 . . . . 0.0 111.354 177.443 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . 0.526 HG22 ' H ' ' A' ' 37' ' ' SER . 3.4 p -144.22 168.74 10.39 Favored 'Isoleucine or valine' 0 C--O 1.232 0.135 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.987 -179.128 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . 0.526 ' H ' HG22 ' A' ' 36' ' ' VAL . 6.3 t -142.2 168.42 19.79 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 107.621 -1.251 . . . . 0.0 107.621 178.659 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.586 ' CD1' ' ND1' ' A' ' 39' ' ' HIS . 0.3 OUTLIER -63.81 1.02 0.69 Allowed 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 119.216 -0.994 . . . . 0.0 110.549 -179.625 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . 0.586 ' ND1' ' CD1' ' A' ' 38' ' ' LEU . 21.9 p-80 -166.53 44.51 0.06 Allowed 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 120.718 -0.393 . . . . 0.0 111.226 179.35 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -176.97 152.04 11.81 Favored Glycine 0 CA--C 1.526 0.719 0 N-CA-C 111.012 -0.835 . . . . 0.0 111.012 179.68 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -148.01 149.01 15.69 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.259 0 CA-C-O 121.545 0.688 . . . . 0.0 111.581 -179.337 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -121.34 135.04 55.14 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 114.873 -1.058 . . . . 0.0 108.191 178.488 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 20.2 m -140.61 174.71 7.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 C-N-CA 120.261 -0.576 . . . . 0.0 111.826 -178.887 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -97.41 143.99 17.05 Favored Glycine 0 CA--C 1.526 0.746 0 N-CA-C 109.497 -1.441 . . . . 0.0 109.497 178.305 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . 0.54 ' CD ' ' O ' ' A' ' 45' ' ' GLN . 0.0 OUTLIER -86.58 115.91 64.02 Favored Pre-proline 0 CA--C 1.533 0.327 0 CA-C-N 117.74 0.77 . . . . 0.0 111.729 -178.569 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 89.7 Cg_endo -84.62 161.14 12.49 Favored 'Trans proline' 0 C--N 1.308 -1.557 0 C-N-CA 121.42 1.414 . . . . 0.0 111.262 179.003 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.2 pt20 -65.3 -38.34 89.9 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 112.437 0.532 . . . . 0.0 112.437 -178.745 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . 0.594 ' O ' ' NE1' ' A' ' 29' ' ' TRP . 1.3 m-20 -74.66 8.36 2.42 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 111.87 0.322 . . . . 0.0 111.87 -178.647 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' TRP . . . . . 0.463 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 65.4 t-105 -58.57 67.98 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 112.03 0.382 . . . . 0.0 112.03 -179.534 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . 0.561 ' N ' ' O ' ' A' ' 48' ' ' ASP . 0.2 OUTLIER -93.22 78.73 4.51 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 120.086 -0.646 . . . . 0.0 109.585 178.484 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -146.15 143.75 11.98 Favored Glycine 0 CA--C 1.526 0.733 0 N-CA-C 111.242 -0.743 . . . . 0.0 111.242 -179.492 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -77.46 122.22 85.62 Favored Pre-proline 0 CA--C 1.536 0.43 0 CA-C-N 115.77 -0.215 . . . . 0.0 110.939 -179.813 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 12.7 Cg_endo -58.35 -22.69 59.43 Favored 'Trans proline' 0 N--CA 1.496 1.654 0 C-N-CA 122.698 2.266 . . . . 0.0 112.362 -179.441 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 22.2 mp0 -78.77 -23.86 45.04 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.337 -0.545 . . . . 0.0 111.69 -179.183 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.522 ' O ' ' CE1' ' A' ' 57' ' ' PHE . 42.2 mtt180 -91.1 155.41 44.77 Favored Pre-proline 0 N--CA 1.463 0.201 0 C-N-CA 120.471 -0.492 . . . . 0.0 109.921 179.772 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 44.6 Cg_endo -67.81 160.59 47.63 Favored 'Trans proline' 0 C--N 1.308 -1.601 0 C-N-CA 122.762 2.308 . . . . 0.0 113.243 -178.846 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.557 ' CE2' ' OE1' ' A' ' 24' ' ' GLN . 51.5 m-85 -130.64 156.54 44.72 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 114.935 -1.029 . . . . 0.0 108.953 179.433 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.532 ' O ' HD12 ' A' ' 23' ' ' LEU . 19.5 mt-10 -121.95 135.07 54.84 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 108.852 -0.796 . . . . 0.0 108.852 178.466 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . 0.636 ' HB2' HD13 ' A' ' 73' ' ' ILE . . . -116.49 136.92 52.58 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.088 0.47 . . . . 0.0 111.56 -178.431 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 7.0 mtt180 -123.65 127.77 48.7 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 108.538 -0.912 . . . . 0.0 108.538 177.848 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 6.6 mt -107.07 144.82 33.19 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.593 -0.443 . . . . 0.0 110.54 -179.184 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' TYR . . . . . 0.517 ' CD1' ' N ' ' A' ' 62' ' ' TYR . 6.5 m-85 -128.58 110.3 12.13 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.719 179.899 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 9.1 mp -105.57 -91.15 0.4 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.257 179.294 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -68.84 178.8 24.35 Favored Glycine 0 CA--C 1.521 0.461 0 N-CA-C 109.484 -1.446 . . . . 0.0 109.484 178.689 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.627 HD12 ' C ' ' A' ' 65' ' ' LEU . 0.9 OUTLIER -74.0 -31.4 62.94 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.015 -0.674 . . . . 0.0 110.122 -179.893 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . 0.416 ' OD1' ' O ' ' A' ' 66' ' ' ASP . 37.5 t0 -103.39 9.23 37.94 Favored 'General case' 0 C--N 1.333 -0.141 0 C-N-CA 122.663 0.385 . . . . 0.0 111.272 -179.802 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . 0.549 ' O ' HG12 ' A' ' 67' ' ' VAL . 16.4 t -104.08 95.26 3.68 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.3 0 CA-C-O 121.4 0.619 . . . . 0.0 111.761 -178.876 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.491 HD12 ' N ' ' A' ' 69' ' ' ILE . 3.7 tp -111.51 117.19 32.32 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 107.859 -1.163 . . . . 0.0 107.859 178.128 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.609 HG23 ' OG ' ' A' ' 94' ' ' SER . 5.1 mt -114.37 144.12 22.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-O 120.959 0.409 . . . . 0.0 111.086 -178.812 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.416 HH11 ' HD3' ' A' ' 70' ' ' ARG . 4.1 ptt180 -128.28 130.6 48.1 Favored 'General case' 0 C--O 1.238 0.48 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.828 179.189 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . 0.784 ' SD ' HD12 ' A' ' 90' ' ' ILE . 1.2 mtm -140.01 147.47 40.44 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.66 -0.7 . . . . 0.0 109.622 179.583 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -99.68 132.59 44.92 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 107.627 -1.249 . . . . 0.0 107.627 178.529 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.636 HD13 ' HB2' ' A' ' 59' ' ' ALA . 13.1 pt -142.0 157.21 20.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 C-N-CA 119.109 -1.036 . . . . 0.0 113.132 -177.467 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 2.7 p -123.65 155.48 37.67 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 114.983 -1.008 . . . . 0.0 110.021 179.219 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.49 HD12 ' CE1' ' A' ' 85' ' ' PHE . 5.6 tp -66.01 119.45 11.38 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.0 0.429 . . . . 0.0 110.802 -179.699 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -97.22 -41.05 8.48 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.342 177.796 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' TRP . . . . . 0.576 ' NE1' ' HA3' ' A' ' 84' ' ' GLY . 67.8 p-90 -171.0 170.73 6.13 Favored 'General case' 0 N--CA 1.466 0.375 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.051 -179.782 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -151.28 124.11 8.58 Favored 'General case' 0 N--CA 1.465 0.289 0 N-CA-C 110.197 -0.298 . . . . 0.0 110.197 178.89 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 1.2 ttp180 -152.37 134.07 14.69 Favored 'General case' 0 CA--C 1.533 0.326 0 N-CA-C 113.148 0.796 . . . . 0.0 113.148 179.795 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 57.11 47.41 17.34 Favored 'General case' 0 N--CA 1.463 0.225 0 N-CA-C 114.124 1.157 . . . . 0.0 114.124 176.434 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 84.55 -28.64 4.28 Favored Glycine 0 CA--C 1.523 0.571 0 C-N-CA 120.382 -0.913 . . . . 0.0 113.157 177.184 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 6.4 mt -89.5 157.81 17.94 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 117.574 0.687 . . . . 0.0 110.57 -178.927 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.442 HD11 ' CB ' ' A' ' 45' ' ' GLN . 38.0 mt -128.74 135.25 48.94 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.833 -0.622 . . . . 0.0 111.016 -179.397 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . 0.576 ' HA3' ' NE1' ' A' ' 77' ' ' TRP . . . -95.04 152.1 20.32 Favored Glycine 0 N--CA 1.45 -0.392 0 N-CA-C 109.471 -1.451 . . . . 0.0 109.471 178.544 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' PHE . . . . . 0.49 ' CE1' HD12 ' A' ' 75' ' ' LEU . 22.5 m-85 -145.74 132.44 19.96 Favored 'General case' 0 C--N 1.32 -0.716 0 C-N-CA 120.641 -0.424 . . . . 0.0 110.675 -179.247 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.412 ' O ' ' CG ' ' A' ' 86' ' ' GLU . 7.4 pt-20 -104.02 127.45 51.58 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 179.67 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 1.8 t -74.8 125.69 29.33 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.16 0.505 . . . . 0.0 111.824 -178.685 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -100.79 -29.22 12.38 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.162 179.327 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . 0.622 ' ND1' ' N ' ' A' ' 90' ' ' ILE . 0.0 OUTLIER -160.39 141.18 11.9 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.958 0.409 . . . . 0.0 110.143 179.512 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.784 HD12 ' SD ' ' A' ' 71' ' ' MET . 6.5 tt -145.65 140.71 22.02 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.096 -179.23 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -56.33 139.64 47.77 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 115.21 -0.905 . . . . 0.0 112.373 -178.079 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 5.5 tp -54.29 -42.29 69.88 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 115.145 -0.934 . . . . 0.0 110.431 -180.0 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 25.6 t0 -69.06 -37.76 78.69 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 179.277 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' SER . . . . . 0.609 ' OG ' HG23 ' A' ' 69' ' ' ILE . 1.2 t -68.54 -35.19 77.1 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.639 179.183 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . 0.445 ' CG1' HG23 ' A' ' 90' ' ' ILE . 20.3 mt -58.64 -37.27 64.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.771 179.233 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -70.33 -40.71 73.97 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 120.278 -0.569 . . . . 0.0 110.669 -178.999 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 61.6 m-70 . . . . . 0 C--N 1.326 -0.451 0 C-N-CA 119.499 -0.88 . . . . 0.0 109.149 179.454 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.635 ' N ' HD12 ' A' ' 14' ' ' ILE . 1.8 mp . . . . . 0 CA--C 1.52 -0.203 0 CA-C-O 121.008 0.432 . . . . 0.0 110.21 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -94.91 120.57 35.35 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.954 -179.834 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.453 ' HE2' HD23 ' A' ' 63' ' ' LEU . 0.4 OUTLIER -149.48 153.43 37.23 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.058 -0.974 . . . . 0.0 108.453 178.399 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -95.36 149.64 21.15 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 120.299 -0.56 . . . . 0.0 111.149 -178.503 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . 178.39 178.78 0.38 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.802 -0.635 . . . . 0.0 109.99 179.626 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -96.36 134.71 39.16 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.892 -179.941 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.67 ' O ' ' O ' ' A' ' 31' ' ' VAL . 5.8 p -136.5 159.03 43.02 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.34 179.169 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.414 ' C ' ' OE1' ' A' ' 21' ' ' GLU . 0.5 OUTLIER -146.71 146.23 30.26 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 178.674 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . 0.516 ' CD1' HD11 ' A' ' 73' ' ' ILE . 1.1 mm -120.37 136.47 57.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-O 121.208 0.528 . . . . 0.0 111.645 -178.091 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.51 ' H ' HD12 ' A' ' 23' ' ' LEU . 0.2 OUTLIER -121.25 123.11 41.42 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.836 -179.902 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.575 ' OE1' ' CE2' ' A' ' 57' ' ' PHE . 22.9 tt0 -130.39 102.27 6.11 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.303 -0.862 . . . . 0.0 109.775 179.028 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 79.89 -126.51 7.48 Favored Glycine 0 CA--C 1.525 0.657 0 N-CA-C 110.053 -1.219 . . . . 0.0 110.053 -179.022 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.4 pm0 -100.61 10.89 40.58 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.816 0.341 . . . . 0.0 110.213 179.444 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.576 ' HB3' ' CZ2' ' A' ' 29' ' ' TRP . 6.5 mtt180 -112.56 133.82 54.4 Favored 'General case' 0 CA--C 1.52 -0.175 0 N-CA-C 112.228 0.455 . . . . 0.0 112.228 -178.758 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 74.7 ttt180 -128.02 149.2 50.47 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.182 179.417 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.576 ' CZ2' ' HB3' ' A' ' 27' ' ' ARG . 6.7 m-90 -147.15 155.54 42.22 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.246 -179.079 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.559 ' CD ' ' H ' ' A' ' 30' ' ' GLU . 3.0 mp0 -101.5 137.89 39.23 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 179.566 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.67 ' O ' ' O ' ' A' ' 20' ' ' SER . 19.2 m -146.71 157.45 10.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 121.261 0.553 . . . . 0.0 111.16 -179.768 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 1.014 ' H ' HD23 ' A' ' 32' ' ' LEU . 1.6 pt? -96.17 130.27 43.27 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 108.614 -0.884 . . . . 0.0 108.614 178.363 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.518 HD13 HD21 ' A' ' 61' ' ' LEU . 1.7 tt -91.47 125.97 36.39 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.241 0.543 . . . . 0.0 110.088 -179.329 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 75.2 m-70 -91.85 -28.57 17.24 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.225 -0.898 . . . . 0.0 111.86 -178.5 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 2.0 p30 -173.39 162.99 4.42 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 119.412 -0.915 . . . . 0.0 111.461 177.632 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . 0.521 HG22 ' N ' ' A' ' 37' ' ' SER . 7.3 p -145.48 168.01 8.65 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.084 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.777 -179.193 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . 0.521 ' N ' HG22 ' A' ' 36' ' ' VAL . 6.5 t -141.78 170.39 15.81 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 107.907 -1.145 . . . . 0.0 107.907 179.042 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -66.11 -0.62 2.55 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 119.488 -0.885 . . . . 0.0 110.832 -178.909 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . 0.43 ' NE2' ' O ' ' A' ' 87' ' ' CYS . 3.0 t60 -163.09 40.03 0.1 Allowed 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 120.682 -0.407 . . . . 0.0 111.128 179.713 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -175.05 155.38 20.46 Favored Glycine 0 CA--C 1.526 0.749 0 N-CA-C 111.144 -0.782 . . . . 0.0 111.144 179.849 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -148.2 148.94 15.69 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.204 0 CA-C-O 121.359 0.599 . . . . 0.0 111.375 -179.17 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -122.09 137.33 54.85 Favored 'General case' 0 N--CA 1.462 0.134 0 CA-C-N 115.133 -0.94 . . . . 0.0 108.642 178.932 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 19.8 m -141.39 174.88 6.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 C-N-CA 120.27 -0.572 . . . . 0.0 111.788 -179.181 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -96.58 145.25 17.75 Favored Glycine 0 CA--C 1.529 0.968 0 N-CA-C 109.572 -1.411 . . . . 0.0 109.572 178.257 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.4 tm0? -87.34 114.18 57.45 Favored Pre-proline 0 N--CA 1.465 0.283 0 CA-C-N 117.877 0.839 . . . . 0.0 111.947 -178.518 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 94.3 Cg_endo -85.26 161.42 11.34 Favored 'Trans proline' 0 C--N 1.309 -1.524 0 C-N-CA 121.714 1.609 . . . . 0.0 111.723 179.082 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.403 ' HG2' ' H ' ' A' ' 48' ' ' ASP . 0.5 OUTLIER -65.57 -40.32 92.63 Favored 'General case' 0 CA--C 1.532 0.277 0 N-CA-C 112.439 0.533 . . . . 0.0 112.439 -179.081 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . 0.531 ' O ' ' NE1' ' A' ' 29' ' ' TRP . 37.7 m-20 -72.85 8.06 1.7 Allowed 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 111.839 0.311 . . . . 0.0 111.839 -178.565 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' TRP . . . . . 0.448 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 60.3 t-105 -60.67 68.28 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.712 -179.58 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . 0.531 ' N ' ' O ' ' A' ' 48' ' ' ASP . 0.6 OUTLIER -93.22 78.78 4.51 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 120.207 -0.597 . . . . 0.0 109.572 178.643 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -141.45 159.54 26.77 Favored Glycine 0 CA--C 1.524 0.638 0 N-CA-C 111.31 -0.716 . . . . 0.0 111.31 -179.381 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 22.4 t0 -94.47 110.34 48.29 Favored Pre-proline 0 CA--C 1.533 0.291 0 CA-C-N 115.823 -0.189 . . . . 0.0 110.546 -179.98 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_exo -46.39 -22.72 1.76 Allowed 'Trans proline' 0 N--CA 1.495 1.579 0 C-N-CA 122.647 2.232 . . . . 0.0 112.393 -179.919 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.647 HE21 ' NH1' ' A' ' 55' ' ' ARG . 16.0 mt-30 -79.61 -24.05 42.24 Favored 'General case' 0 C--N 1.326 -0.444 0 C-N-CA 120.648 -0.421 . . . . 0.0 111.815 -178.751 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.647 ' NH1' HE21 ' A' ' 54' ' ' GLN . 0.0 OUTLIER -93.55 150.72 39.32 Favored Pre-proline 0 C--N 1.329 -0.283 0 C-N-CA 120.531 -0.468 . . . . 0.0 110.166 179.941 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . 0.453 ' O ' ' OE1' ' A' ' 24' ' ' GLN . 35.9 Cg_endo -64.43 160.68 38.18 Favored 'Trans proline' 0 N--CA 1.495 1.582 0 C-N-CA 122.841 2.361 . . . . 0.0 113.421 -178.655 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.578 ' CE1' ' O ' ' A' ' 55' ' ' ARG . 50.4 m-85 -131.22 157.02 44.34 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 114.845 -1.07 . . . . 0.0 109.134 179.594 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.411 ' O ' HD12 ' A' ' 23' ' ' LEU . 83.5 mt-10 -122.72 137.18 54.99 Favored 'General case' 0 N--CA 1.468 0.444 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 178.535 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -116.29 135.41 53.91 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.026 0.441 . . . . 0.0 111.894 -178.44 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.609 ' C ' HD12 ' A' ' 61' ' ' LEU . 39.2 mmt-85 -122.05 127.22 49.96 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 107.757 -1.201 . . . . 0.0 107.757 177.141 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.609 HD12 ' C ' ' A' ' 60' ' ' ARG . 9.0 mp -112.07 151.23 29.63 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.945 0.402 . . . . 0.0 111.21 -178.447 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 9.4 m-85 -131.32 108.45 9.66 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.447 179.471 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.543 ' C ' HD13 ' A' ' 63' ' ' LEU . 2.1 tm? -103.93 -84.58 0.47 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.65 -0.704 . . . . 0.0 109.232 179.521 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.434 ' H ' ' HB ' ' A' ' 67' ' ' VAL . . . -76.09 175.96 51.94 Favored Glycine 0 CA--C 1.521 0.438 0 N-CA-C 108.76 -1.736 . . . . 0.0 108.76 178.065 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 9.8 mt -72.5 -32.64 66.33 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 119.537 -0.865 . . . . 0.0 110.103 -179.557 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -102.84 9.53 38.88 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 122.912 0.485 . . . . 0.0 111.034 -179.842 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . 0.55 ' O ' HG12 ' A' ' 67' ' ' VAL . 9.1 t -106.71 96.61 4.76 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.343 0 CA-C-O 121.4 0.619 . . . . 0.0 111.738 -179.108 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 6.4 tp -112.24 117.35 32.29 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 108.032 -1.099 . . . . 0.0 108.032 178.168 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.405 HG23 ' HB2' ' A' ' 94' ' ' SER . 5.7 mt -112.55 143.43 22.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.86 0.362 . . . . 0.0 111.222 -178.648 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.412 HH11 ' HD2' ' A' ' 70' ' ' ARG . 11.1 mtm180 -128.05 130.65 48.6 Favored 'General case' 0 C--O 1.238 0.463 0 CA-C-O 121.224 0.535 . . . . 0.0 111.346 179.715 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 2.4 mtp -140.28 148.56 41.62 Favored 'General case' 0 C--N 1.334 -0.1 0 CA-C-N 115.535 -0.757 . . . . 0.0 109.881 179.666 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 27.8 tt0 -106.51 125.54 51.12 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 107.793 -1.188 . . . . 0.0 107.793 177.997 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.592 HD12 ' CB ' ' A' ' 85' ' ' PHE . 9.9 pt -133.09 160.26 42.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 N-CA-C 113.279 0.844 . . . . 0.0 113.279 -176.945 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 37.6 m -121.67 151.87 39.98 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 114.564 -1.198 . . . . 0.0 109.357 178.763 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.588 HD12 ' CE1' ' A' ' 85' ' ' PHE . 6.3 tp -67.09 123.02 19.08 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.297 0.57 . . . . 0.0 110.5 -179.679 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -97.81 -41.84 7.86 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 115.146 -0.934 . . . . 0.0 110.667 178.241 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' TRP . . . . . 0.587 ' NE1' ' HA3' ' A' ' 84' ' ' GLY . 67.5 p-90 -170.51 168.64 7.66 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.356 -179.349 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -147.46 123.87 10.98 Favored 'General case' 0 N--CA 1.465 0.299 0 N-CA-C 109.95 -0.389 . . . . 0.0 109.95 178.67 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 38.6 ttt180 -152.3 133.76 14.52 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 119.944 -0.703 . . . . 0.0 112.826 179.931 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . 0.452 ' O ' ' OD1' ' A' ' 80' ' ' ASP . 33.4 t0 56.98 47.22 18.04 Favored 'General case' 0 N--CA 1.463 0.181 0 N-CA-C 113.951 1.093 . . . . 0.0 113.951 176.585 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 82.29 -27.42 3.62 Favored Glycine 0 CA--C 1.524 0.597 0 C-N-CA 120.397 -0.906 . . . . 0.0 113.162 177.28 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 6.9 mt -89.5 156.73 18.45 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 117.672 0.736 . . . . 0.0 110.447 -179.084 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 36.2 mt -128.88 135.51 49.17 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.202 -179.282 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . 0.587 ' HA3' ' NE1' ' A' ' 77' ' ' TRP . . . -96.18 153.19 20.46 Favored Glycine 0 N--CA 1.45 -0.424 0 N-CA-C 109.576 -1.409 . . . . 0.0 109.576 178.692 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' PHE . . . . . 0.592 ' CB ' HD12 ' A' ' 73' ' ' ILE . 26.6 m-85 -145.62 132.36 20.0 Favored 'General case' 0 C--N 1.317 -0.808 0 C-N-CA 120.792 -0.363 . . . . 0.0 110.733 -179.298 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.489 ' CG ' HE21 ' A' ' 88' ' ' GLN . 6.5 pt-20 -103.66 126.21 50.66 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 108.632 -0.877 . . . . 0.0 108.632 179.059 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . 0.455 ' HA ' HG22 ' A' ' 73' ' ' ILE . 7.8 t -64.55 119.6 10.77 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 112.278 0.473 . . . . 0.0 112.278 -177.984 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . 0.489 HE21 ' CG ' ' A' ' 86' ' ' GLU . 46.8 mm-40 -89.32 -37.82 14.62 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.693 179.323 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . 0.412 ' ND1' ' N ' ' A' ' 90' ' ' ILE . 0.0 OUTLIER -164.66 144.85 7.55 Favored 'General case' 0 C--O 1.222 -0.375 0 CA-C-N 115.716 -0.674 . . . . 0.0 109.82 179.928 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.535 HG23 ' CG1' ' A' ' 95' ' ' ILE . 7.2 tt -143.81 140.45 25.47 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-O 121.407 0.623 . . . . 0.0 110.063 -179.814 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . 0.503 ' CB ' ' OG ' ' A' ' 94' ' ' SER . 0.2 OUTLIER -57.38 141.08 48.46 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 115.001 -1.0 . . . . 0.0 112.084 -178.001 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.48 ' HA ' HD12 ' A' ' 95' ' ' ILE . 3.2 tp -54.36 -42.06 69.85 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.254 -0.885 . . . . 0.0 110.403 -179.84 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -65.1 -42.94 93.55 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 179.295 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' SER . . . . . 0.503 ' OG ' ' CB ' ' A' ' 91' ' ' ASP . 1.1 p -66.86 -35.45 80.07 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.718 179.184 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . 0.535 ' CG1' HG23 ' A' ' 90' ' ' ILE . 31.3 mt -58.73 -38.33 71.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.248 179.769 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -69.79 -37.7 76.41 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 119.876 -0.73 . . . . 0.0 111.422 -177.945 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 60.3 m-70 . . . . . 0 C--N 1.326 -0.435 0 C-N-CA 119.567 -0.853 . . . . 0.0 109.578 179.767 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.652 ' H2 ' HE22 ' A' ' 4' ' ' GLN . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.613 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.549 ' H ' ' CD ' ' A' ' 4' ' ' GLN . 39.9 t -101.97 -119.45 0.18 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.385 -0.371 . . . . 0.0 110.363 179.964 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . 0.407 ' N ' ' OG ' ' A' ' 2' ' ' SER . 6.0 m-20 -92.85 26.95 2.54 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.916 179.828 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.679 ' O ' ' N ' ' A' ' 6' ' ' ASP . 0.0 OUTLIER -112.78 -18.02 12.4 Favored 'General case' 0 N--CA 1.463 0.188 0 C-N-CA 120.83 -0.348 . . . . 0.0 110.56 179.517 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . 0.645 ' N ' HE21 ' A' ' 4' ' ' GLN . 0.1 OUTLIER 31.43 27.77 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 120.99 0.424 . . . . 0.0 110.793 -179.719 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . 0.679 ' N ' ' O ' ' A' ' 4' ' ' GLN . 36.2 m-20 43.43 74.57 0.11 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.384 -179.93 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -82.1 128.12 33.81 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.731 -179.393 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.628 ' NH2' ' N11' ' A' ' 501' ' ' C2E . 0.0 OUTLIER -124.88 -6.22 7.36 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 116.037 -0.528 . . . . 0.0 112.119 -179.065 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.67 ' O ' ' N ' ' A' ' 11' ' ' PHE . 1.1 ptt85 -108.27 88.79 2.81 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 120.684 -0.406 . . . . 0.0 110.212 179.811 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.569 ' C ' ' O ' ' A' ' 9' ' ' ARG . 0.0 OUTLIER 8.79 -71.28 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 115.21 -0.904 . . . . 0.0 111.608 -179.714 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . 0.67 ' N ' ' O ' ' A' ' 9' ' ' ARG . 1.5 m-85 -124.85 158.37 33.61 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 121.155 0.502 . . . . 0.0 111.235 -179.782 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . 0.621 ' H ' ' CD2' ' A' ' 12' ' ' HIS . 6.7 m-70 -54.48 -172.38 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.242 179.828 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.549 ' NH1' ' C6 ' ' A' ' 501' ' ' C2E . 31.7 mtm180 -135.95 127.06 27.98 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.068 179.892 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.646 ' N ' HD12 ' A' ' 14' ' ' ILE . 1.8 mp -46.5 100.06 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.093 179.874 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -95.02 120.16 34.76 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.338 0.59 . . . . 0.0 111.262 -179.675 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 5.1 p90 -150.25 158.92 44.68 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 177.668 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . 0.437 ' OD1' ' N ' ' A' ' 17' ' ' ASP . 0.1 OUTLIER -95.49 146.03 24.74 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 120.304 -0.558 . . . . 0.0 110.858 -179.028 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -178.49 176.56 1.02 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.783 179.148 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -96.54 133.63 40.76 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.023 -179.454 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.538 ' O ' ' O ' ' A' ' 31' ' ' VAL . 4.9 p -132.51 149.9 52.25 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.316 0.579 . . . . 0.0 110.201 178.378 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 12.5 mm-40 -131.0 138.97 49.92 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.435 -0.802 . . . . 0.0 108.838 179.708 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 1.1 mm -120.27 136.39 57.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-O 121.282 0.563 . . . . 0.0 110.704 -179.374 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.712 ' H ' HD12 ' A' ' 23' ' ' LEU . 0.0 OUTLIER -126.12 123.4 38.23 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.393 -0.821 . . . . 0.0 111.014 -179.133 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.539 ' OE1' ' CE2' ' A' ' 57' ' ' PHE . 22.1 tt0 -129.35 102.18 6.31 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.094 -0.957 . . . . 0.0 109.676 178.826 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 80.3 -127.33 7.88 Favored Glycine 0 CA--C 1.524 0.606 0 N-CA-C 109.94 -1.264 . . . . 0.0 109.94 -178.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -100.22 11.32 39.66 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.833 0.349 . . . . 0.0 110.179 179.586 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.579 ' HB3' ' CZ2' ' A' ' 29' ' ' TRP . 35.4 mtt180 -113.14 133.82 54.85 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 112.423 0.527 . . . . 0.0 112.423 -178.34 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.439 ' HG2' ' N ' ' A' ' 29' ' ' TRP . 17.2 ttt180 -128.35 149.22 50.61 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.582 179.786 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.579 ' CZ2' ' HB3' ' A' ' 27' ' ' ARG . 6.8 m-90 -146.7 155.79 42.68 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.505 -179.286 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.539 ' OE1' ' N ' ' A' ' 30' ' ' GLU . 1.9 mp0 -100.56 135.44 42.0 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.774 179.459 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.538 ' O ' ' O ' ' A' ' 20' ' ' SER . 15.4 m -145.61 157.33 12.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-O 121.315 0.579 . . . . 0.0 111.026 -179.612 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 1.057 ' H ' HD23 ' A' ' 32' ' ' LEU . 1.5 pt? -96.86 130.57 44.12 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 178.759 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -91.97 125.0 36.5 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.278 0.561 . . . . 0.0 109.908 -179.512 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 69.6 m-70 -91.4 -28.54 17.61 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.307 -0.861 . . . . 0.0 111.662 -178.695 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 -172.66 161.07 4.76 Favored 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 119.484 -0.886 . . . . 0.0 111.08 177.577 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.531 HG22 ' H ' ' A' ' 37' ' ' SER . 4.6 p -145.56 169.08 7.3 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.243 -178.894 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.531 ' H ' HG22 ' A' ' 36' ' ' VAL . 32.1 t -142.18 169.59 17.31 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 107.894 -1.15 . . . . 0.0 107.894 178.348 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 2.6 mt -66.36 -0.82 2.88 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 119.793 -0.763 . . . . 0.0 110.856 -179.461 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . 0.546 ' CE1' ' O ' ' A' ' 87' ' ' CYS . 36.3 t60 -159.72 40.17 0.2 Allowed 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 120.664 -0.415 . . . . 0.0 111.472 -179.908 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . 0.483 ' HA3' ' N3 ' ' A' ' 501' ' ' C2E . . . -179.83 157.74 20.82 Favored Glycine 0 CA--C 1.525 0.681 0 N-CA-C 111.021 -0.832 . . . . 0.0 111.021 179.803 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -148.47 148.83 15.67 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.259 0 CA-C-O 121.382 0.61 . . . . 0.0 111.628 -178.804 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.491 HD23 ' N ' ' A' ' 43' ' ' VAL . 1.0 OUTLIER -121.95 137.4 54.81 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 115.016 -0.993 . . . . 0.0 108.759 178.664 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.491 ' N ' HD23 ' A' ' 42' ' ' LEU . 32.7 m -141.98 174.53 6.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-O 121.214 0.531 . . . . 0.0 111.534 -179.447 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -96.43 145.48 17.85 Favored Glycine 0 CA--C 1.528 0.882 0 N-CA-C 109.506 -1.438 . . . . 0.0 109.506 178.39 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . 0.463 ' O ' ' OE1' ' A' ' 45' ' ' GLN . 1.9 tm0? -86.86 115.19 61.62 Favored Pre-proline 0 N--CA 1.464 0.235 0 CA-C-N 117.88 0.84 . . . . 0.0 111.838 -178.492 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 97.4 Cg_endo -84.92 160.55 11.86 Favored 'Trans proline' 0 C--N 1.307 -1.613 0 C-N-CA 121.51 1.473 . . . . 0.0 111.22 178.715 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.638 ' H ' ' NE2' ' A' ' 47' ' ' GLN . 3.7 mp0 -65.33 -40.4 93.66 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 112.422 0.527 . . . . 0.0 112.422 -178.677 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.549 ' O ' ' N ' ' A' ' 50' ' ' ASN . 46.8 t0 -73.09 8.37 1.65 Allowed 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 111.89 0.33 . . . . 0.0 111.89 -178.592 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' TRP . . . . . 0.444 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 60.6 t-105 -59.3 69.62 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 111.828 0.307 . . . . 0.0 111.828 -179.579 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.549 ' N ' ' O ' ' A' ' 48' ' ' ASP . 0.5 OUTLIER -93.21 79.06 4.5 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 120.439 -0.505 . . . . 0.0 110.024 178.909 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -142.94 161.25 27.54 Favored Glycine 0 CA--C 1.526 0.765 0 N-CA-C 111.417 -0.673 . . . . 0.0 111.417 -179.44 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -95.44 109.94 48.08 Favored Pre-proline 0 CA--C 1.535 0.366 0 N-CA-C 110.512 -0.181 . . . . 0.0 110.512 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 78.7 Cg_exo -46.32 -22.98 1.8 Allowed 'Trans proline' 0 N--CA 1.498 1.769 0 C-N-CA 122.713 2.275 . . . . 0.0 112.813 -179.785 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 3.4 mm100 -79.86 -24.23 41.4 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 120.354 -0.539 . . . . 0.0 111.652 -178.718 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.578 ' O ' ' CE1' ' A' ' 57' ' ' PHE . 82.1 mtt180 -92.15 148.81 37.49 Favored Pre-proline 0 C--N 1.33 -0.246 0 C-N-CA 120.721 -0.391 . . . . 0.0 110.403 -179.978 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . 0.442 ' O ' ' OE1' ' A' ' 24' ' ' GLN . 29.8 Cg_endo -63.23 160.87 32.79 Favored 'Trans proline' 0 N--CA 1.497 1.724 0 C-N-CA 123.07 2.514 . . . . 0.0 113.436 -178.761 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.578 ' CE1' ' O ' ' A' ' 55' ' ' ARG . 49.0 m-85 -131.12 157.3 43.49 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 114.971 -1.013 . . . . 0.0 109.161 179.419 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.6 ' O ' HD12 ' A' ' 23' ' ' LEU . 64.8 mt-10 -122.21 138.46 54.47 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 178.245 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -118.98 137.08 53.76 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.316 0.487 . . . . 0.0 112.316 -178.116 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.622 ' HG3' HD11 ' A' ' 23' ' ' LEU . 9.4 mtm180 -123.11 127.73 49.13 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 108.379 -0.971 . . . . 0.0 108.379 177.237 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.556 HD23 ' C ' ' A' ' 60' ' ' ARG . 0.4 OUTLIER -109.88 144.16 38.75 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 120.638 -0.425 . . . . 0.0 110.736 -178.898 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' TYR . . . . . 0.431 ' CD1' ' N ' ' A' ' 62' ' ' TYR . 14.3 m-85 -125.47 109.47 12.75 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.694 179.862 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -106.17 -85.87 0.49 Allowed 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.39 -0.823 . . . . 0.0 109.488 179.579 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.413 ' H ' ' HB ' ' A' ' 67' ' ' VAL . . . -74.65 176.06 48.89 Favored Glycine 0 CA--C 1.521 0.428 0 N-CA-C 109.168 -1.573 . . . . 0.0 109.168 178.46 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.409 ' N ' HD23 ' A' ' 65' ' ' LEU . 2.0 mt -73.12 -33.18 65.39 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 119.667 -0.813 . . . . 0.0 110.011 -179.587 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 51.4 t0 -102.35 8.82 40.17 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.869 179.858 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.54 ' O ' HG12 ' A' ' 67' ' ' VAL . 13.2 t -106.05 96.68 4.81 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.283 0 CA-C-O 121.364 0.602 . . . . 0.0 111.833 -178.832 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 7.9 tp -113.04 117.4 31.92 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 107.977 -1.12 . . . . 0.0 107.977 178.089 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.485 HG23 ' CB ' ' A' ' 94' ' ' SER . 8.5 mt -111.64 142.54 23.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-O 120.909 0.385 . . . . 0.0 110.881 -178.541 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 26.3 ttp180 -128.49 130.64 47.8 Favored 'General case' 0 C--O 1.24 0.553 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.343 179.824 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . 0.783 ' SD ' HD12 ' A' ' 90' ' ' ILE . 1.4 mtm -139.42 147.63 41.69 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.739 -0.664 . . . . 0.0 109.575 179.238 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 22.0 tt0 -104.75 124.5 49.52 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 107.529 -1.286 . . . . 0.0 107.529 178.273 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.405 HG22 ' HA ' ' A' ' 87' ' ' CYS . 2.7 pt -134.34 160.75 41.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 C-N-CA 119.673 -0.811 . . . . 0.0 113.0 -177.162 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 35.5 m -121.13 152.2 39.0 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.057 -0.974 . . . . 0.0 109.46 178.804 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.59 HD12 ' CE1' ' A' ' 85' ' ' PHE . 10.2 tp -66.44 123.36 19.8 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.274 0.559 . . . . 0.0 109.97 -179.659 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -97.68 -41.7 7.98 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.854 178.373 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' TRP . . . . . 0.554 ' NE1' ' HA3' ' A' ' 84' ' ' GLY . 65.9 p-90 -171.22 165.04 7.3 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.556 -179.121 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -143.59 123.98 13.89 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 109.622 -0.511 . . . . 0.0 109.622 178.437 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 6.7 ttt180 -152.1 133.46 14.5 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 119.634 -0.826 . . . . 0.0 112.96 179.868 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 3.6 t70 57.01 47.03 18.32 Favored 'General case' 0 N--CA 1.462 0.139 0 N-CA-C 113.735 1.013 . . . . 0.0 113.735 176.804 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 82.56 -26.68 3.98 Favored Glycine 0 CA--C 1.523 0.532 0 C-N-CA 120.445 -0.883 . . . . 0.0 113.263 177.238 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.405 ' N ' HD23 ' A' ' 82' ' ' LEU . 5.0 mt -89.66 159.21 17.24 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 117.631 0.715 . . . . 0.0 110.362 -179.11 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 44.0 mt -132.0 135.73 46.75 Favored 'General case' 0 CA--C 1.516 -0.356 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.344 -179.16 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . 0.554 ' HA3' ' NE1' ' A' ' 77' ' ' TRP . . . -102.58 154.0 18.39 Favored Glycine 0 N--CA 1.452 -0.278 0 N-CA-C 109.758 -1.337 . . . . 0.0 109.758 178.714 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . 0.59 ' CE1' HD12 ' A' ' 75' ' ' LEU . 50.5 m-85 -145.36 136.55 24.89 Favored 'General case' 0 C--N 1.318 -0.763 0 C-N-CA 120.921 -0.312 . . . . 0.0 110.45 -179.66 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -104.01 128.96 51.6 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 179.53 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . 0.578 ' C ' HE21 ' A' ' 88' ' ' GLN . 42.9 t -69.38 120.45 15.2 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 112.378 0.51 . . . . 0.0 112.378 -178.237 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . 0.578 HE21 ' C ' ' A' ' 87' ' ' CYS . 5.0 mm-40 -94.58 -34.79 12.51 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.075 178.935 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . 0.449 ' ND1' ' C ' ' A' ' 89' ' ' HIS . 0.0 OUTLIER -161.41 141.89 10.9 Favored 'General case' 0 C--O 1.223 -0.338 0 CA-C-N 116.187 -0.46 . . . . 0.0 109.848 179.761 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.783 HD12 ' SD ' ' A' ' 71' ' ' MET . 6.0 tt -145.04 140.9 23.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-O 121.332 0.587 . . . . 0.0 110.465 -178.833 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -56.9 142.86 39.78 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 115.153 -0.931 . . . . 0.0 112.297 -178.455 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 5.0 tp -54.28 -42.04 69.57 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 114.892 -1.049 . . . . 0.0 110.319 -179.343 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 26.3 t0 -68.3 -42.65 79.15 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.04 179.603 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . 0.485 ' CB ' HG23 ' A' ' 69' ' ' ILE . 14.8 m -60.07 -38.39 82.7 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.062 179.5 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 50.8 mt -58.79 -38.46 72.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.317 179.913 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -70.97 -40.79 71.73 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.235 -0.586 . . . . 0.0 111.157 -179.204 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' HIS . . . . . 0.513 ' O ' HD23 ' A' ' 101' ' ' LEU . 60.0 m-70 -61.52 -34.86 76.26 Favored 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 119.177 -1.009 . . . . 0.0 108.704 179.87 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.598 HD13 ' O ' ' A' ' 98' ' ' LEU . 0.2 OUTLIER -67.2 -34.03 76.64 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 108.592 -0.892 . . . . 0.0 108.592 177.09 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.412 ' O ' ' OE2' ' A' ' 103' ' ' GLU . 3.4 mtt180 -66.02 -41.23 91.24 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 177.933 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . 0.483 ' NH2' ' ND1' ' A' ' 97' ' ' HIS . 26.3 mtm180 -59.77 -42.98 94.51 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.632 178.585 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.513 HD23 ' O ' ' A' ' 97' ' ' HIS . 3.9 mm? -64.53 -39.5 93.88 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.022 -0.535 . . . . 0.0 109.971 -179.476 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . 0.442 HG23 ' O ' ' A' ' 98' ' ' LEU . 77.4 t -68.61 -43.56 83.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.99 179.759 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . 0.563 ' OE1' ' N ' ' A' ' 103' ' ' GLU . 0.2 OUTLIER -62.76 -47.66 82.57 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.528 -179.179 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 14.4 mt -66.31 -38.56 88.01 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.814 -0.354 . . . . 0.0 110.702 -179.452 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 15.3 m120 -70.45 -26.26 63.56 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.611 179.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 3.7 tt -63.83 -43.72 95.36 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.206 -0.452 . . . . 0.0 109.983 179.759 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 94.97 -107.11 3.5 Favored Glycine 0 CA--C 1.523 0.578 0 N-CA-C 110.592 -1.003 . . . . 0.0 110.592 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -163.91 -177.17 4.94 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.704 0.288 . . . . 0.0 110.314 179.817 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -45.34 143.31 1.8 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.446 179.918 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 4.5 pt-20 -145.28 -168.67 3.01 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.556 -179.857 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . 0.538 ' C ' ' H ' ' A' ' 113' ' ' GLU . 1.1 mp -114.09 -130.79 0.31 Allowed 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.82 -179.621 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.647 ' O ' ' N ' ' A' ' 114' ' ' ARG . 7.9 mt 59.17 -1.07 0.13 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.743 -179.833 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . 0.557 ' O ' ' N ' ' A' ' 116' ' ' LEU . 4.5 mm-40 36.06 -83.22 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.353 179.798 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . 0.701 ' CD ' ' H ' ' A' ' 114' ' ' ARG . 8.5 mpt_? -24.0 -68.43 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.457 -179.533 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 43.2 mm-40 -39.65 -43.88 1.42 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.947 -179.646 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.557 ' N ' ' O ' ' A' ' 113' ' ' GLU . 6.0 tp -67.21 -42.44 84.12 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.838 -179.945 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' ALA . . . . . 0.678 ' O ' HG23 ' A' ' 120' ' ' VAL . . . -68.97 -23.06 64.08 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.234 179.67 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 58.0 mt -53.71 -30.35 43.37 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 120.808 -0.357 . . . . 0.0 110.462 -178.841 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 21.5 mt -57.63 -24.91 59.04 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 178.989 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . 0.678 HG23 ' O ' ' A' ' 117' ' ' ALA . 63.7 t -58.39 -43.72 87.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 115.397 -0.819 . . . . 0.0 111.571 -179.782 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 54.3 p -65.61 -11.32 43.38 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 112.273 0.471 . . . . 0.0 112.273 -178.023 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -111.02 -86.9 0.54 Allowed 'General case' 0 N--CA 1.464 0.246 0 C-N-CA 120.314 -0.554 . . . . 0.0 111.72 -179.471 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . 0.729 ' CG ' ' H ' ' A' ' 124' ' ' ASP . 5.0 t-80 -127.58 -154.55 0.64 Allowed 'General case' 0 N--CA 1.464 0.249 0 CA-C-O 121.213 0.53 . . . . 0.0 112.297 -178.526 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . 0.729 ' H ' ' CG ' ' A' ' 123' ' ' HIS . 99.4 m-20 27.9 51.66 0.05 OUTLIER 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 114.965 -1.016 . . . . 0.0 111.027 -179.319 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' ASP . . . . . 0.473 ' OXT' HG13 ' A' ' 120' ' ' VAL . 1.8 m-20 . . . . . 0 C--O 1.22 -0.468 0 CA-C-O 118.057 -0.973 . . . . 0.0 110.742 179.312 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 501' ' ' C2E . . . . . 0.944 ' O21' " H4'" ' A' ' 501' ' ' C2E . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 502' ' ' C2E . . . . . 0.556 ' N21' ' ND1' ' A' ' 12' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.44 ' N ' ' SD ' ' A' ' 1' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.555 0 N-CA-C 109.341 -0.614 . . . . 0.0 109.341 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.448 ' O ' ' NE2' ' A' ' 4' ' ' GLN . 3.5 m -166.76 43.59 0.06 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.719 -179.89 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -99.45 107.64 19.9 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 178.353 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.787 ' O ' ' CG ' ' A' ' 5' ' ' HIS . 1.1 mp0 -113.92 -20.35 11.1 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.148 -0.933 . . . . 0.0 109.724 178.308 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . 0.787 ' CG ' ' O ' ' A' ' 4' ' ' GLN . 1.6 p-80 117.28 7.33 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.516 0 O-C-N 124.41 1.069 . . . . 0.0 109.438 -179.628 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . 0.443 ' O ' ' O ' ' A' ' 5' ' ' HIS . 78.9 m-20 -37.96 158.29 0.01 OUTLIER 'General case' 0 C--O 1.231 0.107 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.42 -179.586 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.635 ' CD ' ' H ' ' A' ' 7' ' ' GLU . 0.7 OUTLIER -95.04 134.7 37.44 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.162 0.506 . . . . 0.0 111.701 -178.945 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.619 ' NH2' ' N11' ' A' ' 501' ' ' C2E . 0.0 OUTLIER -120.68 -7.7 9.57 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.558 179.763 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.706 ' O ' ' N ' ' A' ' 11' ' ' PHE . 2.6 ptt180 -108.64 93.61 4.61 Favored 'General case' 0 N--CA 1.464 0.266 0 N-CA-C 109.667 -0.494 . . . . 0.0 109.667 179.613 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.611 HH21 ' P11' ' A' ' 501' ' ' C2E . 0.3 OUTLIER 17.76 -73.75 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 115.208 -0.906 . . . . 0.0 111.758 -179.276 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . 0.706 ' N ' ' O ' ' A' ' 9' ' ' ARG . 10.1 m-85 -150.61 168.65 23.66 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-O 120.815 0.34 . . . . 0.0 110.587 179.581 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . 0.5 ' H ' ' CD2' ' A' ' 12' ' ' HIS . 4.1 p80 -44.51 130.85 6.71 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.043 -179.841 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.58 ' NH1' ' C6 ' ' A' ' 501' ' ' C2E . 0.1 OUTLIER -89.02 149.22 23.35 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.212 179.583 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 12.2 mm -48.8 86.04 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.085 179.507 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.562 ' N ' ' O ' ' A' ' 13' ' ' ARG . . . -93.67 120.55 34.08 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.506 0.669 . . . . 0.0 111.714 -179.221 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 2.9 p90 -149.37 156.9 42.78 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 114.803 -1.09 . . . . 0.0 108.2 178.298 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -95.51 146.18 24.63 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 120.009 -0.676 . . . . 0.0 110.82 -179.106 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . 179.57 176.75 0.63 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.065 179.865 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -96.47 134.23 39.92 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.731 -179.659 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.508 ' O ' ' O ' ' A' ' 31' ' ' VAL . 6.5 p -134.06 151.89 51.6 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.16 0.505 . . . . 0.0 110.451 178.914 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 22.8 mm-40 -129.27 144.43 51.22 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.679 -0.691 . . . . 0.0 109.169 179.654 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 75.4 mt -126.9 136.46 60.73 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.326 0 C-N-CA 120.352 -0.539 . . . . 0.0 110.869 -179.782 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -125.46 123.27 38.85 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.538 -0.756 . . . . 0.0 111.256 -178.893 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.548 ' OE1' ' CE2' ' A' ' 57' ' ' PHE . 23.8 tt0 -129.58 102.33 6.32 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.453 -0.794 . . . . 0.0 109.717 178.715 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 80.41 -126.23 7.31 Favored Glycine 0 CA--C 1.523 0.564 0 N-CA-C 109.789 -1.324 . . . . 0.0 109.789 -178.96 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -101.42 11.77 38.54 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.816 0.341 . . . . 0.0 110.277 179.58 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.559 ' HB3' ' CZ2' ' A' ' 29' ' ' TRP . 48.0 mtt180 -114.29 134.18 55.13 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 112.664 0.616 . . . . 0.0 112.664 -178.189 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 56.5 ttt180 -127.88 149.48 50.28 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.421 179.288 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.559 ' CZ2' ' HB3' ' A' ' 27' ' ' ARG . 7.2 m-90 -146.31 156.04 43.07 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.477 -179.568 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -100.7 135.23 42.47 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.585 179.22 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.508 ' O ' ' O ' ' A' ' 20' ' ' SER . 28.9 m -145.73 156.3 12.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 C-N-CA 120.652 -0.419 . . . . 0.0 110.83 -179.663 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.519 ' H ' HD23 ' A' ' 32' ' ' LEU . 0.3 OUTLIER -95.12 130.32 41.87 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 108.518 -0.919 . . . . 0.0 108.518 178.429 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.5 tt -90.1 126.01 35.63 Favored 'General case' 0 C--N 1.325 -0.492 0 C-N-CA 120.203 -0.599 . . . . 0.0 110.179 -179.478 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' HIS . . . . . 0.408 ' NE2' HD12 ' A' ' 32' ' ' LEU . 79.3 m-70 -90.29 -30.98 17.15 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.055 -0.975 . . . . 0.0 111.704 -178.811 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -173.67 162.31 4.08 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 119.632 -0.827 . . . . 0.0 111.434 178.303 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.536 HG22 ' H ' ' A' ' 37' ' ' SER . 4.1 p -144.75 168.77 9.21 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.112 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.117 -179.549 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.536 ' H ' HG22 ' A' ' 36' ' ' VAL . 18.8 t -142.33 167.27 22.49 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 107.402 -1.333 . . . . 0.0 107.402 178.262 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.527 ' H ' HD12 ' A' ' 38' ' ' LEU . 1.7 mp -62.42 1.4 0.35 Allowed 'General case' 0 C--N 1.322 -0.588 0 C-N-CA 119.412 -0.915 . . . . 0.0 110.635 -179.483 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . 0.489 ' CD2' ' N ' ' A' ' 39' ' ' HIS . 0.3 OUTLIER -168.34 44.89 0.04 OUTLIER 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 120.655 -0.418 . . . . 0.0 111.338 179.868 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -177.71 150.44 9.99 Favored Glycine 0 CA--C 1.527 0.782 0 N-CA-C 110.573 -1.011 . . . . 0.0 110.573 179.768 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.588 HG21 HG21 ' A' ' 73' ' ' ILE . 0.1 OUTLIER -147.02 148.65 16.45 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.222 0 CA-C-O 121.317 0.579 . . . . 0.0 111.656 -179.082 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.529 HD23 ' N ' ' A' ' 43' ' ' VAL . 1.1 tt -121.87 139.69 53.32 Favored 'General case' 0 N--CA 1.464 0.262 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 178.596 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.529 ' N ' HD23 ' A' ' 42' ' ' LEU . 18.8 m -143.72 175.15 3.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 C-N-CA 120.129 -0.628 . . . . 0.0 112.058 -178.8 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -98.13 143.98 16.99 Favored Glycine 0 CA--C 1.528 0.853 0 N-CA-C 109.224 -1.55 . . . . 0.0 109.224 177.845 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . 0.499 ' CD ' ' O ' ' A' ' 45' ' ' GLN . 0.0 OUTLIER -86.25 120.16 72.11 Favored Pre-proline 0 CA--C 1.532 0.262 0 CA-C-N 118.075 0.938 . . . . 0.0 112.046 -178.224 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_endo -86.24 159.64 9.83 Favored 'Trans proline' 0 C--N 1.308 -1.564 0 C-N-CA 121.797 1.665 . . . . 0.0 110.906 178.278 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 65.7 mt-30 -65.38 -40.23 93.25 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.315 0.487 . . . . 0.0 112.315 -178.936 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.554 ' O ' ' NE1' ' A' ' 29' ' ' TRP . 29.5 m-20 -73.59 8.4 1.87 Allowed 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 111.975 0.361 . . . . 0.0 111.975 -178.71 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' TRP . . . . . 0.445 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 58.9 t-105 -59.51 69.57 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 111.914 0.338 . . . . 0.0 111.914 -179.308 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.551 ' N ' ' O ' ' A' ' 48' ' ' ASP . 0.2 OUTLIER -93.39 78.92 4.41 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 120.159 -0.616 . . . . 0.0 109.953 178.729 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -142.88 159.93 27.42 Favored Glycine 0 CA--C 1.524 0.632 0 N-CA-C 111.548 -0.621 . . . . 0.0 111.548 -179.647 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -94.2 111.25 52.65 Favored Pre-proline 0 CA--C 1.536 0.422 0 CA-C-N 115.543 -0.329 . . . . 0.0 110.744 -179.817 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_exo -47.99 -23.31 4.21 Favored 'Trans proline' 0 N--CA 1.497 1.721 0 C-N-CA 122.473 2.116 . . . . 0.0 112.366 179.762 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 1.7 mm100 -78.25 -24.01 47.07 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.782 -178.96 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.558 ' O ' ' CE1' ' A' ' 57' ' ' PHE . 44.3 mtp85 -94.54 148.9 35.72 Favored Pre-proline 0 C--N 1.331 -0.232 0 C-N-CA 120.598 -0.441 . . . . 0.0 110.138 179.94 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . 0.423 ' O ' ' OE1' ' A' ' 24' ' ' GLN . 31.1 Cg_endo -63.43 160.82 33.74 Favored 'Trans proline' 0 N--CA 1.494 1.527 0 C-N-CA 122.93 2.42 . . . . 0.0 113.337 -178.598 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.558 ' CE1' ' O ' ' A' ' 55' ' ' ARG . 34.2 m-85 -130.5 158.42 39.99 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 114.8 -1.091 . . . . 0.0 108.922 179.346 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 69.3 mt-10 -121.39 135.34 55.08 Favored 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 108.644 -0.873 . . . . 0.0 108.644 178.175 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . 0.563 ' HB2' ' CD1' ' A' ' 73' ' ' ILE . . . -118.02 138.15 52.41 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.281 0.562 . . . . 0.0 111.645 -177.958 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 47.6 mtm180 -124.71 128.11 48.29 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 178.024 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 10.2 mt -107.16 143.0 35.97 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 120.431 -0.508 . . . . 0.0 111.098 -178.522 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' TYR . . . . . 0.473 ' CD1' ' N ' ' A' ' 62' ' ' TYR . 7.7 m-85 -125.93 107.78 10.79 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.242 179.471 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.486 ' C ' HD23 ' A' ' 63' ' ' LEU . 1.9 tt -104.53 -85.37 0.47 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.441 -0.799 . . . . 0.0 109.436 179.688 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.447 ' H ' ' HB ' ' A' ' 67' ' ' VAL . . . -74.23 178.09 44.79 Favored Glycine 0 CA--C 1.522 0.482 0 N-CA-C 109.139 -1.584 . . . . 0.0 109.139 178.403 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.66 ' N ' HD12 ' A' ' 65' ' ' LEU . 7.9 mp -74.63 -31.44 61.98 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 119.846 -0.742 . . . . 0.0 110.151 -179.777 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -103.84 9.5 36.86 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 123.054 0.542 . . . . 0.0 110.798 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.521 ' O ' HG12 ' A' ' 67' ' ' VAL . 20.7 t -105.71 96.06 4.3 Favored 'Isoleucine or valine' 0 C--O 1.234 0.277 0 CA-C-O 121.206 0.527 . . . . 0.0 111.855 -178.929 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 3.8 tp -113.14 117.3 31.55 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 108.128 -1.064 . . . . 0.0 108.128 178.405 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.471 HG23 ' CB ' ' A' ' 94' ' ' SER . 17.7 mm -112.5 143.82 21.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 120.926 0.393 . . . . 0.0 111.049 -178.677 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.473 ' C ' ' HG2' ' A' ' 71' ' ' MET . 59.2 mtp180 -127.64 130.31 48.74 Favored 'General case' 0 C--O 1.239 0.516 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.374 179.3 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . 0.739 ' SD ' HD12 ' A' ' 90' ' ' ILE . 0.1 OUTLIER -142.4 147.69 36.61 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.223 -0.898 . . . . 0.0 109.476 -179.576 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -102.05 128.89 48.31 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 108.017 -1.105 . . . . 0.0 108.017 178.587 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.588 HG21 HG21 ' A' ' 41' ' ' ILE . 25.9 pt -136.77 157.62 36.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 C-N-CA 119.836 -0.746 . . . . 0.0 112.836 -177.611 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 2.0 p -122.63 155.41 36.42 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 115.068 -0.969 . . . . 0.0 109.414 178.393 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.524 ' CD1' ' CZ ' ' A' ' 85' ' ' PHE . 7.1 tp -70.43 126.13 28.76 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.591 0.71 . . . . 0.0 110.782 -179.752 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -98.36 -43.66 6.84 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 114.515 -1.22 . . . . 0.0 111.138 178.103 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' TRP . . . . . 0.674 ' NE1' ' HA3' ' A' ' 84' ' ' GLY . 69.3 p-90 -167.71 172.4 9.28 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.425 -178.884 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -151.36 123.69 8.32 Favored 'General case' 0 N--CA 1.467 0.39 0 N-CA-C 110.032 -0.358 . . . . 0.0 110.032 178.373 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 61.4 ttt180 -152.58 133.54 14.11 Favored 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 112.91 0.708 . . . . 0.0 112.91 179.842 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 25.7 t0 56.71 47.22 18.66 Favored 'General case' 0 N--CA 1.464 0.229 0 N-CA-C 114.055 1.132 . . . . 0.0 114.055 176.154 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 83.98 -27.51 4.41 Favored Glycine 0 CA--C 1.522 0.529 0 C-N-CA 120.385 -0.912 . . . . 0.0 113.242 177.128 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 4.4 mt -89.52 161.26 16.31 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 117.664 0.732 . . . . 0.0 110.41 -178.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.406 HD11 ' CB ' ' A' ' 45' ' ' GLN . 42.3 mt -133.93 135.36 43.52 Favored 'General case' 0 CA--C 1.518 -0.272 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.242 -179.236 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . 0.674 ' HA3' ' NE1' ' A' ' 77' ' ' TRP . . . -94.84 152.36 20.47 Favored Glycine 0 N--CA 1.451 -0.331 0 N-CA-C 109.962 -1.255 . . . . 0.0 109.962 178.999 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . 0.524 ' CZ ' ' CD1' ' A' ' 75' ' ' LEU . 29.0 m-85 -145.47 133.77 21.75 Favored 'General case' 0 C--N 1.319 -0.754 0 C-N-CA 120.985 -0.286 . . . . 0.0 110.492 -179.602 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -103.8 127.93 51.25 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 108.555 -0.905 . . . . 0.0 108.555 179.242 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . 0.565 ' HA ' HG22 ' A' ' 73' ' ' ILE . 2.3 t -67.69 119.89 13.16 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.925 0.393 . . . . 0.0 111.704 -178.595 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -89.33 -36.35 15.59 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.973 179.782 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . 0.485 ' ND1' ' C ' ' A' ' 89' ' ' HIS . 0.0 OUTLIER -166.43 147.8 6.45 Favored 'General case' 0 C--O 1.224 -0.237 0 CA-C-N 116.028 -0.533 . . . . 0.0 109.921 179.371 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.739 HD12 ' SD ' ' A' ' 71' ' ' MET . 10.4 tt -145.27 141.1 22.7 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-O 121.418 0.628 . . . . 0.0 110.568 -178.984 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . 0.504 ' CB ' ' OG ' ' A' ' 94' ' ' SER . 0.0 OUTLIER -55.6 141.56 37.04 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 115.045 -0.98 . . . . 0.0 112.27 -178.077 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 5.2 tp -54.72 -42.33 71.42 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.192 -0.913 . . . . 0.0 110.294 -179.937 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -68.62 -42.9 77.43 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.264 -0.425 . . . . 0.0 109.93 179.625 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . 0.504 ' OG ' ' CB ' ' A' ' 91' ' ' ASP . 1.5 p -60.24 -36.32 77.47 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.022 -0.536 . . . . 0.0 109.918 179.303 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . 0.412 ' CG1' HG23 ' A' ' 90' ' ' ILE . 38.2 mt -60.35 -38.77 78.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.16 179.894 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -70.44 -37.53 74.39 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 120.342 -0.543 . . . . 0.0 110.852 -178.856 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' HIS . . . . . 0.518 ' O ' ' HB2' ' A' ' 100' ' ' ARG . 67.2 m-70 -66.92 -45.53 77.6 Favored 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 119.666 -0.814 . . . . 0.0 109.385 179.668 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 2.4 tt -61.0 -33.71 73.68 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 177.906 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 9.6 mtt-85 -56.81 -37.06 70.67 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 178.309 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . 0.518 ' HB2' ' O ' ' A' ' 97' ' ' HIS . 2.3 mmp_? -56.01 -43.58 77.84 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.178 0.513 . . . . 0.0 109.849 178.517 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.6 HD22 ' N ' ' A' ' 101' ' ' LEU . 3.9 mm? -64.21 -39.29 93.66 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.451 -0.795 . . . . 0.0 111.022 -179.503 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . 0.58 ' O ' ' ND2' ' A' ' 105' ' ' ASN . 0.4 OUTLIER -68.3 -46.47 80.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 C-N-CA 120.504 -0.478 . . . . 0.0 110.64 -179.665 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . 0.465 ' N ' ' CG1' ' A' ' 102' ' ' VAL . 44.1 mt-10 -66.17 -43.66 86.3 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.723 -179.635 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 10.4 mt -68.31 -40.66 81.63 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 111.991 0.367 . . . . 0.0 111.991 -178.473 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . 0.58 ' ND2' ' O ' ' A' ' 102' ' ' VAL . 0.0 OUTLIER -73.94 -26.6 60.58 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.449 -0.5 . . . . 0.0 110.745 -179.542 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 2.1 mt -67.37 -42.61 83.13 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.136 179.783 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 150.88 -83.1 0.17 Allowed Glycine 0 CA--C 1.525 0.708 0 N-CA-C 110.847 -0.901 . . . . 0.0 110.847 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -170.46 123.42 0.67 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.746 0.308 . . . . 0.0 110.508 179.922 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . 0.555 ' O ' ' N ' ' A' ' 111' ' ' LEU . 8.0 tp10 66.33 5.72 3.86 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.019 -179.699 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 25.2 tt0 57.49 -74.28 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.789 -0.641 . . . . 0.0 111.085 179.804 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . 0.555 ' N ' ' O ' ' A' ' 109' ' ' GLU . 1.8 tp 66.07 114.15 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 -179.377 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.456 ' N ' HD12 ' A' ' 112' ' ' LEU . 9.1 mp 60.04 129.12 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.207 -179.477 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 18.9 mt-10 -43.21 -51.64 6.0 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.808 -179.886 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . 0.46 ' HG2' ' H ' ' A' ' 115' ' ' GLU . 11.5 ttm-85 63.45 172.35 0.16 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.226 -179.767 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . 0.561 ' O ' ' CE2' ' A' ' 11' ' ' PHE . 11.3 mt-10 56.5 -92.01 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.728 180.0 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 6.9 mt -54.48 -35.48 63.13 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.561 -179.752 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -68.54 -35.58 77.64 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 119.852 -0.739 . . . . 0.0 109.843 179.823 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.435 ' O ' ' O ' ' A' ' 122' ' ' ALA . 19.5 mt -54.14 -49.43 69.23 Favored 'General case' 0 N--CA 1.463 0.175 0 CA-C-N 115.48 -0.782 . . . . 0.0 111.095 -176.802 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . 0.418 ' HA ' ' O ' ' A' ' 122' ' ' ALA . 4.8 mt -65.99 -47.97 72.76 Favored 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 120.31 -0.556 . . . . 0.0 110.319 179.865 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 70.9 t -56.99 -47.46 83.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.667 -176.787 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 73.7 m -70.48 -41.11 73.15 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 119.536 -0.866 . . . . 0.0 110.33 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . 0.455 ' O ' ' OD2' ' A' ' 124' ' ' ASP . . . -148.77 159.36 44.22 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.834 -0.621 . . . . 0.0 109.855 179.796 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . 0.813 ' CG ' ' H ' ' A' ' 124' ' ' ASP . 1.9 p80 -63.32 -69.74 0.25 Allowed 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 119.666 -0.814 . . . . 0.0 109.399 178.192 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . 0.813 ' H ' ' CG ' ' A' ' 123' ' ' HIS . 2.3 m-20 66.65 57.12 0.69 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.229 179.225 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 1.2 p30 . . . . . 0 C--O 1.221 -0.447 0 CA-C-O 117.975 -1.012 . . . . 0.0 110.573 179.639 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 501' ' ' C2E . . . . . 0.619 ' N11' ' NH2' ' A' ' 8' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 502' ' ' C2E . . . . . 0.527 ' C4 ' ' CE2' ' A' ' 77' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.649 ' O ' ' CB ' ' A' ' 2' ' ' SER . 39.7 mtt . . . . . 0 N--CA 1.489 1.513 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.649 ' CB ' ' O ' ' A' ' 1' ' ' MET . 52.8 m 129.21 153.53 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.598 0 O-C-N 123.891 0.744 . . . . 0.0 110.21 179.772 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 8.8 p30 -86.14 28.34 0.83 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.013 0.435 . . . . 0.0 109.991 179.417 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.561 ' O ' ' NE2' ' A' ' 4' ' ' GLN . 0.0 OUTLIER -112.4 2.24 16.34 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.19 179.534 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . 0.522 ' CD2' ' C ' ' A' ' 4' ' ' GLN . 0.6 OUTLIER 50.47 103.66 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.075 179.897 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -40.9 144.5 0.27 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.486 -179.436 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 14.1 pm0 -75.91 135.49 40.1 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.408 0.623 . . . . 0.0 111.136 -179.565 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.861 ' H ' ' C61' ' A' ' 502' ' ' C2E . 0.0 OUTLIER -118.42 -12.71 9.82 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.306 179.404 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.638 ' O ' ' N ' ' A' ' 11' ' ' PHE . 9.3 mtm180 -96.91 76.83 2.75 Favored 'General case' 0 CA--C 1.514 -0.418 0 N-CA-C 109.927 -0.397 . . . . 0.0 109.927 179.914 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.758 ' H ' ' CZ ' ' A' ' 10' ' ' ARG . 0.0 OUTLIER 29.17 -84.56 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.58 -0.737 . . . . 0.0 110.77 179.816 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . 0.638 ' N ' ' O ' ' A' ' 9' ' ' ARG . 0.1 OUTLIER -132.7 147.19 52.32 Favored 'General case' 0 CA--C 1.53 0.182 0 N-CA-C 109.878 -0.415 . . . . 0.0 109.878 179.19 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . 0.413 ' C ' ' O ' ' A' ' 11' ' ' PHE . 17.4 p80 -36.25 155.28 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.288 -179.467 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.558 ' CZ ' ' NH1' ' A' ' 9' ' ' ARG . 3.9 mtm180 -111.3 -176.15 2.88 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.394 179.935 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.56 HG13 HG22 ' A' ' 102' ' ' VAL . 41.1 mm -90.66 94.4 4.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.386 179.52 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -91.82 120.22 32.33 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.416 0.627 . . . . 0.0 110.99 179.907 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 3.1 p90 -149.8 158.65 44.37 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.034 -0.984 . . . . 0.0 108.423 178.18 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 3.1 p30 -95.34 144.67 25.7 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 120.184 -0.606 . . . . 0.0 110.051 -179.62 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -177.49 175.7 1.39 Allowed 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 179.697 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -96.37 134.24 39.77 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.704 -179.716 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.542 ' O ' ' O ' ' A' ' 31' ' ' VAL . 10.7 p -134.04 152.7 51.95 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.109 0.481 . . . . 0.0 110.293 178.851 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 12.0 mm-40 -129.5 141.53 50.98 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 179.625 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -122.21 135.72 61.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 C-N-CA 120.096 -0.642 . . . . 0.0 110.371 179.771 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.432 ' H ' HD12 ' A' ' 23' ' ' LEU . 0.1 OUTLIER -126.12 123.15 37.66 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.32 -0.854 . . . . 0.0 110.934 -179.133 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.582 ' OE1' ' CE2' ' A' ' 57' ' ' PHE . 22.2 tt0 -128.79 101.82 6.28 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.245 -0.889 . . . . 0.0 109.678 178.849 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 80.11 -126.77 7.59 Favored Glycine 0 CA--C 1.523 0.55 0 N-CA-C 110.138 -1.185 . . . . 0.0 110.138 -178.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -99.65 11.31 39.53 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.844 0.354 . . . . 0.0 110.325 179.57 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.551 ' HB3' ' CZ2' ' A' ' 29' ' ' TRP . 67.7 mtt180 -113.24 134.97 54.32 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 112.422 0.527 . . . . 0.0 112.422 -178.369 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 28.0 ttt180 -129.29 150.62 50.58 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.51 179.65 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.551 ' CZ2' ' HB3' ' A' ' 27' ' ' ARG . 7.0 m-90 -149.0 156.5 42.35 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.675 -178.919 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 14.7 mt-10 -100.28 134.59 42.99 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.003 179.292 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.542 ' O ' ' O ' ' A' ' 20' ' ' SER . 16.8 m -145.9 158.03 12.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 121.104 0.478 . . . . 0.0 111.306 -179.628 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.957 ' H ' HD23 ' A' ' 32' ' ' LEU . 1.4 pt? -97.0 130.21 44.36 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 178.505 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.4 tt -93.29 126.63 38.5 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.27 0.557 . . . . 0.0 109.731 -179.946 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 45.8 m-70 -92.31 -26.09 18.27 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.397 -0.819 . . . . 0.0 111.923 -178.36 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.405 ' OD1' ' CZ ' ' A' ' 13' ' ' ARG . 2.3 p30 -174.24 159.45 3.15 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 119.528 -0.869 . . . . 0.0 111.12 177.652 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.531 HG22 ' N ' ' A' ' 37' ' ' SER . 6.7 p -142.82 168.89 13.14 Favored 'Isoleucine or valine' 0 C--O 1.231 0.099 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.84 -179.178 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.531 ' N ' HG22 ' A' ' 36' ' ' VAL . 22.9 t -142.36 169.15 18.12 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 107.889 -1.152 . . . . 0.0 107.889 178.926 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 91.4 mt -66.23 -1.25 3.12 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 119.642 -0.823 . . . . 0.0 110.941 -179.438 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . 0.513 ' NE2' ' O ' ' A' ' 87' ' ' CYS . 3.7 t60 -161.32 38.98 0.14 Allowed 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 120.839 -0.344 . . . . 0.0 111.179 -179.847 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . 0.491 ' HA3' ' N3 ' ' A' ' 501' ' ' C2E . . . -175.77 154.67 17.98 Favored Glycine 0 CA--C 1.527 0.825 0 N-CA-C 110.929 -0.868 . . . . 0.0 110.929 179.88 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -148.04 148.87 15.82 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.345 0 CA-C-O 121.389 0.614 . . . . 0.0 111.809 -178.87 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.694 HD23 ' N ' ' A' ' 43' ' ' VAL . 1.8 tt -122.22 140.85 52.11 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 115.088 -0.96 . . . . 0.0 109.1 178.836 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.694 ' N ' HD23 ' A' ' 42' ' ' LEU . 20.8 m -145.42 174.84 2.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-O 121.12 0.486 . . . . 0.0 111.633 -179.568 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -97.9 145.77 17.93 Favored Glycine 0 CA--C 1.529 0.913 0 N-CA-C 109.961 -1.256 . . . . 0.0 109.961 178.86 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 1.6 tm0? -87.64 113.76 55.85 Favored Pre-proline 0 N--CA 1.463 0.184 0 CA-C-N 117.923 0.862 . . . . 0.0 111.841 -178.574 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 77.2 Cg_endo -85.26 163.37 11.32 Favored 'Trans proline' 0 C--N 1.305 -1.752 0 C-N-CA 121.625 1.55 . . . . 0.0 111.289 178.899 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -65.39 -40.52 93.56 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 116.519 -0.309 . . . . 0.0 111.815 -179.054 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.53 ' O ' ' N ' ' A' ' 50' ' ' ASN . 86.0 m-20 -71.28 8.63 0.96 Allowed 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 111.926 0.343 . . . . 0.0 111.926 -178.819 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' TRP . . . . . 0.46 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 61.8 t-105 -61.56 67.4 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 111.856 0.317 . . . . 0.0 111.856 -179.576 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.533 ' ND2' ' C ' ' A' ' 50' ' ' ASN . 0.7 OUTLIER -93.1 78.71 4.57 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 178.569 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -142.7 159.34 27.28 Favored Glycine 0 CA--C 1.523 0.583 0 N-CA-C 111.239 -0.745 . . . . 0.0 111.239 -179.581 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 14.3 t0 -92.91 121.57 65.58 Favored Pre-proline 0 CA--C 1.534 0.362 0 N-CA-C 110.321 -0.251 . . . . 0.0 110.321 179.886 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -61.29 -22.38 74.44 Favored 'Trans proline' 0 N--CA 1.495 1.587 0 C-N-CA 122.477 2.118 . . . . 0.0 112.075 -179.513 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 18.7 mt-30 -77.45 -20.08 55.04 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.12 -179.492 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.471 ' O ' ' CE1' ' A' ' 57' ' ' PHE . 1.3 mtt85 -97.85 157.32 34.82 Favored Pre-proline 0 CA--C 1.531 0.215 0 CA-C-O 120.745 0.307 . . . . 0.0 110.23 179.926 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . 0.443 ' O ' ' OE1' ' A' ' 24' ' ' GLN . 55.7 Cg_endo -70.22 161.0 47.62 Favored 'Trans proline' 0 N--CA 1.495 1.606 0 C-N-CA 122.913 2.409 . . . . 0.0 113.298 -178.766 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.582 ' CE2' ' OE1' ' A' ' 24' ' ' GLN . 53.3 m-85 -131.16 155.63 46.7 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.053 -0.976 . . . . 0.0 109.142 179.605 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -121.34 137.74 54.56 Favored 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 178.517 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -119.74 137.82 53.7 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.143 0.497 . . . . 0.0 111.963 -178.201 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.601 ' HE ' ' CD1' ' A' ' 68' ' ' LEU . 7.0 mmm-85 -123.43 127.56 48.6 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 108.404 -0.961 . . . . 0.0 108.404 177.612 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 12.4 mt -107.18 149.08 28.09 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.906 0.384 . . . . 0.0 110.836 -178.965 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 10.3 m-85 -134.14 111.8 10.61 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.711 -179.735 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.548 ' C ' HD23 ' A' ' 63' ' ' LEU . 2.9 tt -105.94 -83.35 0.52 Allowed 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 115.812 -0.631 . . . . 0.0 109.5 179.444 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.456 ' H ' ' HB ' ' A' ' 67' ' ' VAL . . . -76.81 -177.12 44.42 Favored Glycine 0 CA--C 1.521 0.436 0 N-CA-C 109.326 -1.509 . . . . 0.0 109.326 178.699 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.667 ' N ' HD12 ' A' ' 65' ' ' LEU . 7.3 mp -75.45 -33.2 60.86 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 119.988 -0.685 . . . . 0.0 110.477 -179.612 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -102.63 8.96 39.59 Favored 'General case' 0 C--N 1.332 -0.168 0 C-N-CA 122.67 0.388 . . . . 0.0 111.323 -179.902 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.573 ' O ' HG12 ' A' ' 67' ' ' VAL . 9.5 t -101.49 93.56 2.89 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.245 0 CA-C-O 121.197 0.523 . . . . 0.0 111.694 -178.864 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.601 ' CD1' ' HE ' ' A' ' 60' ' ' ARG . 1.9 tp -111.69 117.81 33.9 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 108.446 -0.946 . . . . 0.0 108.446 178.62 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.653 HG23 ' OG ' ' A' ' 94' ' ' SER . 3.6 mt -115.28 144.78 22.09 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.247 0 CA-C-O 120.945 0.402 . . . . 0.0 111.155 -178.815 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -128.46 134.42 48.73 Favored 'General case' 0 C--O 1.238 0.492 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.251 179.417 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . 0.55 ' HE3' HD12 ' A' ' 90' ' ' ILE . 0.1 OUTLIER -143.75 148.15 35.22 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.439 -0.8 . . . . 0.0 109.557 179.472 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -110.82 121.49 45.47 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 107.975 -1.12 . . . . 0.0 107.975 178.509 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.683 HD12 ' CB ' ' A' ' 85' ' ' PHE . 4.2 pt -132.19 165.41 32.12 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 N-CA-C 113.627 0.973 . . . . 0.0 113.627 -176.621 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 3.3 p -120.09 148.96 42.96 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 114.926 -1.033 . . . . 0.0 109.642 178.71 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.535 HD12 ' CE1' ' A' ' 85' ' ' PHE . 14.2 tp -66.1 124.4 22.48 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-O 121.239 0.542 . . . . 0.0 110.542 -179.002 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -98.58 -44.89 6.28 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 115.307 -0.861 . . . . 0.0 111.429 178.205 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' TRP . . . . . 0.581 ' NE1' ' HA3' ' A' ' 84' ' ' GLY . 69.2 p-90 -164.91 172.34 12.96 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.808 -179.091 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -151.3 123.78 8.4 Favored 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 178.117 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . 0.547 ' O ' ' OD1' ' A' ' 80' ' ' ASP . 5.2 ttm180 -152.2 131.81 13.1 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 119.916 -0.713 . . . . 0.0 112.617 179.891 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . 0.563 ' OD2' ' O ' ' A' ' 80' ' ' ASP . 0.6 OUTLIER 53.61 46.76 25.36 Favored 'General case' 0 N--CA 1.467 0.418 0 N-CA-C 113.699 0.999 . . . . 0.0 113.699 177.117 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 72.32 12.15 76.38 Favored Glycine 0 CA--C 1.521 0.461 0 C-N-CA 120.433 -0.889 . . . . 0.0 111.856 178.114 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 52.4 mt -116.24 140.27 49.49 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 178.734 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 35.2 mt -128.17 135.72 50.13 Favored 'General case' 0 CA--C 1.512 -0.501 0 C-N-CA 120.715 -0.394 . . . . 0.0 111.339 -178.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . 0.581 ' HA3' ' NE1' ' A' ' 77' ' ' TRP . . . -110.66 156.67 15.43 Favored Glycine 0 N--CA 1.448 -0.558 0 N-CA-C 109.317 -1.513 . . . . 0.0 109.317 178.301 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . 0.683 ' CB ' HD12 ' A' ' 73' ' ' ILE . 78.4 m-85 -145.37 143.94 30.4 Favored 'General case' 0 C--N 1.312 -1.028 0 N-CA-C 110.001 -0.37 . . . . 0.0 110.001 -179.53 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 52.4 tt0 -103.64 130.16 51.06 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 179.355 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . 0.513 ' O ' ' NE2' ' A' ' 39' ' ' HIS . 4.6 t -69.26 118.67 12.44 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.492 0.553 . . . . 0.0 112.492 -177.926 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 58.7 mm-40 -92.43 -36.76 12.93 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.77 178.876 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . 0.449 ' ND1' ' C ' ' A' ' 89' ' ' HIS . 0.0 OUTLIER -164.0 143.79 8.06 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.966 179.955 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.602 HD11 ' OG ' ' A' ' 94' ' ' SER . 9.0 tt -145.61 141.3 22.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-O 121.254 0.55 . . . . 0.0 109.994 -179.592 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -58.5 141.04 53.03 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 115.272 -0.876 . . . . 0.0 112.434 -178.029 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 6.3 tp -54.15 -41.73 68.77 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 114.853 -1.067 . . . . 0.0 110.725 -179.491 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . 0.524 ' OD1' ' N ' ' A' ' 94' ' ' SER . 2.8 p30 -68.5 -37.18 79.86 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 179.469 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . 0.653 ' OG ' HG23 ' A' ' 69' ' ' ILE . 1.6 t -67.2 -38.45 85.36 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.08 179.337 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . 0.471 ' CG1' HG23 ' A' ' 90' ' ' ILE . 56.4 mt -58.65 -37.81 67.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.324 179.886 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -70.24 -40.66 74.32 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.158 -0.617 . . . . 0.0 111.195 -178.489 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 61.2 m-70 -61.66 -36.22 80.19 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 119.359 -0.936 . . . . 0.0 109.207 179.767 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.607 ' O ' HG23 ' A' ' 102' ' ' VAL . 35.6 mt -66.82 -34.13 77.14 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 177.651 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.14 -40.93 95.11 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 108.504 -0.924 . . . . 0.0 108.504 177.893 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 2.7 mmp_? -60.23 -45.28 93.78 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.157 -0.929 . . . . 0.0 110.31 178.776 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.458 HD21 HD12 ' A' ' 63' ' ' LEU . 5.3 mp -63.01 -36.23 82.88 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.988 -179.803 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . 0.607 HG23 ' O ' ' A' ' 98' ' ' LEU . 71.5 t -68.31 -47.3 78.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.527 179.749 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 26.8 tt0 -65.57 -40.48 92.82 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.947 -0.569 . . . . 0.0 111.486 -179.399 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 12.5 mt -75.44 -42.57 53.07 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.718 -0.393 . . . . 0.0 111.175 -179.066 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . 0.431 ' OD1' ' O ' ' A' ' 101' ' ' LEU . 16.9 m120 -61.29 -34.23 74.88 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 120.814 -0.354 . . . . 0.0 110.711 -179.714 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 17.8 tp -59.3 -39.7 83.86 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.335 179.883 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 82.98 31.11 29.78 Favored Glycine 0 CA--C 1.524 0.63 0 N-CA-C 111.001 -0.839 . . . . 0.0 111.001 179.903 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . 0.51 ' CG ' ' H ' ' A' ' 109' ' ' GLU . 23.0 t70 -165.85 -173.64 2.75 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.853 0.359 . . . . 0.0 110.427 179.954 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . 0.51 ' H ' ' CG ' ' A' ' 108' ' ' ASP . 0.2 OUTLIER -159.17 -167.88 2.19 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.425 179.875 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 24.6 mt-10 56.88 42.59 26.19 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.033 0.444 . . . . 0.0 110.085 -179.565 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . 0.492 HD22 ' HA ' ' A' ' 111' ' ' LEU . 0.2 OUTLIER -140.39 105.93 5.1 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.049 179.911 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.651 HD22 ' N ' ' A' ' 112' ' ' LEU . 3.4 mm? -78.07 -113.45 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.728 -179.696 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . 0.455 ' O ' ' O ' ' A' ' 114' ' ' ARG . 56.8 mt-10 -90.99 -119.15 0.07 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.73 -179.79 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . 0.455 ' O ' ' O ' ' A' ' 113' ' ' GLU . 2.4 mtm105 55.13 110.64 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.235 -179.713 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -96.83 -31.81 12.42 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.854 0.359 . . . . 0.0 110.823 -179.68 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -66.75 -38.49 86.74 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.915 -179.712 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' ALA . . . . . 0.635 ' O ' HG23 ' A' ' 120' ' ' VAL . . . -69.55 -23.92 63.64 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.64 179.481 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 80.8 mt -54.78 -37.49 66.09 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.446 -0.502 . . . . 0.0 111.167 -177.898 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . 0.587 ' C ' ' H ' ' A' ' 121' ' ' SER . 2.9 mm? -56.24 -15.74 4.34 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 120.123 -0.631 . . . . 0.0 110.001 -178.439 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . 0.635 HG23 ' O ' ' A' ' 117' ' ' ALA . 57.4 t -56.85 0.18 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 121.014 0.435 . . . . 0.0 110.446 179.805 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' SER . . . . . 0.587 ' H ' ' C ' ' A' ' 119' ' ' LEU . 11.2 p -101.9 -33.03 9.93 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.263 179.553 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -166.61 112.35 0.8 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.29 179.901 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . 0.688 ' CG ' ' N ' ' A' ' 124' ' ' ASP . 7.7 p80 -67.11 -56.95 7.84 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.811 -179.634 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . 0.688 ' N ' ' CG ' ' A' ' 123' ' ' HIS . 0.4 OUTLIER 55.62 -1.82 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.71 -179.667 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 125' ' ' ASP . . . . . 0.613 ' H ' ' C ' ' A' ' 123' ' ' HIS . 14.7 m-20 . . . . . 0 C--O 1.22 -0.488 0 CA-C-O 117.986 -1.007 . . . . 0.0 110.68 -179.853 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 501' ' ' C2E . . . . . 0.928 ' O21' " H4'" ' A' ' 501' ' ' C2E . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 502' ' ' C2E . . . . . 0.861 ' C61' ' H ' ' A' ' 8' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.407 ' C ' ' H ' ' A' ' 3' ' ' ASP . 12.1 mmt . . . . . 0 N--CA 1.491 1.582 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 37.3 m -78.6 35.54 0.24 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.322 179.864 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . 0.407 ' H ' ' C ' ' A' ' 1' ' ' MET . 5.3 m-20 -80.66 20.74 0.71 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.446 179.886 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.716 ' O ' ' N ' ' A' ' 6' ' ' ASP . 14.8 tm0? -111.0 -11.94 14.26 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.112 179.968 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . 0.566 ' CD2' ' N ' ' A' ' 5' ' ' HIS . 0.1 OUTLIER -14.48 73.3 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 115.564 -0.744 . . . . 0.0 111.705 179.41 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . 0.716 ' N ' ' O ' ' A' ' 4' ' ' GLN . 1.6 m-20 19.98 91.87 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.14 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.598 179.794 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.736 ' OE1' ' HB2' ' A' ' 122' ' ' ALA . 6.1 tt0 -95.68 125.69 40.44 Favored 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 110.093 -0.336 . . . . 0.0 110.093 179.792 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.694 ' NH2' ' N11' ' A' ' 501' ' ' C2E . 0.0 OUTLIER -125.26 -5.42 7.24 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.775 -178.947 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.525 ' O ' ' C ' ' A' ' 10' ' ' ARG . 1.1 ptt85 -111.61 84.53 1.96 Allowed 'General case' 0 N--CA 1.467 0.41 0 CA-C-O 121.119 0.485 . . . . 0.0 110.225 179.829 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.525 ' C ' ' O ' ' A' ' 9' ' ' ARG . 0.0 OUTLIER 17.33 -91.18 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 114.945 -1.025 . . . . 0.0 111.769 -179.892 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 5.2 m-85 -115.02 169.55 9.01 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-O 120.789 0.328 . . . . 0.0 110.464 -179.895 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . 0.536 ' ND1' ' N21' ' A' ' 502' ' ' C2E . 14.8 m-70 -63.39 143.13 58.07 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.499 179.964 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.525 ' NH1' ' C6 ' ' A' ' 501' ' ' C2E . 19.7 mtm180 -86.32 164.71 16.93 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.095 -179.997 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.752 ' N ' HD12 ' A' ' 14' ' ' ILE . 1.8 mp -73.17 97.25 0.81 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 N-CA-C 109.863 -0.421 . . . . 0.0 109.863 179.772 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -95.19 120.5 35.53 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.506 0.669 . . . . 0.0 111.623 -179.363 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -149.73 155.57 40.39 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 114.791 -1.095 . . . . 0.0 108.363 178.022 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -95.44 146.81 24.13 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 120.159 -0.616 . . . . 0.0 110.863 -178.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.538 ' O ' HD12 ' A' ' 32' ' ' LEU . . . -179.79 176.99 0.72 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.9 -0.591 . . . . 0.0 109.926 179.598 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -96.12 133.88 39.86 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.79 -179.855 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.583 ' O ' ' O ' ' A' ' 31' ' ' VAL . 13.0 t -133.8 152.86 52.0 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.186 0.517 . . . . 0.0 110.215 178.692 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.538 ' OE1' ' NH2' ' A' ' 28' ' ' ARG . 97.0 mt-10 -129.09 155.67 45.09 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 109.136 -0.691 . . . . 0.0 109.136 179.291 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.477 ' HA ' ' O ' ' A' ' 58' ' ' GLU . 34.2 mt -138.47 136.36 43.94 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.437 0 C-N-CA 120.005 -0.678 . . . . 0.0 111.263 -179.603 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.75 HD11 ' HE ' ' A' ' 60' ' ' ARG . 0.0 OUTLIER -125.29 127.79 47.23 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.419 -0.809 . . . . 0.0 111.261 -178.793 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.469 ' O ' ' OE1' ' A' ' 24' ' ' GLN . 1.6 tm0? -132.49 101.95 5.53 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.082 -0.963 . . . . 0.0 109.532 178.519 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 80.71 -126.51 7.43 Favored Glycine 0 CA--C 1.523 0.554 0 N-CA-C 110.111 -1.195 . . . . 0.0 110.111 -178.729 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.613 ' OE1' ' N ' ' A' ' 26' ' ' GLU . 6.0 pm0 -100.68 13.21 35.58 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 110.084 -0.339 . . . . 0.0 110.084 179.583 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.558 ' HB3' ' CZ2' ' A' ' 29' ' ' TRP . 33.5 mtt180 -114.54 135.83 53.69 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 112.755 0.65 . . . . 0.0 112.755 -178.312 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.538 ' NH2' ' OE1' ' A' ' 21' ' ' GLU . 26.7 ttt180 -128.74 148.7 50.87 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.174 179.206 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.558 ' CZ2' ' HB3' ' A' ' 27' ' ' ARG . 6.7 m-90 -147.2 156.13 42.7 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.655 -179.144 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 18.8 mt-10 -100.34 138.54 37.27 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 178.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.583 ' O ' ' O ' ' A' ' 20' ' ' SER . 12.0 m -148.06 157.96 8.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-O 121.223 0.535 . . . . 0.0 111.274 -179.454 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.538 HD12 ' O ' ' A' ' 18' ' ' ALA . 8.3 tp -98.31 130.03 45.0 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 108.301 -1.0 . . . . 0.0 108.301 178.816 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.537 ' N ' HD12 ' A' ' 32' ' ' LEU . 0.8 OUTLIER -92.12 125.96 37.01 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 120.334 -0.547 . . . . 0.0 109.881 179.895 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 73.3 m-70 -90.48 -28.74 18.36 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.418 -0.81 . . . . 0.0 111.742 -178.706 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -171.98 162.23 5.88 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 119.493 -0.883 . . . . 0.0 111.283 177.568 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.511 HG22 ' H ' ' A' ' 37' ' ' SER . 4.8 p -146.04 168.88 6.64 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.11 0 CA-C-N 115.782 -0.645 . . . . 0.0 111.193 -178.798 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.511 ' H ' HG22 ' A' ' 36' ' ' VAL . 23.0 t -142.11 168.46 19.69 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 107.632 -1.247 . . . . 0.0 107.632 178.513 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 3.6 tp -64.41 -0.6 1.36 Allowed 'General case' 0 C--N 1.322 -0.588 0 C-N-CA 119.555 -0.858 . . . . 0.0 110.795 -179.277 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 2.0 p80 -162.25 43.16 0.13 Allowed 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 120.693 -0.403 . . . . 0.0 111.41 179.747 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . 0.457 ' HA3' ' N3 ' ' A' ' 501' ' ' C2E . . . 179.83 156.58 18.18 Favored Glycine 0 CA--C 1.528 0.898 0 N-CA-C 111.039 -0.824 . . . . 0.0 111.039 179.765 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.45 HG21 HG21 ' A' ' 73' ' ' ILE . 0.1 OUTLIER -148.57 148.76 15.69 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.355 0 CA-C-O 121.453 0.644 . . . . 0.0 111.664 -178.745 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.434 HD23 ' N ' ' A' ' 43' ' ' VAL . 0.9 OUTLIER -121.83 132.29 54.51 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 115.069 -0.969 . . . . 0.0 108.53 178.79 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.434 ' N ' HD23 ' A' ' 42' ' ' LEU . 31.7 m -136.62 174.84 11.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 121.316 0.579 . . . . 0.0 112.078 -179.172 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -98.57 144.56 17.3 Favored Glycine 0 CA--C 1.526 0.725 0 N-CA-C 109.263 -1.535 . . . . 0.0 109.263 178.109 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . 0.516 ' CD ' ' O ' ' A' ' 45' ' ' GLN . 0.0 OUTLIER -87.16 117.73 69.01 Favored Pre-proline 0 CA--C 1.534 0.33 0 CA-C-N 118.052 0.926 . . . . 0.0 111.862 -178.284 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 74.6 Cg_endo -85.85 160.16 10.43 Favored 'Trans proline' 0 C--N 1.306 -1.673 0 C-N-CA 121.772 1.648 . . . . 0.0 111.576 178.89 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 24.0 mm-40 -65.2 -25.33 67.66 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 112.291 0.478 . . . . 0.0 112.291 -178.888 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.532 ' O ' ' N ' ' A' ' 50' ' ' ASN . 3.3 m-20 -86.68 8.82 20.84 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 111.661 0.245 . . . . 0.0 111.661 -178.897 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' TRP . . . . . 0.463 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 59.3 t-105 -60.56 66.9 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 112.265 0.468 . . . . 0.0 112.265 -179.421 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.584 ' C ' HD22 ' A' ' 50' ' ' ASN . 0.2 OUTLIER -93.16 78.66 4.54 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 120.047 -0.661 . . . . 0.0 109.246 178.105 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -145.65 146.25 16.24 Favored Glycine 0 CA--C 1.523 0.54 0 N-CA-C 111.601 -0.6 . . . . 0.0 111.601 -179.07 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -77.75 121.97 84.99 Favored Pre-proline 0 C--N 1.328 -0.365 0 CA-C-N 115.427 -0.386 . . . . 0.0 110.714 -179.969 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 21.5 Cg_endo -62.12 -22.41 74.16 Favored 'Trans proline' 0 N--CA 1.496 1.634 0 C-N-CA 122.61 2.207 . . . . 0.0 112.113 -179.757 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 15.8 mt-30 -77.19 -24.19 51.41 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 120.477 -0.489 . . . . 0.0 111.429 -179.2 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.535 ' O ' ' CE1' ' A' ' 57' ' ' PHE . 17.1 mtp85 -92.88 155.42 41.56 Favored Pre-proline 0 C--N 1.331 -0.223 0 C-N-CA 120.836 -0.345 . . . . 0.0 110.383 -179.955 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_endo -68.0 161.16 45.42 Favored 'Trans proline' 0 N--CA 1.497 1.694 0 C-N-CA 123.059 2.506 . . . . 0.0 113.03 -179.057 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.535 ' CE1' ' O ' ' A' ' 55' ' ' ARG . 43.5 m-85 -131.09 157.31 43.42 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.35 -0.841 . . . . 0.0 109.415 179.595 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.477 ' O ' ' HA ' ' A' ' 22' ' ' ILE . 42.0 mt-10 -123.13 139.23 54.28 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 109.095 -0.706 . . . . 0.0 109.095 178.319 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -124.92 142.08 51.7 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 112.817 0.673 . . . . 0.0 112.817 -177.531 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.75 ' HE ' HD11 ' A' ' 23' ' ' LEU . 0.0 OUTLIER -124.95 128.08 48.05 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.115 -0.948 . . . . 0.0 109.288 177.215 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.538 HD11 ' SD ' ' A' ' 71' ' ' MET . 7.4 mt -108.59 129.38 55.32 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 120.569 -0.452 . . . . 0.0 110.431 -179.658 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' TYR . . . . . 0.43 ' CD1' ' N ' ' A' ' 62' ' ' TYR . 19.9 m-85 -110.67 109.66 20.02 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.002 0.429 . . . . 0.0 110.742 -179.957 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.526 ' C ' HD23 ' A' ' 63' ' ' LEU . 3.5 tt -104.19 -85.03 0.47 Allowed 'General case' 0 C--N 1.333 -0.116 0 CA-C-N 115.76 -0.655 . . . . 0.0 109.545 179.476 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.467 ' H ' ' HB ' ' A' ' 67' ' ' VAL . . . -76.3 176.89 51.49 Favored Glycine 0 CA--C 1.523 0.585 0 N-CA-C 109.337 -1.505 . . . . 0.0 109.337 178.7 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.725 HD13 ' C ' ' A' ' 65' ' ' LEU . 3.0 tm? -71.93 -37.31 70.05 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 120.031 -0.668 . . . . 0.0 109.604 -179.636 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.427 ' OD1' ' O ' ' A' ' 66' ' ' ASP . 55.6 t0 -98.52 9.2 43.72 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.105 179.49 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.558 ' O ' HG12 ' A' ' 67' ' ' VAL . 8.7 t -106.06 96.15 4.37 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.305 0 CA-C-O 121.405 0.621 . . . . 0.0 111.741 -178.875 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 7.8 tp -113.24 117.55 32.18 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 108.102 -1.073 . . . . 0.0 108.102 178.221 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.763 HG23 ' OG ' ' A' ' 94' ' ' SER . 3.6 mt -112.64 144.76 19.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 120.798 0.333 . . . . 0.0 110.948 -178.974 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 9.8 ptt180 -128.16 130.98 48.92 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.835 179.214 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . 0.538 ' SD ' HD11 ' A' ' 61' ' ' LEU . 2.0 mtp -140.18 148.14 41.16 Favored 'General case' 0 C--O 1.227 -0.117 0 CA-C-N 115.719 -0.673 . . . . 0.0 109.902 179.836 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -103.78 126.54 50.98 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 107.627 -1.249 . . . . 0.0 107.627 178.143 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.45 HG21 HG21 ' A' ' 41' ' ' ILE . 11.2 pt -134.83 157.68 41.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 N-CA-C 112.953 0.723 . . . . 0.0 112.953 -177.44 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -122.52 154.69 37.53 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.023 -0.99 . . . . 0.0 109.623 178.723 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.523 ' CD1' ' CZ ' ' A' ' 85' ' ' PHE . 5.2 tp -66.47 120.74 13.9 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.226 0.536 . . . . 0.0 110.558 -179.828 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -97.69 -41.75 7.96 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.422 177.927 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' TRP . . . . . 0.597 ' NE1' ' HA3' ' A' ' 84' ' ' GLY . 67.6 p-90 -170.45 168.52 7.81 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 115.485 -0.78 . . . . 0.0 109.898 -179.647 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -148.15 123.89 10.53 Favored 'General case' 0 N--CA 1.464 0.27 0 N-CA-C 109.932 -0.395 . . . . 0.0 109.932 178.795 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 38.4 ttt85 -152.37 133.68 14.41 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 113.215 0.82 . . . . 0.0 113.215 179.863 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 13.3 t70 56.92 47.15 18.3 Favored 'General case' 0 N--CA 1.464 0.246 0 N-CA-C 114.227 1.195 . . . . 0.0 114.227 176.405 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 83.77 -28.08 4.12 Favored Glycine 0 CA--C 1.524 0.656 0 C-N-CA 120.314 -0.946 . . . . 0.0 113.153 177.114 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 3.5 mt -89.69 157.89 17.8 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 117.637 0.719 . . . . 0.0 110.206 -179.283 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 36.5 mt -129.62 135.34 48.42 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.308 -179.078 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . 0.597 ' HA3' ' NE1' ' A' ' 77' ' ' TRP . . . -96.29 152.4 20.21 Favored Glycine 0 N--CA 1.451 -0.347 0 N-CA-C 109.894 -1.283 . . . . 0.0 109.894 178.935 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . 0.523 ' CZ ' ' CD1' ' A' ' 75' ' ' LEU . 23.8 m-85 -145.67 132.75 20.36 Favored 'General case' 0 C--N 1.318 -0.772 0 C-N-CA 120.79 -0.364 . . . . 0.0 110.892 -179.2 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.501 ' O ' ' NE2' ' A' ' 88' ' ' GLN . 42.3 tt0 -103.92 126.32 50.95 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 178.994 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . 0.431 ' C ' HE21 ' A' ' 88' ' ' GLN . 5.6 t -68.72 122.12 17.89 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.015 0.436 . . . . 0.0 112.007 -178.408 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . 0.501 ' NE2' ' O ' ' A' ' 86' ' ' GLU . 20.1 mm-40 -95.14 -34.05 12.42 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.078 179.348 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . 0.442 ' ND1' ' C ' ' A' ' 89' ' ' HIS . 0.0 OUTLIER -161.5 141.69 10.65 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.031 179.66 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.41 HD11 ' OG ' ' A' ' 94' ' ' SER . 7.1 tt -143.36 139.33 26.52 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-O 121.169 0.509 . . . . 0.0 109.988 -179.045 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -57.21 142.69 42.0 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 115.508 -0.769 . . . . 0.0 112.057 -178.312 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 3.3 tp -54.1 -42.05 68.98 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.222 -0.899 . . . . 0.0 110.457 -179.337 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . 0.522 ' OD1' ' N ' ' A' ' 94' ' ' SER . 1.4 p30 -67.07 -39.07 86.79 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 179.273 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . 0.763 ' OG ' HG23 ' A' ' 69' ' ' ILE . 6.7 t -66.24 -37.0 84.47 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.573 -0.74 . . . . 0.0 110.185 179.268 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . 0.41 ' CG1' HG23 ' A' ' 90' ' ' ILE . 38.5 mt -58.61 -38.3 70.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.137 179.973 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -70.88 -41.54 71.23 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.354 -0.538 . . . . 0.0 111.203 -179.003 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 60.7 m-70 -61.67 -35.4 77.86 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 119.408 -0.917 . . . . 0.0 109.303 179.791 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 5.5 mp -67.53 -34.04 76.29 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 177.475 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -64.3 -38.69 91.94 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 178.522 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 53.2 mtp85 -58.06 -37.93 75.36 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.943 179.131 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.471 ' O ' ' ND2' ' A' ' 105' ' ' ASN . 6.7 mp -69.91 -36.24 75.22 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.124 -179.657 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 86.5 t -68.67 -40.84 82.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.911 179.739 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 14.5 tt0 -64.94 -47.86 76.16 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.447 -179.269 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.468 ' CD1' ' N ' ' A' ' 104' ' ' LEU . 5.3 mp -69.24 -43.05 74.77 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 120.976 -0.29 . . . . 0.0 111.416 -179.668 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . 0.471 ' ND2' ' O ' ' A' ' 101' ' ' LEU . 18.6 m-80 -62.13 -26.24 68.2 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.684 -0.407 . . . . 0.0 110.596 -179.756 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 2.4 tp -55.9 -18.92 10.16 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.885 0.374 . . . . 0.0 110.016 179.803 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -132.02 171.31 21.42 Favored Glycine 0 CA--C 1.526 0.759 0 N-CA-C 110.81 -0.916 . . . . 0.0 110.81 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . 0.478 ' CG ' ' N ' ' A' ' 109' ' ' GLU . 4.5 p-10 -135.39 -54.69 0.79 Allowed 'General case' 0 C--N 1.333 -0.152 0 CA-C-O 120.703 0.287 . . . . 0.0 110.576 -179.942 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . 0.478 ' N ' ' CG ' ' A' ' 108' ' ' ASP . 2.3 tp10 -169.98 -34.56 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.378 -0.373 . . . . 0.0 110.942 179.991 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -144.66 -136.41 0.09 Allowed 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.576 -0.284 . . . . 0.0 110.677 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 2.4 mp -97.93 -94.57 0.23 Allowed 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 121.055 -0.258 . . . . 0.0 110.952 -179.696 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 2.3 tp 67.25 131.09 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.738 0.304 . . . . 0.0 110.55 -179.815 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . 0.4 ' O ' ' CG ' ' A' ' 113' ' ' GLU . 8.3 pt-20 -65.29 122.32 16.85 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.582 179.922 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 10.1 ttm180 -174.85 45.11 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.35 -179.913 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -150.51 -55.94 0.16 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.623 -179.875 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 1.2 tt -66.93 -37.11 83.71 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.79 -179.857 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -63.71 -22.69 67.04 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.167 0.508 . . . . 0.0 110.283 -179.123 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.417 ' O ' ' OG ' ' A' ' 121' ' ' SER . 46.9 mt -57.46 -35.81 70.63 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 108.195 -1.039 . . . . 0.0 108.195 178.32 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . 0.495 ' C ' ' H ' ' A' ' 121' ' ' SER . 36.2 mt -57.91 -48.92 78.45 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 114.935 -1.03 . . . . 0.0 108.24 179.075 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . 0.431 ' O ' HG12 ' A' ' 120' ' ' VAL . 18.6 t -59.14 -0.99 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.135 177.991 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' SER . . . . . 0.495 ' H ' ' C ' ' A' ' 119' ' ' LEU . 4.4 p -111.45 -41.66 4.06 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 108.555 -0.906 . . . . 0.0 108.555 177.237 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . 0.736 ' HB2' ' OE1' ' A' ' 7' ' ' GLU . . . -128.75 84.55 2.24 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.106 -0.952 . . . . 0.0 109.664 179.77 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . 0.741 ' CG ' ' N ' ' A' ' 124' ' ' ASP . 0.0 OUTLIER -83.74 -159.01 0.34 Allowed 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 120.559 -0.456 . . . . 0.0 111.162 -178.834 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . 0.741 ' N ' ' CG ' ' A' ' 123' ' ' HIS . 0.6 OUTLIER 158.91 -32.15 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.787 -0.642 . . . . 0.0 109.53 179.961 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 125' ' ' ASP . . . . . 0.42 ' OD1' ' O ' ' A' ' 125' ' ' ASP . 0.7 OUTLIER . . . . . 0 C--O 1.219 -0.518 0 CA-C-O 118.028 -0.987 . . . . 0.0 110.417 179.771 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 501' ' ' C2E . . . . . 0.889 ' O21' " H4'" ' A' ' 501' ' ' C2E . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 502' ' ' C2E . . . . . 0.536 ' N21' ' ND1' ' A' ' 12' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.0 mpt? . . . . . 0 N--CA 1.491 1.583 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 3.4 t -163.35 161.21 24.42 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.458 -179.914 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -99.66 21.04 12.94 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.16 -0.473 . . . . 0.0 109.89 178.475 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.501 ' C ' ' H ' ' A' ' 6' ' ' ASP . 0.8 OUTLIER -114.41 -15.69 12.05 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 115.643 -0.708 . . . . 0.0 109.827 177.883 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 61.1 m170 -74.8 29.99 0.09 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.214 179.512 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . 0.591 ' O ' ' NH2' ' A' ' 8' ' ' ARG . 6.3 m-20 -50.25 160.26 0.39 Allowed 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 -179.932 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -97.27 133.39 41.95 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.177 0.513 . . . . 0.0 110.391 -179.744 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.668 HH21 ' C81' ' A' ' 502' ' ' C2E . 0.2 OUTLIER -125.14 -14.17 6.61 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.501 -0.772 . . . . 0.0 111.289 -179.1 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.625 ' CZ ' HH21 ' A' ' 13' ' ' ARG . 2.5 ptt180 -105.47 93.66 4.79 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.112 179.365 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.536 ' C ' ' O ' ' A' ' 9' ' ' ARG . 0.0 OUTLIER 15.07 -89.23 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 115.215 -0.902 . . . . 0.0 111.945 -179.88 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . 0.4 ' N ' ' O ' ' A' ' 9' ' ' ARG . 0.3 OUTLIER -124.52 171.37 10.05 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-O 120.978 0.418 . . . . 0.0 110.707 -179.557 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . 0.569 ' ND1' ' N21' ' A' ' 502' ' ' C2E . 9.0 m-70 -64.74 132.88 50.8 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.643 -179.946 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.625 HH21 ' CZ ' ' A' ' 9' ' ' ARG . 2.2 mtm180 -81.24 -177.68 6.58 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.396 -0.366 . . . . 0.0 110.527 -179.905 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.567 ' N ' HD12 ' A' ' 14' ' ' ILE . 2.4 mp -91.56 104.49 15.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.043 -179.405 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -95.14 120.21 34.96 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.635 179.145 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 2.2 p90 -150.11 157.82 43.52 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 108.503 -0.925 . . . . 0.0 108.503 178.02 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -95.77 143.37 27.07 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 120.139 -0.624 . . . . 0.0 110.77 -179.372 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.559 ' O ' HD12 ' A' ' 32' ' ' LEU . . . -176.48 175.23 1.79 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.665 179.091 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -96.33 134.03 39.96 Favored 'General case' 0 C--N 1.326 -0.45 0 C-N-CA 120.647 -0.421 . . . . 0.0 111.141 -179.598 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.495 ' O ' ' O ' ' A' ' 31' ' ' VAL . 11.0 p -133.52 152.39 51.9 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.019 178.588 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.442 ' CG ' HH21 ' A' ' 28' ' ' ARG . 6.1 mm-40 -131.31 136.74 48.38 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 179.814 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 1.1 mm -117.45 135.37 58.08 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.552 0 C-N-CA 120.197 -0.601 . . . . 0.0 110.338 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -130.56 122.78 28.16 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.78 -179.321 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.535 ' OE1' ' CZ ' ' A' ' 57' ' ' PHE . 24.2 tt0 -124.64 101.78 7.28 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 114.735 -1.12 . . . . 0.0 109.823 179.097 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 82.14 -124.53 6.52 Favored Glycine 0 CA--C 1.523 0.557 0 N-CA-C 110.055 -1.218 . . . . 0.0 110.055 -178.952 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -100.53 10.64 40.91 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.776 0.322 . . . . 0.0 110.197 179.555 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.53 ' HB3' ' CZ2' ' A' ' 29' ' ' TRP . 17.5 mtt180 -112.58 133.57 54.56 Favored 'General case' 0 C--N 1.332 -0.158 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 -178.502 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.442 HH21 ' CG ' ' A' ' 21' ' ' GLU . 49.2 ttt180 -128.47 152.88 47.73 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.388 179.212 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.53 ' CZ2' ' HB3' ' A' ' 27' ' ' ARG . 6.6 m-90 -151.02 156.9 42.08 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.709 -178.691 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.538 ' CD ' ' H ' ' A' ' 30' ' ' GLU . 2.3 mp0 -99.94 136.18 40.24 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 179.159 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.495 ' O ' ' O ' ' A' ' 20' ' ' SER . 30.7 m -145.36 156.65 13.35 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-O 121.049 0.452 . . . . 0.0 111.001 -179.451 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.559 HD12 ' O ' ' A' ' 18' ' ' ALA . 10.7 tp -97.41 129.71 44.61 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 108.42 -0.956 . . . . 0.0 108.42 178.811 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.472 ' N ' HD12 ' A' ' 32' ' ' LEU . 0.5 OUTLIER -90.14 124.41 34.79 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.152 0.501 . . . . 0.0 110.111 -179.729 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 75.4 m-70 -91.02 -31.56 16.26 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.375 -0.829 . . . . 0.0 111.414 -178.87 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 1.9 p30 -170.8 161.87 7.4 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 119.577 -0.849 . . . . 0.0 111.125 177.387 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.512 HG22 ' N ' ' A' ' 37' ' ' SER . 5.4 p -146.78 169.11 5.16 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.168 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.307 -178.572 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.527 ' CB ' HN22 ' A' ' 501' ' ' C2E . 14.7 t -140.09 171.78 13.7 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 107.956 -1.127 . . . . 0.0 107.956 178.224 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 4.0 tp -68.18 0.79 3.35 Favored 'General case' 0 C--N 1.324 -0.514 0 C-N-CA 120.124 -0.63 . . . . 0.0 111.185 -179.091 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -160.78 35.21 0.15 Allowed 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.573 -0.451 . . . . 0.0 111.141 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . 0.578 ' HA3' ' N3 ' ' A' ' 501' ' ' C2E . . . -174.02 159.93 29.55 Favored Glycine 0 CA--C 1.524 0.656 0 N-CA-C 110.943 -0.863 . . . . 0.0 110.943 179.673 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -148.22 148.91 15.7 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.277 0 CA-C-O 121.46 0.648 . . . . 0.0 111.839 -178.664 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -121.57 134.84 55.02 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 114.839 -1.073 . . . . 0.0 108.612 178.662 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 33.3 m -139.63 175.05 7.79 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-O 121.234 0.54 . . . . 0.0 111.698 -179.444 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -99.47 143.7 16.66 Favored Glycine 0 N--CA 1.467 0.746 0 N-CA-C 108.774 -1.73 . . . . 0.0 108.774 177.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . 0.52 ' CD ' ' O ' ' A' ' 45' ' ' GLN . 0.0 OUTLIER -85.66 121.7 73.3 Favored Pre-proline 0 CA--C 1.534 0.332 0 CA-C-N 118.221 1.01 . . . . 0.0 111.659 -178.314 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 79.8 Cg_endo -86.6 161.74 9.38 Favored 'Trans proline' 0 C--N 1.303 -1.82 0 C-N-CA 121.766 1.644 . . . . 0.0 111.106 178.447 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.4 mm100 -65.72 -39.65 91.41 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 111.9 0.334 . . . . 0.0 111.9 -179.32 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.528 ' O ' ' N ' ' A' ' 50' ' ' ASN . 79.2 m-20 -72.48 8.7 1.29 Allowed 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 111.912 0.338 . . . . 0.0 111.912 -178.873 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' TRP . . . . . 0.462 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 64.8 t-105 -59.84 66.72 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 112.324 0.49 . . . . 0.0 112.324 -179.344 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.538 ' ND2' ' O ' ' A' ' 50' ' ' ASN . 1.8 t30 -93.07 78.71 4.59 Favored 'General case' 0 C--N 1.326 -0.43 0 C-N-CA 119.947 -0.701 . . . . 0.0 109.302 178.176 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -144.39 144.23 13.11 Favored Glycine 0 CA--C 1.525 0.682 0 N-CA-C 111.578 -0.609 . . . . 0.0 111.578 -179.199 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -78.62 121.99 84.31 Favored Pre-proline 0 CA--C 1.534 0.357 0 CA-C-N 115.795 -0.203 . . . . 0.0 110.811 -179.898 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -60.93 -22.93 75.97 Favored 'Trans proline' 0 N--CA 1.495 1.59 0 C-N-CA 122.443 2.096 . . . . 0.0 112.433 -179.576 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.589 ' C ' ' HE ' ' A' ' 55' ' ' ARG . 28.2 mt-30 -75.5 -23.73 56.78 Favored 'General case' 0 C--N 1.323 -0.544 0 C-N-CA 120.36 -0.536 . . . . 0.0 111.059 -179.634 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.589 ' HE ' ' C ' ' A' ' 54' ' ' GLN . 0.0 OUTLIER -94.11 151.45 39.64 Favored Pre-proline 0 C--N 1.33 -0.252 0 CA-C-O 120.851 0.358 . . . . 0.0 110.043 179.981 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . 0.438 ' O ' ' OE1' ' A' ' 24' ' ' GLN . 33.2 Cg_endo -64.03 160.92 35.5 Favored 'Trans proline' 0 N--CA 1.495 1.615 0 C-N-CA 123.068 2.512 . . . . 0.0 113.532 -178.833 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.535 ' CZ ' ' OE1' ' A' ' 24' ' ' GLN . 58.7 m-85 -130.79 156.38 45.09 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 114.926 -1.034 . . . . 0.0 109.191 179.366 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -123.36 136.74 54.8 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 178.537 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . 0.605 ' HB2' HD13 ' A' ' 73' ' ' ILE . . . -115.33 135.42 54.16 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.971 0.415 . . . . 0.0 111.915 -178.545 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 3.7 mmm180 -122.91 127.42 48.92 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 108.547 -0.908 . . . . 0.0 108.547 177.725 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 13.5 mt -108.35 151.24 26.26 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.908 0.385 . . . . 0.0 111.001 -178.895 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' TYR . . . . . 0.407 ' CD1' ' N ' ' A' ' 62' ' ' TYR . 12.7 m-85 -134.61 110.68 9.47 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.62 179.809 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.472 ' C ' HD23 ' A' ' 63' ' ' LEU . 1.4 tt -106.01 -81.91 0.54 Allowed 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.625 179.608 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.464 ' H ' ' HB ' ' A' ' 67' ' ' VAL . . . -79.84 -177.88 50.96 Favored Glycine 0 CA--C 1.521 0.41 0 N-CA-C 109.343 -1.503 . . . . 0.0 109.343 178.678 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 5.5 mt -76.13 -33.42 59.43 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 119.806 -0.758 . . . . 0.0 110.478 -179.535 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -101.67 8.35 41.68 Favored 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 122.616 0.367 . . . . 0.0 110.849 179.886 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.563 ' O ' HG12 ' A' ' 67' ' ' VAL . 12.1 t -103.95 94.1 2.99 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.195 0 CA-C-O 121.336 0.589 . . . . 0.0 111.877 -178.769 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 5.4 tp -113.65 117.33 31.26 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 108.088 -1.079 . . . . 0.0 108.088 178.156 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.516 HG23 ' CB ' ' A' ' 94' ' ' SER . 3.9 mt -112.09 144.39 19.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-O 120.943 0.401 . . . . 0.0 111.174 -178.814 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.442 ' C ' ' HG2' ' A' ' 71' ' ' MET . 0.5 OUTLIER -128.2 130.1 47.49 Favored 'General case' 0 C--O 1.239 0.547 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.653 179.183 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . 0.769 ' SD ' HD12 ' A' ' 90' ' ' ILE . 0.0 OUTLIER -138.54 146.83 42.37 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.771 -0.649 . . . . 0.0 109.829 179.551 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . 0.454 ' OE2' ' O ' ' A' ' 57' ' ' PHE . 15.4 tp10 -99.59 132.83 44.67 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 107.551 -1.277 . . . . 0.0 107.551 178.663 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.605 HD13 ' HB2' ' A' ' 59' ' ' ALA . 2.0 pt -143.16 157.17 17.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 C-N-CA 119.182 -1.007 . . . . 0.0 113.102 -177.732 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 7.2 m -123.11 155.87 36.1 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-N 115.111 -0.95 . . . . 0.0 110.022 179.043 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.587 HD22 ' CE1' ' A' ' 85' ' ' PHE . 0.2 OUTLIER -64.56 118.33 8.67 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.793 0.33 . . . . 0.0 110.698 -179.252 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . 0.556 ' N ' HD13 ' A' ' 75' ' ' LEU . . . -97.1 -43.32 7.45 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-O 121.136 0.493 . . . . 0.0 110.022 177.659 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' TRP . . . . . 0.569 ' NE1' ' HA3' ' A' ' 84' ' ' GLY . 67.5 p-90 -171.22 167.75 6.92 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.042 179.946 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -146.96 123.73 11.23 Favored 'General case' 0 N--CA 1.465 0.278 0 N-CA-C 109.878 -0.416 . . . . 0.0 109.878 178.575 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . 0.422 ' NH2' ' O21' ' A' ' 502' ' ' C2E . 10.9 ttp180 -152.48 134.23 14.69 Favored 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 113.163 0.801 . . . . 0.0 113.163 -179.98 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 56.97 47.18 18.12 Favored 'General case' 0 C--N 1.333 -0.15 0 N-CA-C 113.788 1.033 . . . . 0.0 113.788 176.487 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 82.39 -27.94 3.54 Favored Glycine 0 CA--C 1.523 0.58 0 C-N-CA 120.319 -0.943 . . . . 0.0 113.033 177.268 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 4.9 mt -89.39 154.0 20.4 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 117.381 0.59 . . . . 0.0 110.335 -179.004 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.427 HD11 ' CB ' ' A' ' 45' ' ' GLN . 70.1 mt -126.87 135.67 51.28 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.402 -178.969 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . 0.569 ' HA3' ' NE1' ' A' ' 77' ' ' TRP . . . -98.49 150.84 19.46 Favored Glycine 0 N--CA 1.45 -0.375 0 N-CA-C 109.546 -1.421 . . . . 0.0 109.546 178.64 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . 0.587 ' CE1' HD22 ' A' ' 75' ' ' LEU . 45.8 m-85 -145.57 134.85 22.95 Favored 'General case' 0 C--N 1.318 -0.766 0 C-N-CA 120.863 -0.335 . . . . 0.0 110.458 -179.542 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.466 ' CD ' HE22 ' A' ' 88' ' ' GLN . 5.7 tt0 -103.97 125.73 50.57 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 179.646 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -70.38 125.44 26.8 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.979 0.419 . . . . 0.0 111.542 -178.744 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . 0.466 HE22 ' CD ' ' A' ' 86' ' ' GLU . 29.3 mm-40 -98.22 -31.94 11.82 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.302 179.468 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . 0.472 ' ND1' ' C ' ' A' ' 89' ' ' HIS . 0.0 OUTLIER -160.48 141.59 12.06 Favored 'General case' 0 C--O 1.222 -0.342 0 CA-C-N 116.043 -0.526 . . . . 0.0 109.842 179.617 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.769 HD12 ' SD ' ' A' ' 71' ' ' MET . 7.1 tt -145.26 140.72 22.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-O 121.381 0.61 . . . . 0.0 110.235 -179.13 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . 0.545 ' OD1' ' N ' ' A' ' 92' ' ' LEU . 12.9 t0 -56.88 142.42 41.29 Favored 'General case' 0 N--CA 1.462 0.131 0 CA-C-N 115.148 -0.933 . . . . 0.0 112.003 -178.294 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.545 ' N ' ' OD1' ' A' ' 91' ' ' ASP . 6.5 tt -53.87 -41.84 67.96 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 114.82 -1.082 . . . . 0.0 110.233 -179.051 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . 0.43 ' N ' ' OD1' ' A' ' 91' ' ' ASP . 0.6 OUTLIER -67.52 -42.46 82.76 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.815 -0.439 . . . . 0.0 109.815 179.254 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . 0.516 ' CB ' HG23 ' A' ' 69' ' ' ILE . 6.4 m -60.79 -37.8 83.17 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.176 179.615 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . 0.403 ' CG1' HG23 ' A' ' 90' ' ' ILE . 61.4 mt -58.62 -38.32 70.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.243 -179.991 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -70.97 -40.81 71.72 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.206 -0.597 . . . . 0.0 111.337 -179.131 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 68.7 m-70 -62.35 -37.24 84.89 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 119.503 -0.879 . . . . 0.0 109.316 179.945 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.43 -33.92 76.15 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 178.374 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 6.3 mtt-85 -60.46 -36.77 79.04 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 120.166 -0.613 . . . . 0.0 109.347 178.628 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . 0.462 ' CG ' HH11 ' A' ' 100' ' ' ARG . 0.1 OUTLIER -57.89 -46.18 85.3 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.511 179.108 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 7.1 mp -65.56 -35.4 80.73 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.39 -179.65 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 2.5 t -68.63 -47.7 75.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.496 -0.32 . . . . 0.0 110.437 179.64 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 93.4 mt-10 -65.72 -42.05 91.55 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.702 -179.552 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 48.1 mt -68.3 -41.33 81.1 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.949 -0.3 . . . . 0.0 111.639 -178.582 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . 0.478 ' CG ' HG23 ' A' ' 14' ' ' ILE . 1.8 m-80 -68.91 -40.56 79.04 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.445 -0.502 . . . . 0.0 110.709 -179.871 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 2.1 tp -56.23 -47.29 78.74 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.781 0.324 . . . . 0.0 110.348 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . 0.582 ' O ' ' N ' ' A' ' 109' ' ' GLU . . . 64.66 94.67 0.02 OUTLIER Glycine 0 CA--C 1.523 0.565 0 N-CA-C 110.508 -1.037 . . . . 0.0 110.508 -179.855 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -44.37 86.3 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.844 0.354 . . . . 0.0 110.824 -179.805 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . 0.582 ' N ' ' O ' ' A' ' 107' ' ' GLY . 61.3 mt-10 -99.88 -81.14 0.47 Allowed 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.346 179.965 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 25.0 tt0 -174.77 -67.06 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.489 -179.879 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . 0.552 HD12 ' N ' ' A' ' 111' ' ' LEU . 8.1 mp 43.11 49.01 5.48 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.796 179.917 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.405 ' O ' ' O ' ' A' ' 113' ' ' GLU . 0.2 OUTLIER -78.03 74.86 4.57 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.989 0.423 . . . . 0.0 110.145 179.885 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . 0.405 ' O ' ' O ' ' A' ' 112' ' ' LEU . 21.0 tt0 56.39 108.35 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.353 -179.781 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . 0.427 HH11 ' HD2' ' A' ' 114' ' ' ARG . 5.6 ttm180 -109.37 -118.96 0.28 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.877 -179.713 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . 0.425 ' N ' ' HG2' ' A' ' 114' ' ' ARG . 6.0 tp10 -63.16 147.03 52.06 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.026 0.441 . . . . 0.0 110.845 -179.387 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 41.4 mt -67.12 -46.98 72.5 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.319 -179.95 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' ALA . . . . . 0.546 ' O ' ' N ' ' A' ' 121' ' ' SER . . . -59.76 -47.52 85.34 Favored 'General case' 0 C--N 1.332 -0.158 0 N-CA-C 112.849 0.685 . . . . 0.0 112.849 -178.169 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 25.4 mt -55.76 -48.8 74.65 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.267 -0.573 . . . . 0.0 111.362 -177.569 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 14.7 mt -73.56 -50.14 22.8 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 120.185 -0.606 . . . . 0.0 110.693 179.74 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 60.2 t -71.32 -20.29 21.19 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.306 0 N-CA-C 112.6 0.592 . . . . 0.0 112.6 -178.336 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' SER . . . . . 0.546 ' N ' ' O ' ' A' ' 117' ' ' ALA . 10.9 t -64.75 -41.33 95.99 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 119.403 -0.919 . . . . 0.0 110.179 -179.062 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -170.17 161.34 8.39 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.629 -0.428 . . . . 0.0 111.075 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . 0.407 ' CD2' ' C ' ' A' ' 123' ' ' HIS . 0.0 OUTLIER -160.18 158.25 29.77 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.004 -0.544 . . . . 0.0 109.778 179.058 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . 0.45 ' OD1' ' O ' ' A' ' 124' ' ' ASP . 15.0 t0 -160.85 69.38 0.36 Allowed 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 120.815 -0.354 . . . . 0.0 111.215 -178.899 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 . . . . . 0 C--O 1.22 -0.476 0 CA-C-O 117.963 -1.018 . . . . 0.0 110.526 -179.985 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 501' ' ' C2E . . . . . 0.959 ' O21' " H4'" ' A' ' 501' ' ' C2E . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 502' ' ' C2E . . . . . 0.668 ' C81' HH21 ' A' ' 8' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 11.1 mmt . . . . . 0 N--CA 1.491 1.578 0 N-CA-C 109.419 -0.586 . . . . 0.0 109.419 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 29.9 m -98.41 79.11 2.48 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.717 -179.908 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . 0.474 ' C ' ' H ' ' A' ' 5' ' ' HIS . 1.5 p30 -99.62 -30.37 12.16 Favored 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 178.337 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.434 ' CD ' ' O ' ' A' ' 4' ' ' GLN . 0.3 OUTLIER -71.37 7.93 1.2 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.784 -0.644 . . . . 0.0 109.672 179.922 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . 0.474 ' H ' ' C ' ' A' ' 3' ' ' ASP . 24.8 m170 -100.95 28.37 5.32 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.679 -0.691 . . . . 0.0 109.918 179.462 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 50.5 m-20 -41.08 144.05 0.33 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.857 -179.298 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.457 ' OE1' ' N21' ' A' ' 502' ' ' C2E . 4.3 tt0 -80.74 134.14 35.78 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.69 179.938 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.825 ' H ' ' C61' ' A' ' 502' ' ' C2E . 0.0 OUTLIER -121.99 -13.82 8.14 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.451 179.824 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.714 ' O ' ' N ' ' A' ' 11' ' ' PHE . 1.7 mtt180 -96.05 69.54 2.79 Favored 'General case' 0 N--CA 1.469 0.487 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 179.47 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.501 ' C ' ' O ' ' A' ' 9' ' ' ARG . 0.0 OUTLIER 26.31 -79.65 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.836 -179.438 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . 0.714 ' N ' ' O ' ' A' ' 9' ' ' ARG . 0.3 OUTLIER -139.73 142.93 36.81 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 109.893 -0.41 . . . . 0.0 109.893 179.313 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . 0.427 ' C ' ' O ' ' A' ' 11' ' ' PHE . 64.2 m-70 -32.68 151.39 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.468 -179.354 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.448 ' NH1' ' N1 ' ' A' ' 501' ' ' C2E . 24.2 mtm180 -103.3 173.91 6.1 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.558 -179.732 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 40.5 mm -72.25 98.88 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.412 179.786 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -95.58 119.86 34.82 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.33 0.586 . . . . 0.0 111.663 -179.861 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -149.93 154.64 38.62 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.036 -0.983 . . . . 0.0 108.433 177.816 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -95.57 147.03 24.0 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 120.013 -0.675 . . . . 0.0 111.478 -178.328 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.508 ' O ' HD12 ' A' ' 32' ' ' LEU . . . -179.11 176.8 0.85 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.698 -0.683 . . . . 0.0 109.846 179.375 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 22.2 t0 -96.11 134.26 39.39 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.95 -179.737 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.594 ' O ' ' O ' ' A' ' 31' ' ' VAL . 21.5 p -134.37 154.06 51.55 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.135 0.493 . . . . 0.0 110.263 179.002 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 18.7 mt-10 -135.29 143.16 46.08 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 109.041 -0.726 . . . . 0.0 109.041 179.487 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -122.35 136.3 59.64 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 C-N-CA 120.21 -0.596 . . . . 0.0 110.986 -179.023 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.47 ' H ' HD12 ' A' ' 23' ' ' LEU . 0.2 OUTLIER -123.89 123.32 40.17 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.927 -179.44 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.547 ' OE1' ' CZ ' ' A' ' 57' ' ' PHE . 20.6 tt0 -131.15 102.7 6.11 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.32 -0.855 . . . . 0.0 109.635 178.858 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 78.56 -128.38 8.64 Favored Glycine 0 CA--C 1.522 0.524 0 N-CA-C 109.77 -1.332 . . . . 0.0 109.77 -178.94 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -98.89 11.24 39.42 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.675 0.274 . . . . 0.0 110.456 179.612 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.586 ' HB3' ' CZ2' ' A' ' 29' ' ' TRP . 0.6 OUTLIER -111.78 132.5 54.62 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 121.007 0.432 . . . . 0.0 112.011 -179.056 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.417 ' HG2' ' N ' ' A' ' 29' ' ' TRP . 4.5 ttt85 -126.79 147.43 50.01 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.8 -0.637 . . . . 0.0 109.947 178.931 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.623 ' HE1' ' CG ' ' A' ' 48' ' ' ASP . 6.5 m-90 -145.85 155.44 42.9 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.497 -179.0 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.52 ' OE1' ' N ' ' A' ' 30' ' ' GLU . 0.0 OUTLIER -99.33 138.53 36.3 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 178.982 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.594 ' O ' ' O ' ' A' ' 20' ' ' SER . 17.7 m -149.12 157.82 6.67 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-O 121.226 0.536 . . . . 0.0 110.947 -179.335 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.544 HD12 ' N ' ' A' ' 33' ' ' LEU . 8.2 tp -98.24 129.84 44.97 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 107.975 -1.12 . . . . 0.0 107.975 178.511 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.544 ' N ' HD12 ' A' ' 32' ' ' LEU . 1.9 tt -92.17 126.46 37.26 Favored 'General case' 0 C--N 1.325 -0.489 0 C-N-CA 120.271 -0.572 . . . . 0.0 109.61 -179.922 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 73.4 m-70 -90.46 -28.16 18.78 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.428 -0.805 . . . . 0.0 111.732 -178.299 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -172.44 161.46 5.11 Favored 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 119.635 -0.826 . . . . 0.0 111.205 177.578 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.532 HG22 ' H ' ' A' ' 37' ' ' SER . 4.8 p -144.92 168.99 8.57 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.165 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.949 -179.026 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.532 ' H ' HG22 ' A' ' 36' ' ' VAL . 9.4 t -141.88 170.55 15.5 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 107.924 -1.139 . . . . 0.0 107.924 178.717 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.916 HD23 ' O ' ' A' ' 38' ' ' LEU . 4.0 tt -67.13 -1.08 3.85 Favored 'General case' 0 C--N 1.322 -0.611 0 C-N-CA 119.691 -0.804 . . . . 0.0 110.58 -179.243 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . 0.539 ' CE1' ' O ' ' A' ' 87' ' ' CYS . 26.1 t60 -159.86 35.4 0.18 Allowed 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 120.642 -0.423 . . . . 0.0 111.609 179.926 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . 0.466 ' HA3' ' N3 ' ' A' ' 501' ' ' C2E . . . -171.83 155.59 24.17 Favored Glycine 0 CA--C 1.528 0.862 0 N-CA-C 111.135 -0.786 . . . . 0.0 111.135 179.79 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -147.33 149.09 15.89 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.454 0 CA-C-O 121.368 0.604 . . . . 0.0 111.774 -179.182 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -122.7 139.58 53.8 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 115.205 -0.907 . . . . 0.0 109.185 178.984 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.0 m -144.1 175.29 3.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 121.178 0.514 . . . . 0.0 111.709 -179.474 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -97.18 145.47 17.87 Favored Glycine 0 CA--C 1.531 1.073 0 N-CA-C 109.692 -1.363 . . . . 0.0 109.692 178.545 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . 0.541 ' NE2' ' O ' ' A' ' 46' ' ' PRO . 17.9 tm0? -87.65 114.3 58.32 Favored Pre-proline 0 N--CA 1.467 0.411 0 CA-C-N 117.954 0.877 . . . . 0.0 112.06 -178.467 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.541 ' O ' ' NE2' ' A' ' 45' ' ' GLN . 83.7 Cg_endo -84.24 161.5 13.26 Favored 'Trans proline' 0 C--N 1.308 -1.557 0 C-N-CA 121.569 1.513 . . . . 0.0 110.97 178.524 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -65.26 -40.17 93.62 Favored 'General case' 0 N--CA 1.465 0.317 0 N-CA-C 112.7 0.629 . . . . 0.0 112.7 -178.621 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.623 ' CG ' ' HE1' ' A' ' 29' ' ' TRP . 38.5 t0 -73.95 8.84 1.79 Allowed 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 112.068 0.396 . . . . 0.0 112.068 -178.571 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' TRP . . . . . 0.475 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 65.2 t-105 -59.17 69.32 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 111.636 0.235 . . . . 0.0 111.636 -179.781 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.547 ' N ' ' O ' ' A' ' 48' ' ' ASP . 0.5 OUTLIER -93.41 78.82 4.4 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 120.203 -0.599 . . . . 0.0 110.019 178.913 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -142.52 159.48 27.22 Favored Glycine 0 CA--C 1.526 0.731 0 N-CA-C 111.22 -0.752 . . . . 0.0 111.22 -179.765 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 45.3 t0 -95.26 109.05 42.85 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-N 115.759 -0.22 . . . . 0.0 111.022 -179.544 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 78.1 Cg_exo -47.27 -22.69 2.59 Favored 'Trans proline' 0 N--CA 1.493 1.485 0 C-N-CA 122.358 2.039 . . . . 0.0 112.077 179.532 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.51 -23.84 53.7 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.285 -179.386 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.487 ' O ' ' CE1' ' A' ' 57' ' ' PHE . 26.6 mtm180 -95.26 155.22 39.1 Favored Pre-proline 0 N--CA 1.463 0.207 0 C-N-CA 120.616 -0.434 . . . . 0.0 110.22 179.635 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . 0.409 ' O ' ' OE1' ' A' ' 24' ' ' GLN . 9.3 Cg_exo -66.92 160.73 45.63 Favored 'Trans proline' 0 N--CA 1.493 1.49 0 C-N-CA 122.685 2.256 . . . . 0.0 113.305 -178.864 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.547 ' CZ ' ' OE1' ' A' ' 24' ' ' GLN . 49.3 m-85 -130.76 155.31 46.86 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 114.851 -1.068 . . . . 0.0 108.937 179.313 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -122.16 139.17 54.06 Favored 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 178.326 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -119.77 137.69 53.8 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 112.217 0.451 . . . . 0.0 112.217 -178.059 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 13.0 mtt180 -123.17 127.6 48.88 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 108.623 -0.88 . . . . 0.0 108.623 177.385 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.478 HD11 ' SD ' ' A' ' 71' ' ' MET . 9.7 mt -109.39 150.98 27.25 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.942 0.401 . . . . 0.0 110.757 -178.966 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' TYR . . . . . 0.425 ' CD1' ' N ' ' A' ' 62' ' ' TYR . 20.1 m-85 -132.61 109.68 9.91 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.438 179.73 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.484 ' C ' HD23 ' A' ' 63' ' ' LEU . 1.9 tt -104.55 -82.48 0.51 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.731 -0.668 . . . . 0.0 109.398 179.501 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.471 ' H ' ' HB ' ' A' ' 67' ' ' VAL . . . -78.68 179.01 52.82 Favored Glycine 0 CA--C 1.522 0.497 0 N-CA-C 109.156 -1.578 . . . . 0.0 109.156 178.423 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.698 HD22 ' N ' ' A' ' 65' ' ' LEU . 3.1 mm? -74.22 -33.06 63.25 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 119.827 -0.749 . . . . 0.0 110.118 -179.498 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -101.96 9.32 40.61 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.95 179.929 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.564 ' O ' HG12 ' A' ' 67' ' ' VAL . 8.9 t -106.08 95.91 4.18 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.242 0 CA-C-O 121.309 0.576 . . . . 0.0 111.807 -178.621 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 6.5 tp -113.1 117.46 32.03 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 108.169 -1.049 . . . . 0.0 108.169 178.176 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.502 HG23 ' HB3' ' A' ' 94' ' ' SER . 3.5 mt -111.04 142.92 22.02 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-O 120.97 0.414 . . . . 0.0 110.836 -178.962 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 5.7 ttp180 -128.2 130.97 48.83 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.734 179.572 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . 0.478 ' SD ' HD11 ' A' ' 61' ' ' LEU . 0.0 OUTLIER -139.64 147.4 40.98 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.643 179.846 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -106.38 123.74 48.53 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 107.52 -1.289 . . . . 0.0 107.52 178.257 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.713 HD12 ' CB ' ' A' ' 85' ' ' PHE . 3.8 pt -134.47 162.35 39.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 N-CA-C 113.348 0.87 . . . . 0.0 113.348 -176.923 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 1.9 t -119.0 148.58 42.84 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 114.808 -1.087 . . . . 0.0 108.71 178.251 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.429 ' HA ' ' CD1' ' A' ' 85' ' ' PHE . 2.3 tt -66.46 126.74 29.79 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.569 0.7 . . . . 0.0 110.119 -179.127 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -98.2 -41.39 7.92 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 114.923 -1.035 . . . . 0.0 110.928 178.284 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' TRP . . . . . 0.548 ' CZ3' " H1'" ' A' ' 502' ' ' C2E . 69.2 p-90 -169.59 171.94 7.24 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.096 -179.409 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -149.19 123.13 9.37 Favored 'General case' 0 N--CA 1.465 0.301 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 177.725 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 20.4 ttt-85 -152.91 134.66 14.59 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 119.775 -0.77 . . . . 0.0 113.033 -179.882 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 56.54 46.84 19.78 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 113.372 0.878 . . . . 0.0 113.372 176.586 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 80.82 -25.22 3.53 Favored Glycine 0 CA--C 1.524 0.632 0 C-N-CA 120.485 -0.864 . . . . 0.0 113.082 177.479 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 7.6 mt -89.76 161.41 16.05 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 117.882 0.841 . . . . 0.0 110.825 -178.948 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 54.3 mt -136.37 136.24 39.48 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.278 -179.308 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . 0.545 ' HA3' ' NE1' ' A' ' 77' ' ' TRP . . . -109.61 156.2 15.72 Favored Glycine 0 N--CA 1.451 -0.316 0 N-CA-C 109.294 -1.522 . . . . 0.0 109.294 178.169 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . 0.713 ' CB ' HD12 ' A' ' 73' ' ' ILE . 81.4 m-85 -145.46 143.3 29.94 Favored 'General case' 0 C--N 1.318 -0.788 0 C-N-CA 120.829 -0.348 . . . . 0.0 110.214 -179.655 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.485 ' OE2' ' CD2' ' A' ' 39' ' ' HIS . 14.5 tm-20 -103.37 128.74 50.4 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 179.276 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . 0.539 ' O ' ' CE1' ' A' ' 39' ' ' HIS . 41.0 t -78.28 127.14 31.8 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 112.267 0.469 . . . . 0.0 112.267 -178.236 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -102.98 -27.99 12.28 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.462 179.367 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . 0.558 ' ND1' ' N ' ' A' ' 90' ' ' ILE . 0.0 OUTLIER -160.46 141.28 11.88 Favored 'General case' 0 C--O 1.227 -0.104 0 CA-C-O 121.019 0.438 . . . . 0.0 110.55 179.433 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.558 ' N ' ' ND1' ' A' ' 89' ' ' HIS . 9.3 tt -145.74 141.16 21.99 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.966 -179.843 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 5.5 t0 -54.67 141.9 30.38 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 115.334 -0.848 . . . . 0.0 112.23 -178.248 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.434 ' HA ' HD12 ' A' ' 95' ' ' ILE . 57.3 tp -54.12 -41.97 68.93 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 114.929 -1.032 . . . . 0.0 109.979 -179.704 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -68.89 -41.53 78.15 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 109.558 -0.534 . . . . 0.0 109.558 179.228 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . 0.502 ' HB3' HG23 ' A' ' 69' ' ' ILE . 13.4 m -61.39 -37.3 82.93 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.863 -0.608 . . . . 0.0 109.878 179.325 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . 0.457 ' CG1' HG23 ' A' ' 90' ' ' ILE . 47.6 mt -58.62 -38.03 68.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 115.635 -0.712 . . . . 0.0 110.011 179.74 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -70.86 -37.79 73.11 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 120.266 -0.574 . . . . 0.0 110.686 -179.465 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' HIS . . . . . 0.448 ' O ' ' HB2' ' A' ' 100' ' ' ARG . 73.5 m-70 -66.47 -37.97 86.3 Favored 'General case' 0 C--N 1.326 -0.448 0 C-N-CA 119.657 -0.817 . . . . 0.0 109.235 179.491 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 1.9 mp -67.85 -34.09 76.02 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 177.906 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 15.3 mtp-105 -65.24 -37.1 86.21 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 178.489 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . 0.448 ' HB2' ' O ' ' A' ' 97' ' ' HIS . 2.8 mmt180 -57.59 -37.84 73.88 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.626 178.635 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.428 ' O ' ' OD1' ' A' ' 105' ' ' ASN . 15.6 mt -68.86 -37.4 79.07 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.38 -179.448 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . 0.419 ' O ' ' CB ' ' A' ' 106' ' ' LEU . 72.6 t -68.5 -47.35 77.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.095 -179.909 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -65.14 -44.44 88.63 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.484 -179.248 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.469 ' CD2' ' N ' ' A' ' 104' ' ' LEU . 1.3 mm? -70.93 -42.82 69.34 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.519 -0.309 . . . . 0.0 111.345 -179.282 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . 0.428 ' OD1' ' O ' ' A' ' 101' ' ' LEU . 1.5 m-20 -74.16 -34.68 63.91 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 120.741 -0.384 . . . . 0.0 110.827 -179.554 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.481 ' C ' HD23 ' A' ' 106' ' ' LEU . 6.5 tt -61.69 -23.45 66.11 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.323 179.781 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -52.7 -91.81 0.01 OUTLIER Glycine 0 CA--C 1.522 0.495 0 N-CA-C 110.667 -0.973 . . . . 0.0 110.667 -179.855 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 174.73 38.15 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.913 0.387 . . . . 0.0 110.699 179.851 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -67.21 -75.74 0.09 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.447 179.858 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . 0.484 ' CD ' ' N ' ' A' ' 111' ' ' LEU . 0.0 OUTLIER -51.78 -19.72 1.8 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.942 0.401 . . . . 0.0 110.076 179.779 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . 0.506 ' C ' ' H ' ' A' ' 113' ' ' GLU . 0.5 OUTLIER 68.58 -55.96 0.52 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.667 179.802 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER 72.86 -17.78 0.39 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.215 -179.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . 0.506 ' H ' ' C ' ' A' ' 111' ' ' LEU . 17.1 tt0 47.7 36.83 6.05 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.595 179.902 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . 0.462 ' HA ' HH11 ' A' ' 114' ' ' ARG . 3.7 tpt85 -174.81 155.62 2.13 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.44 179.949 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 16.9 tp10 -168.33 -51.55 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.384 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.424 ' O ' ' HB2' ' A' ' 119' ' ' LEU . 17.2 mt -67.38 -34.12 76.62 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.112 -179.856 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' ALA . . . . . 0.543 ' O ' HG23 ' A' ' 120' ' ' VAL . . . -67.58 -24.29 65.49 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 120.037 -0.665 . . . . 0.0 109.316 -179.608 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.464 ' C ' ' N ' ' A' ' 120' ' ' VAL . 18.1 mt -63.59 -31.01 72.04 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 114.858 -1.065 . . . . 0.0 109.823 178.24 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . 0.505 ' HA ' HD22 ' A' ' 119' ' ' LEU . 0.3 OUTLIER -55.28 -11.27 0.73 Allowed 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 -179.14 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . 0.543 HG23 ' O ' ' A' ' 117' ' ' ALA . 55.6 t -64.74 -8.08 4.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.544 -0.753 . . . . 0.0 109.809 175.307 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 22.1 p -92.64 -22.54 19.4 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.063 -178.92 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -89.33 -102.51 0.09 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.937 0.398 . . . . 0.0 110.346 179.777 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . 0.422 ' ND1' ' C ' ' A' ' 123' ' ' HIS . 0.0 OUTLIER 179.89 150.17 0.36 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.391 179.75 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 6.4 p30 -139.94 35.17 1.95 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.782 0.325 . . . . 0.0 110.556 -179.823 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 25.2 m-20 . . . . . 0 C--O 1.22 -0.456 0 CA-C-O 118.074 -0.965 . . . . 0.0 110.448 -179.833 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 501' ' ' C2E . . . . . 0.58 ' C21' HH21 ' A' ' 8' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 502' ' ' C2E . . . . . 0.825 ' C61' ' H ' ' A' ' 8' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.536 ' O ' ' CB ' ' A' ' 2' ' ' SER . 3.3 mmt . . . . . 0 N--CA 1.491 1.596 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.536 ' CB ' ' O ' ' A' ' 1' ' ' MET . 0.9 OUTLIER 91.67 -6.37 0.23 Allowed 'General case' 0 N--CA 1.463 0.22 0 CA-C-O 120.929 0.395 . . . . 0.0 109.967 -179.277 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -99.8 36.62 1.77 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.863 -0.608 . . . . 0.0 109.73 178.054 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.511 ' O ' ' NH1' ' A' ' 8' ' ' ARG . 2.4 mm100 -114.84 -21.76 9.98 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.493 178.005 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . 0.418 ' O ' ' C ' ' A' ' 6' ' ' ASP . 10.7 m170 -60.76 -4.45 0.97 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.924 0.393 . . . . 0.0 110.094 179.651 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . 0.44 ' H ' ' C ' ' A' ' 4' ' ' GLN . 3.0 m-20 -36.27 143.32 0.07 Allowed 'General case' 0 C--N 1.333 -0.118 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.833 179.673 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.423 ' CD ' ' O ' ' A' ' 121' ' ' SER . 9.4 tt0 -82.17 130.88 35.2 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.65 -179.877 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.754 ' H ' ' C61' ' A' ' 502' ' ' C2E . 0.0 OUTLIER -124.51 -8.65 7.44 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.662 -179.609 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.822 ' O ' ' N ' ' A' ' 11' ' ' PHE . 3.6 mtt180 -99.05 75.98 2.08 Favored 'General case' 0 N--CA 1.464 0.232 0 N-CA-C 109.91 -0.404 . . . . 0.0 109.91 179.963 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.54 ' C ' ' O ' ' A' ' 9' ' ' ARG . 0.0 OUTLIER 16.74 -68.91 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.63 0 O-C-N 123.858 0.724 . . . . 0.0 111.427 -179.441 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . 0.822 ' N ' ' O ' ' A' ' 9' ' ' ARG . 0.1 OUTLIER -135.48 141.44 45.34 Favored 'General case' 0 CA--C 1.53 0.207 0 N-CA-C 109.751 -0.463 . . . . 0.0 109.751 179.615 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 5.8 p80 -41.01 151.29 0.06 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.824 0.345 . . . . 0.0 111.03 -179.652 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.706 HH12 ' NH1' ' A' ' 9' ' ' ARG . 3.4 mtm-85 -97.19 -172.13 2.36 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.498 -179.82 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 42.2 mm -94.82 98.05 7.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.887 -179.684 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -93.75 120.39 33.96 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.315 0.579 . . . . 0.0 111.19 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 2.3 p90 -149.76 157.66 43.42 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.164 -0.926 . . . . 0.0 108.683 178.045 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -95.6 146.21 24.65 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 120.343 -0.543 . . . . 0.0 110.502 -179.472 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . 179.32 174.45 0.76 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.367 179.703 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -96.15 133.84 39.94 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.544 179.924 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.531 ' O ' ' O ' ' A' ' 31' ' ' VAL . 3.3 p -134.64 154.11 51.66 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.976 0.417 . . . . 0.0 110.18 179.076 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -132.93 143.67 49.63 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.172 -0.677 . . . . 0.0 109.172 179.427 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 53.3 mt -124.33 136.41 60.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 C-N-CA 120.176 -0.61 . . . . 0.0 111.184 -179.477 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.596 ' H ' HD12 ' A' ' 23' ' ' LEU . 0.0 OUTLIER -121.11 123.39 42.2 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.659 -179.34 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.607 HE22 ' N ' ' A' ' 52' ' ' ASP . 3.4 tt0 -130.78 101.9 5.86 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.135 -0.939 . . . . 0.0 109.551 179.361 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 78.37 -129.08 9.1 Favored Glycine 0 CA--C 1.523 0.553 0 N-CA-C 109.785 -1.326 . . . . 0.0 109.785 -178.668 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 19.2 pt-20 -98.81 11.49 38.56 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.903 0.382 . . . . 0.0 110.21 179.367 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.486 ' HB3' ' CZ2' ' A' ' 29' ' ' TRP . 1.1 mpt_? -112.42 133.79 54.31 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.074 -0.512 . . . . 0.0 112.01 -178.922 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 17.2 ttt180 -127.12 149.58 49.88 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.873 -0.603 . . . . 0.0 109.764 178.777 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.566 ' NE1' ' O ' ' A' ' 48' ' ' ASP . 6.1 m-90 -147.74 156.45 42.76 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.769 -178.927 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 78.1 mt-10 -99.3 131.3 45.42 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.693 -0.685 . . . . 0.0 109.212 178.81 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.531 ' O ' ' O ' ' A' ' 20' ' ' SER . 14.4 m -137.15 154.7 31.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-O 121.256 0.551 . . . . 0.0 111.214 -179.504 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 13.0 tp -95.23 126.57 40.64 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 108.531 -0.914 . . . . 0.0 108.531 178.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.471 ' HG ' ' N ' ' A' ' 34' ' ' HIS . 2.3 tt -83.02 150.75 26.15 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 179.631 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' HIS . . . . . 0.471 ' N ' ' HG ' ' A' ' 33' ' ' LEU . 64.7 m-70 -123.01 -28.33 4.08 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.155 179.604 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.543 ' CG ' HH21 ' A' ' 13' ' ' ARG . 2.3 p30 -173.83 160.62 3.65 Favored 'General case' 0 C--N 1.327 -0.413 0 C-N-CA 119.802 -0.759 . . . . 0.0 111.109 176.953 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.538 HG22 ' N ' ' A' ' 37' ' ' SER . 6.5 p -145.24 169.08 7.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.146 -179.06 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.538 ' N ' HG22 ' A' ' 36' ' ' VAL . 29.8 t -142.17 167.68 21.55 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 107.985 -1.117 . . . . 0.0 107.985 178.6 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 2.7 pp -62.99 -0.16 0.65 Allowed 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 119.758 -0.777 . . . . 0.0 110.963 -179.157 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . 0.427 ' H ' ' C ' ' A' ' 37' ' ' SER . 0.4 OUTLIER -165.61 43.04 0.07 Allowed 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 120.793 -0.363 . . . . 0.0 111.467 -179.91 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . 0.428 ' HA3' ' N3 ' ' A' ' 501' ' ' C2E . . . -178.85 154.95 15.09 Favored Glycine 0 CA--C 1.528 0.881 0 N-CA-C 110.816 -0.914 . . . . 0.0 110.816 179.812 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.426 ' CG2' HG21 ' A' ' 73' ' ' ILE . 0.1 OUTLIER -148.21 148.77 15.84 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.238 0 CA-C-O 121.469 0.652 . . . . 0.0 111.873 -178.9 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.458 HD23 ' N ' ' A' ' 43' ' ' VAL . 0.9 OUTLIER -120.79 132.42 55.02 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 114.813 -1.085 . . . . 0.0 108.187 178.355 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.458 ' N ' HD23 ' A' ' 42' ' ' LEU . 5.4 m -139.26 175.9 6.88 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-O 121.368 0.604 . . . . 0.0 111.821 -178.737 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -98.0 143.87 16.94 Favored Glycine 0 CA--C 1.529 0.968 0 N-CA-C 109.758 -1.337 . . . . 0.0 109.758 178.148 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . 0.483 ' O ' ' OE1' ' A' ' 45' ' ' GLN . 1.7 tm0? -85.78 117.73 69.26 Favored Pre-proline 0 N--CA 1.466 0.345 0 CA-C-N 117.625 0.713 . . . . 0.0 111.686 -178.78 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_endo -86.79 161.76 9.1 Favored 'Trans proline' 0 C--N 1.311 -1.446 0 C-N-CA 121.628 1.552 . . . . 0.0 111.037 178.687 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.579 ' CD ' ' H ' ' A' ' 47' ' ' GLN . 1.2 mp0 -65.49 -40.63 93.31 Favored 'General case' 0 N--CA 1.467 0.407 0 N-CA-C 112.604 0.594 . . . . 0.0 112.604 -178.877 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.566 ' O ' ' NE1' ' A' ' 29' ' ' TRP . 1.2 m-20 -72.2 8.56 1.27 Allowed 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 111.866 0.321 . . . . 0.0 111.866 -178.371 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' TRP . . . . . 0.463 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 63.5 t-105 -60.13 68.9 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.55 -0.295 . . . . 0.0 111.717 -179.521 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.551 ' C ' HD22 ' A' ' 50' ' ' ASN . 0.7 OUTLIER -93.35 78.76 4.44 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 120.074 -0.651 . . . . 0.0 109.806 178.737 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . 0.474 ' CA ' HE22 ' A' ' 24' ' ' GLN . . . -143.93 151.22 23.19 Favored Glycine 0 CA--C 1.525 0.707 0 N-CA-C 110.896 -0.882 . . . . 0.0 110.896 -179.729 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . 0.607 ' N ' HE22 ' A' ' 24' ' ' GLN . 11.0 t0 -88.17 114.18 58.29 Favored Pre-proline 0 CA--C 1.536 0.415 0 CA-C-O 120.339 0.114 . . . . 0.0 111.014 -179.677 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_exo -46.93 -22.42 2.0 Favored 'Trans proline' 0 N--CA 1.497 1.694 0 C-N-CA 122.735 2.29 . . . . 0.0 112.671 179.618 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -78.27 -24.12 46.94 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 120.571 -0.452 . . . . 0.0 111.894 -178.632 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.553 ' O ' ' CE1' ' A' ' 57' ' ' PHE . 12.7 mtp85 -93.9 152.59 40.69 Favored Pre-proline 0 C--N 1.33 -0.247 0 C-N-CA 120.598 -0.441 . . . . 0.0 110.177 179.839 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_endo -65.01 160.57 40.89 Favored 'Trans proline' 0 N--CA 1.495 1.565 0 C-N-CA 122.734 2.289 . . . . 0.0 112.93 -178.912 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.553 ' CE1' ' O ' ' A' ' 55' ' ' ARG . 43.1 m-85 -130.41 156.43 44.76 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.094 -0.957 . . . . 0.0 109.17 179.469 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.428 ' O ' HD12 ' A' ' 23' ' ' LEU . 35.8 mt-10 -123.1 136.8 54.95 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 178.357 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . 0.602 ' HB2' ' CD1' ' A' ' 73' ' ' ILE . . . -116.66 136.08 53.26 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.097 0.475 . . . . 0.0 111.931 -178.152 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 16.1 mmm-85 -123.02 127.56 48.95 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 177.864 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 6.9 mt -105.99 151.06 25.1 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.063 0.458 . . . . 0.0 111.243 -178.43 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' TYR . . . . . 0.478 ' CD1' ' N ' ' A' ' 62' ' ' TYR . 13.6 m-85 -135.88 108.9 7.66 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.002 179.291 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -105.34 -81.3 0.54 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.681 -0.69 . . . . 0.0 109.589 179.911 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.472 ' H ' ' HB ' ' A' ' 67' ' ' VAL . . . -78.82 -176.44 47.93 Favored Glycine 0 CA--C 1.521 0.428 0 N-CA-C 109.254 -1.538 . . . . 0.0 109.254 178.421 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.616 ' H ' HD23 ' A' ' 65' ' ' LEU . 0.3 OUTLIER -76.39 -33.34 58.88 Favored 'General case' 0 C--N 1.329 -0.326 0 C-N-CA 119.918 -0.713 . . . . 0.0 110.59 -179.62 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.41 ' OD1' ' O ' ' A' ' 66' ' ' ASP . 48.2 t0 -103.06 9.21 38.64 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 122.753 0.421 . . . . 0.0 111.075 -179.789 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.472 ' HB ' ' H ' ' A' ' 64' ' ' GLY . 28.7 t -103.33 95.21 3.66 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.249 0 CA-C-O 121.288 0.566 . . . . 0.0 111.698 -178.652 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.661 HD12 ' N ' ' A' ' 69' ' ' ILE . 1.3 tp -114.2 117.6 31.65 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 178.917 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.661 ' N ' HD12 ' A' ' 68' ' ' LEU . 18.7 mm -113.15 145.24 19.35 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.252 0 CA-C-O 121.012 0.434 . . . . 0.0 111.726 -178.422 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 3.2 ptm180 -128.51 133.42 48.44 Favored 'General case' 0 C--O 1.239 0.502 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.078 179.133 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -146.16 150.42 35.84 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.273 -0.876 . . . . 0.0 110.144 -179.765 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -103.81 128.2 51.25 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 107.851 -1.166 . . . . 0.0 107.851 178.335 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.602 ' CD1' ' HB2' ' A' ' 59' ' ' ALA . 14.5 pt -135.97 156.98 38.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 C-N-CA 119.995 -0.682 . . . . 0.0 112.757 -177.594 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 31.3 t -122.41 151.35 41.34 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 114.781 -1.1 . . . . 0.0 109.903 179.195 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.56 HD12 ' CE1' ' A' ' 85' ' ' PHE . 7.1 tp -66.21 121.2 14.66 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.184 0.516 . . . . 0.0 110.365 -179.68 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -97.57 -42.57 7.62 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 115.454 -0.793 . . . . 0.0 110.522 178.175 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' TRP . . . . . 0.586 ' NE1' ' HA3' ' A' ' 84' ' ' GLY . 66.8 p-90 -168.52 167.37 11.69 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 115.419 -0.809 . . . . 0.0 110.084 -179.357 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -147.51 123.77 10.89 Favored 'General case' 0 N--CA 1.465 0.325 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 178.612 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 33.9 ttt85 -152.4 134.29 14.81 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 119.789 -0.764 . . . . 0.0 113.043 179.87 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 57.05 47.3 17.7 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 113.781 1.03 . . . . 0.0 113.781 176.839 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 82.78 -27.48 3.82 Favored Glycine 0 CA--C 1.522 0.495 0 C-N-CA 120.292 -0.956 . . . . 0.0 113.28 177.075 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 3.9 mt -89.67 158.85 17.4 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 117.744 0.772 . . . . 0.0 110.153 -179.096 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 63.4 mt -130.68 135.44 47.83 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.387 -179.119 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . 0.586 ' HA3' ' NE1' ' A' ' 77' ' ' TRP . . . -93.93 151.69 20.38 Favored Glycine 0 N--CA 1.448 -0.561 0 N-CA-C 109.477 -1.449 . . . . 0.0 109.477 178.434 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . 0.56 ' CE1' HD12 ' A' ' 75' ' ' LEU . 26.8 m-85 -145.81 131.3 18.73 Favored 'General case' 0 C--N 1.317 -0.823 0 C-N-CA 120.647 -0.421 . . . . 0.0 110.692 -179.234 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.527 ' OE1' ' NE2' ' A' ' 88' ' ' GLN . 4.0 tt0 -103.76 127.56 51.23 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 179.664 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . 0.531 ' HA ' HG22 ' A' ' 73' ' ' ILE . 4.9 t -70.67 122.77 20.42 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.929 0.395 . . . . 0.0 111.907 -178.616 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . 0.527 ' NE2' ' OE1' ' A' ' 86' ' ' GLU . 32.0 mm-40 -94.74 -32.43 13.33 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.898 -0.592 . . . . 0.0 109.774 179.16 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . 0.498 ' ND1' ' N ' ' A' ' 90' ' ' ILE . 0.0 OUTLIER -163.38 143.72 8.93 Favored 'General case' 0 C--O 1.223 -0.316 0 CA-C-N 115.74 -0.664 . . . . 0.0 109.984 179.751 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.498 ' N ' ' ND1' ' A' ' 89' ' ' HIS . 10.7 tt -144.89 141.06 23.32 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-O 121.379 0.609 . . . . 0.0 109.918 -179.83 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . 0.553 ' O ' ' OG ' ' A' ' 94' ' ' SER . 4.7 t0 -56.43 142.11 39.8 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-N 115.209 -0.905 . . . . 0.0 112.1 -177.903 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 3.7 tp -54.44 -41.56 69.55 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 114.885 -1.052 . . . . 0.0 109.895 -179.635 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -70.51 -37.71 74.2 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.208 179.45 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . 0.553 ' OG ' ' O ' ' A' ' 91' ' ' ASP . 2.2 p -63.16 -35.18 79.44 Favored 'General case' 0 C--N 1.333 -0.149 0 N-CA-C 109.841 -0.429 . . . . 0.0 109.841 179.706 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 36.2 mt -62.08 -39.16 82.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.209 179.539 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -70.53 -42.73 70.83 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.386 -0.526 . . . . 0.0 111.785 -178.371 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' HIS . . . . . 0.488 ' O ' ' HB2' ' A' ' 100' ' ' ARG . 57.4 m-70 -62.7 -40.17 96.31 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 119.153 -1.019 . . . . 0.0 109.264 -179.778 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 3.4 tp -66.46 -33.61 76.09 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 177.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 11.3 mtt-85 -57.74 -35.76 71.15 Favored 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 119.871 -0.732 . . . . 0.0 109.439 178.385 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . 0.488 ' HB2' ' O ' ' A' ' 97' ' ' HIS . 11.2 mmt180 -58.39 -47.69 83.04 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 121.178 0.513 . . . . 0.0 110.596 178.973 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -66.84 -34.35 77.62 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.381 -179.803 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 71.8 t -68.63 -47.06 78.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-O 120.929 0.395 . . . . 0.0 110.555 179.512 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.2 tm-20 -65.42 -42.63 92.29 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.386 -179.436 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 28.2 mt -65.04 -42.38 94.34 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 120.796 -0.362 . . . . 0.0 110.487 -179.714 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 49.8 m-80 -74.59 -50.79 16.57 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.21 179.399 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 52.0 tp -57.6 -18.69 21.27 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 179.398 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -91.67 140.82 15.37 Favored Glycine 0 CA--C 1.52 0.378 0 N-CA-C 110.711 -0.955 . . . . 0.0 110.711 179.875 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -93.33 150.07 20.75 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 120.92 -0.312 . . . . 0.0 110.458 -179.927 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 16.6 tt0 -89.79 -142.16 0.15 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.263 179.973 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . 0.408 ' O ' ' CD ' ' A' ' 110' ' ' GLU . 2.2 tm-20 -66.55 -34.59 78.25 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.354 179.79 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . 0.588 HD23 ' N ' ' A' ' 112' ' ' LEU . 0.8 OUTLIER -48.23 136.0 12.65 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.382 179.942 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.588 ' N ' HD23 ' A' ' 111' ' ' LEU . 3.7 mt -38.82 129.58 1.51 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.743 179.996 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 9.7 mt-10 -76.75 134.61 39.11 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.193 179.72 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . 0.578 ' C ' ' H ' ' A' ' 116' ' ' LEU . 2.8 ttm180 -146.11 -76.56 0.2 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.745 -179.958 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 62.6 tt0 63.48 -9.0 0.14 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.079 0.466 . . . . 0.0 110.397 -179.921 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.578 ' H ' ' C ' ' A' ' 114' ' ' ARG . 55.3 tp -67.6 -35.67 79.41 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.877 -0.601 . . . . 0.0 112.531 -179.096 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -62.77 -23.02 67.0 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.26 -0.576 . . . . 0.0 110.826 -177.854 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.433 ' O ' ' CB ' ' A' ' 121' ' ' SER . 13.0 mt -58.54 -32.89 69.31 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.234 -0.894 . . . . 0.0 109.546 178.47 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -56.92 -43.6 81.61 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 107.926 -1.139 . . . . 0.0 107.926 179.708 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 20.1 t -57.39 -9.71 0.87 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 178.199 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' SER . . . . . 0.607 ' O ' ' HB2' ' A' ' 122' ' ' ALA . 1.0 OUTLIER -87.49 22.05 2.32 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 178.052 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . 0.607 ' HB2' ' O ' ' A' ' 121' ' ' SER . . . 164.94 -162.65 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.236 -0.893 . . . . 0.0 109.908 -179.736 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . 0.644 ' CG ' ' N ' ' A' ' 124' ' ' ASP . 0.0 OUTLIER 76.95 -52.04 0.57 Allowed 'General case' 0 C--N 1.333 -0.114 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 -178.883 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . 0.644 ' N ' ' CG ' ' A' ' 123' ' ' HIS . 24.3 m-20 2.32 84.41 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 115.747 -0.66 . . . . 0.0 112.026 179.656 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 17.7 p-10 . . . . . 0 C--O 1.221 -0.447 0 CA-C-O 118.042 -0.98 . . . . 0.0 110.415 179.786 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 501' ' ' C2E . . . . . 0.562 ' N71' ' CG ' ' A' ' 9' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 502' ' ' C2E . . . . . 0.754 ' C61' ' H ' ' A' ' 8' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.557 ' O ' ' CB ' ' A' ' 2' ' ' SER . 5.6 mmt . . . . . 0 N--CA 1.491 1.595 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.557 ' CB ' ' O ' ' A' ' 1' ' ' MET . 6.6 p 92.2 34.0 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.395 -179.526 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 10.1 p30 -100.07 22.11 11.81 Favored 'General case' 0 C--N 1.332 -0.179 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 177.73 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.472 ' C ' ' H ' ' A' ' 6' ' ' ASP . 0.0 OUTLIER -113.84 -21.6 10.58 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 115.531 -0.759 . . . . 0.0 109.9 178.395 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . 0.418 ' O ' ' C ' ' A' ' 6' ' ' ASP . 32.1 m170 -66.69 3.95 0.91 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.102 179.305 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . 0.472 ' H ' ' C ' ' A' ' 4' ' ' GLN . 42.5 m-20 -37.77 147.05 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.123 179.961 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -80.4 134.2 35.98 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.149 0.5 . . . . 0.0 110.998 -179.358 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.619 HH21 ' C21' ' A' ' 501' ' ' C2E . 0.0 OUTLIER -121.27 -13.73 8.44 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.732 -179.952 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.751 ' O ' ' N ' ' A' ' 11' ' ' PHE . 3.8 ptt85 -110.19 69.63 0.7 Allowed 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 121.104 0.478 . . . . 0.0 109.938 179.794 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.611 ' CG ' HH11 ' A' ' 10' ' ' ARG . 0.0 OUTLIER 37.78 -72.65 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.044 -0.98 . . . . 0.0 111.799 -179.865 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . 0.751 ' N ' ' O ' ' A' ' 9' ' ' ARG . 6.0 m-85 -148.23 170.31 18.15 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 120.824 0.345 . . . . 0.0 110.571 -179.613 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . 0.486 ' CD2' HD22 ' A' ' 118' ' ' LEU . 0.6 OUTLIER -61.81 141.58 57.84 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.298 179.795 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.742 ' HE ' ' H ' ' A' ' 13' ' ' ARG . 0.5 OUTLIER -88.4 -174.38 4.58 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.592 -179.69 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.782 ' N ' HD12 ' A' ' 14' ' ' ILE . 1.9 mp -81.12 97.6 3.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.276 179.778 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -93.0 120.57 33.43 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.297 0.57 . . . . 0.0 111.402 -179.524 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 2.0 p90 -149.68 157.06 42.88 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.135 -0.939 . . . . 0.0 108.565 178.134 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -95.55 147.22 23.8 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 120.341 -0.544 . . . . 0.0 110.62 -179.223 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . 178.94 176.2 0.57 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.241 179.795 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -96.43 134.51 39.51 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.933 -179.608 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.654 ' O ' ' O ' ' A' ' 31' ' ' VAL . 11.5 p -136.48 159.93 40.29 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.07 179.092 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.474 ' OE2' HD21 ' A' ' 23' ' ' LEU . 0.3 OUTLIER -148.29 145.2 28.07 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 108.717 -0.845 . . . . 0.0 108.717 178.772 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.471 ' N ' ' OE1' ' A' ' 21' ' ' GLU . 61.6 mt -119.58 136.73 55.77 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.323 0 CA-C-O 121.237 0.542 . . . . 0.0 112.056 -177.776 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.758 ' H ' HD12 ' A' ' 23' ' ' LEU . 0.0 OUTLIER -117.8 123.24 45.46 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.492 -0.776 . . . . 0.0 110.443 179.678 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.433 ' HG3' ' O ' ' A' ' 56' ' ' PRO . 38.1 tt0 -129.26 101.42 5.99 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.446 -0.797 . . . . 0.0 109.823 179.101 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 78.09 -126.78 7.84 Favored Glycine 0 CA--C 1.521 0.418 0 N-CA-C 109.877 -1.289 . . . . 0.0 109.877 -179.089 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.457 ' OE1' ' O ' ' A' ' 26' ' ' GLU . 0.0 OUTLIER -100.24 9.82 42.16 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.894 0.378 . . . . 0.0 110.084 179.53 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.496 ' HB3' ' CZ2' ' A' ' 29' ' ' TRP . 36.7 mtt85 -112.37 134.62 53.81 Favored 'General case' 0 CA--C 1.521 -0.15 0 CA-C-N 116.06 -0.518 . . . . 0.0 112.066 -178.806 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.405 ' HG2' ' N ' ' A' ' 29' ' ' TRP . 60.1 ttt-85 -129.24 150.15 50.74 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.346 179.852 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.528 ' NE1' ' O ' ' A' ' 48' ' ' ASP . 6.5 m-90 -147.49 155.01 41.48 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.171 -179.169 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.608 ' CD ' ' H ' ' A' ' 30' ' ' GLU . 1.4 mp0 -101.23 140.32 35.69 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 179.517 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.654 ' O ' ' O ' ' A' ' 20' ' ' SER . 18.9 m -148.89 157.11 7.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-O 121.149 0.499 . . . . 0.0 111.121 -179.466 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 1.093 ' H ' HD23 ' A' ' 32' ' ' LEU . 1.2 pt? -95.71 129.82 42.81 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 108.456 -0.942 . . . . 0.0 108.456 178.294 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.423 HD13 HD21 ' A' ' 61' ' ' LEU . 1.4 tt -93.57 126.11 38.54 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.403 0.62 . . . . 0.0 110.239 -179.255 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 50.2 m-70 -90.65 -25.75 19.95 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.009 -0.996 . . . . 0.0 111.863 -178.375 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -175.2 161.78 2.89 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 119.721 -0.792 . . . . 0.0 111.341 177.78 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.528 HG22 ' H ' ' A' ' 37' ' ' SER . 4.3 p -143.42 168.37 12.47 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.157 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.871 -179.472 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.528 ' H ' HG22 ' A' ' 36' ' ' VAL . 25.3 t -142.92 167.06 22.97 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 107.789 -1.189 . . . . 0.0 107.789 178.399 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.488 ' C ' ' CG ' ' A' ' 39' ' ' HIS . 1.0 OUTLIER -63.28 -1.32 1.04 Allowed 'General case' 0 C--N 1.322 -0.588 0 C-N-CA 119.602 -0.839 . . . . 0.0 110.31 -179.811 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . 0.488 ' CG ' ' C ' ' A' ' 38' ' ' LEU . 0.0 OUTLIER -163.3 46.31 0.13 Allowed 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 120.713 -0.395 . . . . 0.0 111.301 179.995 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 177.14 153.58 11.05 Favored Glycine 0 CA--C 1.528 0.86 0 N-CA-C 111.221 -0.752 . . . . 0.0 111.221 179.568 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -148.77 149.36 15.08 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.255 0 CA-C-O 121.33 0.586 . . . . 0.0 111.64 -179.198 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -121.18 136.47 54.97 Favored 'General case' 0 N--CA 1.464 0.27 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 178.685 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 19.3 m -140.22 175.29 6.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 C-N-CA 120.226 -0.589 . . . . 0.0 111.887 -179.561 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -97.3 144.36 17.28 Favored Glycine 0 CA--C 1.527 0.829 0 N-CA-C 109.247 -1.541 . . . . 0.0 109.247 177.938 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 60.4 tt0 -86.82 114.66 59.23 Favored Pre-proline 0 N--CA 1.466 0.349 0 CA-C-N 117.938 0.869 . . . . 0.0 111.839 -178.504 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 93.8 Cg_endo -84.85 162.7 12.03 Favored 'Trans proline' 0 C--N 1.31 -1.488 0 C-N-CA 121.81 1.674 . . . . 0.0 111.774 178.938 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.705 ' NE2' ' H ' ' A' ' 48' ' ' ASP . 0.4 OUTLIER -65.54 -40.1 92.5 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 112.438 0.532 . . . . 0.0 112.438 -178.981 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.705 ' H ' ' NE2' ' A' ' 47' ' ' GLN . 37.6 m-20 -74.21 8.79 1.93 Allowed 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 111.895 0.331 . . . . 0.0 111.895 -178.645 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' TRP . . . . . 0.48 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 62.3 t-105 -60.79 69.01 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 112.006 0.373 . . . . 0.0 112.006 -179.525 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.579 HD22 ' C ' ' A' ' 50' ' ' ASN . 0.2 OUTLIER -92.96 80.07 4.61 Favored 'General case' 0 C--N 1.326 -0.43 0 C-N-CA 119.84 -0.744 . . . . 0.0 109.439 178.476 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -143.17 146.08 16.53 Favored Glycine 0 CA--C 1.524 0.596 0 N-CA-C 111.341 -0.703 . . . . 0.0 111.341 -179.301 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 53.9 t0 -84.42 113.95 51.92 Favored Pre-proline 0 CA--C 1.533 0.305 0 CA-C-N 115.96 -0.12 . . . . 0.0 110.705 179.817 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_exo -48.0 -22.33 3.41 Favored 'Trans proline' 0 N--CA 1.497 1.716 0 C-N-CA 122.517 2.144 . . . . 0.0 112.194 179.854 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 34.5 mm-40 -77.63 -24.11 49.6 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.132 -0.485 . . . . 0.0 112.044 -178.703 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.564 ' O ' ' CE1' ' A' ' 57' ' ' PHE . 39.1 mtp85 -95.15 151.64 38.91 Favored Pre-proline 0 N--CA 1.464 0.245 0 C-N-CA 120.573 -0.451 . . . . 0.0 110.436 -179.703 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . 0.433 ' O ' ' HG3' ' A' ' 24' ' ' GLN . 38.3 Cg_endo -65.59 161.09 40.09 Favored 'Trans proline' 0 N--CA 1.498 1.751 0 C-N-CA 123.156 2.571 . . . . 0.0 113.072 -178.855 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.564 ' CE1' ' O ' ' A' ' 55' ' ' ARG . 42.7 m-85 -131.59 156.29 46.04 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.344 -0.843 . . . . 0.0 109.572 179.587 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.508 ' O ' HD12 ' A' ' 23' ' ' LEU . 29.2 mt-10 -120.35 133.95 55.35 Favored 'General case' 0 N--CA 1.469 0.475 0 N-CA-C 108.913 -0.773 . . . . 0.0 108.913 178.043 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . 0.687 ' HB2' HD11 ' A' ' 73' ' ' ILE . . . -114.36 136.28 53.16 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.149 0.5 . . . . 0.0 111.998 -178.332 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.663 ' HG3' HD11 ' A' ' 23' ' ' LEU . 12.1 mmt180 -123.12 127.86 49.29 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 108.352 -0.981 . . . . 0.0 108.352 177.644 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.568 HD12 ' C ' ' A' ' 60' ' ' ARG . 10.7 mp -108.16 147.14 31.7 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 120.33 -0.548 . . . . 0.0 110.683 -179.316 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' TYR . . . . . 0.513 ' CD1' ' N ' ' A' ' 62' ' ' TYR . 4.2 m-85 -130.6 111.1 11.91 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.353 179.77 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 1.8 tt -106.57 -79.33 0.57 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.852 -0.613 . . . . 0.0 109.938 179.781 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.451 ' H ' ' HB ' ' A' ' 67' ' ' VAL . . . -80.99 -177.33 51.58 Favored Glycine 0 CA--C 1.52 0.404 0 N-CA-C 109.372 -1.491 . . . . 0.0 109.372 178.643 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 12.1 mt -76.07 -32.62 59.35 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 119.725 -0.79 . . . . 0.0 110.452 -179.441 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -104.16 8.91 36.38 Favored 'General case' 0 C--N 1.332 -0.185 0 C-N-CA 122.656 0.382 . . . . 0.0 111.222 -179.825 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.451 ' HB ' ' H ' ' A' ' 64' ' ' GLY . 37.6 t -104.8 96.29 4.48 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.294 0 CA-C-O 121.37 0.605 . . . . 0.0 111.654 -179.072 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.503 HD12 ' N ' ' A' ' 69' ' ' ILE . 3.1 tp -116.06 117.52 30.33 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 107.95 -1.13 . . . . 0.0 107.95 178.659 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.503 ' N ' HD12 ' A' ' 68' ' ' LEU . 20.9 mm -111.8 146.3 16.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.639 -178.29 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.426 ' C ' ' HG2' ' A' ' 71' ' ' MET . 0.0 OUTLIER -128.36 130.49 47.82 Favored 'General case' 0 C--O 1.238 0.481 0 CA-C-O 121.25 0.548 . . . . 0.0 111.134 178.817 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . 0.802 ' SD ' HD12 ' A' ' 90' ' ' ILE . 1.2 mtm -140.66 148.2 40.46 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.494 -0.775 . . . . 0.0 110.002 179.629 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . 0.457 ' OE2' ' O ' ' A' ' 57' ' ' PHE . 10.6 tp10 -100.74 128.47 46.77 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 107.678 -1.23 . . . . 0.0 107.678 178.666 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.687 HD11 ' HB2' ' A' ' 59' ' ' ALA . 9.2 pt -138.83 157.23 29.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 C-N-CA 119.601 -0.84 . . . . 0.0 112.965 -177.644 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -121.82 150.99 41.11 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 114.787 -1.097 . . . . 0.0 109.613 178.765 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.526 HD12 ' CE1' ' A' ' 85' ' ' PHE . 7.3 tp -66.48 123.46 20.08 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.425 0.631 . . . . 0.0 110.457 -179.666 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -98.18 -43.63 6.92 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 114.959 -1.019 . . . . 0.0 111.115 178.168 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' TRP . . . . . 0.589 ' NE1' ' HA3' ' A' ' 84' ' ' GLY . 68.7 p-90 -167.56 171.21 10.52 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.436 -179.124 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -151.09 123.87 8.58 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 116.541 -0.3 . . . . 0.0 110.305 178.776 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 8.1 ttt85 -152.33 133.6 14.38 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 112.821 0.674 . . . . 0.0 112.821 179.494 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . 0.414 ' O ' ' OD1' ' A' ' 80' ' ' ASP . 8.3 t70 56.4 47.41 19.02 Favored 'General case' 0 N--CA 1.464 0.26 0 N-CA-C 113.528 0.936 . . . . 0.0 113.528 176.506 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 69.43 12.72 66.93 Favored Glycine 0 CA--C 1.523 0.558 0 C-N-CA 120.305 -0.95 . . . . 0.0 111.931 178.188 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 49.5 mt -117.65 139.67 50.7 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 108.739 -0.837 . . . . 0.0 108.739 178.665 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 44.9 mt -122.72 135.06 54.46 Favored 'General case' 0 CA--C 1.513 -0.455 0 C-N-CA 120.359 -0.536 . . . . 0.0 111.179 -179.311 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . 0.589 ' HA3' ' NE1' ' A' ' 77' ' ' TRP . . . -97.81 153.63 20.14 Favored Glycine 0 N--CA 1.448 -0.558 0 N-CA-C 109.474 -1.451 . . . . 0.0 109.474 178.868 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . 0.537 ' CG ' HD12 ' A' ' 73' ' ' ILE . 27.8 m-85 -145.44 132.16 19.99 Favored 'General case' 0 C--N 1.314 -0.966 0 C-N-CA 120.788 -0.365 . . . . 0.0 110.668 -179.183 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 55.9 tt0 -103.92 127.88 51.44 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 179.726 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . 0.519 ' HA ' HG22 ' A' ' 73' ' ' ILE . 0.5 OUTLIER -76.62 125.86 29.98 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.065 0.459 . . . . 0.0 111.626 -178.715 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -103.46 -29.26 11.29 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.236 179.701 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . 0.459 ' ND1' ' C ' ' A' ' 89' ' ' HIS . 0.0 OUTLIER -160.35 141.2 11.97 Favored 'General case' 0 C--O 1.223 -0.318 0 CA-C-O 120.947 0.403 . . . . 0.0 110.462 179.542 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.802 HD12 ' SD ' ' A' ' 71' ' ' MET . 7.5 tt -146.01 141.06 21.6 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.131 -179.619 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -56.75 138.82 52.42 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 115.194 -0.912 . . . . 0.0 111.864 -178.321 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 1.8 tt -54.09 -41.46 68.28 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 115.078 -0.965 . . . . 0.0 110.304 -179.849 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -67.88 -36.1 79.67 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 179.321 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 3.9 m -68.62 -37.39 79.72 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.869 179.355 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . 0.405 ' CG1' HG23 ' A' ' 90' ' ' ILE . 54.7 mt -58.9 -38.75 75.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.721 -179.757 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -70.67 -41.21 72.38 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 120.332 -0.547 . . . . 0.0 111.502 -178.385 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' HIS . . . . . 0.416 ' O ' ' HB2' ' A' ' 100' ' ' ARG . 58.5 m-70 -62.02 -37.58 85.42 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 119.272 -0.971 . . . . 0.0 109.216 179.875 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 6.5 tt -67.66 -34.1 76.26 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 110.059 -0.348 . . . . 0.0 110.059 178.095 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 8.1 mtp85 -59.22 -38.01 78.92 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.255 -0.578 . . . . 0.0 109.467 178.646 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . 0.416 ' HB2' ' O ' ' A' ' 97' ' ' HIS . 3.5 mmt180 -58.06 -45.66 86.68 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.736 178.758 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.449 HD22 ' N ' ' A' ' 101' ' ' LEU . 3.2 mm? -65.31 -37.96 88.71 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.628 -179.415 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . 0.548 ' O ' ' ND2' ' A' ' 105' ' ' ASN . 55.1 t -65.73 -47.55 85.55 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-O 120.941 0.401 . . . . 0.0 110.28 179.838 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 14.8 tm-20 -66.08 -39.27 89.91 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.459 179.803 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 13.8 mt -73.26 -42.53 62.39 Favored 'General case' 0 CA--C 1.532 0.28 0 N-CA-C 112.143 0.423 . . . . 0.0 112.143 -178.327 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . 0.548 ' ND2' ' O ' ' A' ' 102' ' ' VAL . 0.1 OUTLIER -70.61 -37.53 73.87 Favored 'General case' 0 N--CA 1.464 0.274 0 C-N-CA 120.589 -0.444 . . . . 0.0 111.131 -179.137 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 2.2 mt -56.07 -28.47 57.72 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.555 -179.696 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . 0.426 ' O ' ' C ' ' A' ' 108' ' ' ASP . . . 52.15 54.37 26.6 Favored Glycine 0 CA--C 1.523 0.567 0 N-CA-C 110.257 -1.137 . . . . 0.0 110.257 -179.498 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . 0.426 ' C ' ' O ' ' A' ' 107' ' ' GLY . 8.0 t0 -35.69 -69.19 0.11 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.779 0.323 . . . . 0.0 111.018 -179.612 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . 0.443 ' O ' ' OE1' ' A' ' 109' ' ' GLU . 0.0 OUTLIER -71.98 102.18 2.88 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.762 -179.649 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 58.43 -130.64 1.29 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.921 179.646 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . 0.479 ' O ' ' C ' ' A' ' 112' ' ' LEU . 4.0 mm? 59.04 94.8 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.384 -179.78 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.496 ' CG ' ' H ' ' A' ' 113' ' ' GLU . 0.4 OUTLIER 24.54 -113.69 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.837 179.826 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . 0.511 ' O ' ' O ' ' A' ' 114' ' ' ARG . 0.7 OUTLIER 70.43 -73.74 0.09 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.226 -179.663 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . 0.511 ' O ' ' O ' ' A' ' 113' ' ' GLU . 1.6 ptt180 36.6 99.64 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.987 179.781 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . 0.41 ' HG3' ' H ' ' A' ' 115' ' ' GLU . 8.9 mt-10 -50.09 -15.4 0.21 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.965 -0.562 . . . . 0.0 111.064 -179.936 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.542 ' O ' HG23 ' A' ' 120' ' ' VAL . 10.8 mp -54.14 -45.46 71.97 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.01 0.433 . . . . 0.0 110.36 -179.645 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -58.09 -52.29 66.16 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.969 179.791 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.486 HD22 ' CD2' ' A' ' 12' ' ' HIS . 11.7 mt -60.3 -48.42 81.83 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.958 -0.564 . . . . 0.0 112.291 -178.357 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -72.72 -50.51 24.23 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 119.886 -0.725 . . . . 0.0 111.002 -179.107 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . 0.542 HG23 ' O ' ' A' ' 116' ' ' LEU . 91.5 t -56.71 -8.64 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 C-N-CA 120.341 -0.544 . . . . 0.0 111.577 -175.602 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 11.1 t -83.25 -40.14 19.98 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 178.413 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . 0.566 ' O ' ' HB3' ' A' ' 123' ' ' HIS . . . -131.24 -144.66 0.26 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.347 -0.842 . . . . 0.0 109.848 179.431 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . 0.566 ' HB3' ' O ' ' A' ' 122' ' ' ALA . 0.0 OUTLIER 162.92 -154.22 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.288 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 179.496 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . 0.401 ' OD1' ' N ' ' A' ' 124' ' ' ASP . 1.0 OUTLIER -116.34 31.21 6.87 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-O 120.628 0.251 . . . . 0.0 110.821 179.958 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 125' ' ' ASP . . . . . 0.482 ' C ' ' CE1' ' A' ' 123' ' ' HIS . 50.0 m-20 . . . . . 0 C--O 1.22 -0.458 0 CA-C-O 118.025 -0.988 . . . . 0.0 110.625 -179.854 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 501' ' ' C2E . . . . . 0.985 ' O21' " H4'" ' A' ' 501' ' ' C2E . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 502' ' ' C2E . . . . . 0.568 ' C2 ' ' CD1' ' A' ' 77' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.4 ' C ' ' H ' ' A' ' 3' ' ' ASP . 45.9 mtt . . . . . 0 N--CA 1.491 1.589 0 N-CA-C 109.395 -0.595 . . . . 0.0 109.395 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 38.2 m -75.45 40.79 0.18 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.699 -179.784 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . 0.429 ' O ' ' OG ' ' A' ' 121' ' ' SER . 79.6 m-20 -85.21 21.37 1.71 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.044 179.595 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.754 ' NE2' ' H ' ' A' ' 6' ' ' ASP . 0.0 OUTLIER -112.16 -24.51 9.82 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.232 179.993 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . 0.579 ' C ' ' O ' ' A' ' 4' ' ' GLN . 0.0 OUTLIER 3.19 64.51 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 115.59 -0.732 . . . . 0.0 111.781 179.487 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . 0.754 ' H ' ' NE2' ' A' ' 4' ' ' GLN . 8.1 m-20 25.89 92.58 0.01 OUTLIER 'General case' 0 N--CA 1.461 0.121 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.889 179.74 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.405 ' HA ' ' C61' ' A' ' 502' ' ' C2E . 5.2 tt0 -98.26 127.61 44.28 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 120.695 -0.402 . . . . 0.0 110.358 -179.574 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.744 ' NH2' ' N11' ' A' ' 501' ' ' C2E . 0.0 OUTLIER -125.0 -3.83 7.57 Favored 'General case' 0 N--CA 1.462 0.135 0 CA-C-N 115.972 -0.558 . . . . 0.0 112.113 -178.977 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.584 ' NH1' ' CZ ' ' A' ' 13' ' ' ARG . 1.7 ptt180 -109.28 84.46 1.93 Allowed 'General case' 0 N--CA 1.467 0.402 0 CA-C-O 121.11 0.481 . . . . 0.0 110.241 179.799 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.529 ' C ' ' O ' ' A' ' 9' ' ' ARG . 0.0 OUTLIER 18.23 -87.92 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 114.979 -1.01 . . . . 0.0 111.689 -179.846 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . 0.45 ' N ' ' O ' ' A' ' 9' ' ' ARG . 0.5 OUTLIER -119.64 154.59 33.78 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.873 0.368 . . . . 0.0 110.174 -179.943 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . 0.466 ' ND1' ' N ' ' A' ' 12' ' ' HIS . 2.0 m-70 -46.64 172.37 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.067 -179.577 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.584 ' CZ ' ' NH1' ' A' ' 9' ' ' ARG . 2.3 mtm180 -118.24 -179.5 3.79 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.404 -179.875 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.806 ' N ' HD12 ' A' ' 14' ' ' ILE . 1.8 mp -91.46 94.16 4.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.944 179.727 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -93.35 120.4 33.6 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.358 0.599 . . . . 0.0 111.435 -179.493 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -149.7 156.19 41.46 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.029 -0.987 . . . . 0.0 108.509 178.01 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -95.38 148.04 22.87 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 120.271 -0.571 . . . . 0.0 110.646 -178.888 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.502 ' O ' HD12 ' A' ' 32' ' ' LEU . . . 178.73 178.69 0.42 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.695 -0.684 . . . . 0.0 109.852 179.565 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 63.1 t0 -96.63 133.78 40.7 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.76 179.946 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.573 ' O ' ' O ' ' A' ' 31' ' ' VAL . 13.0 p -134.11 154.03 51.45 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.013 0.435 . . . . 0.0 110.164 178.818 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -135.36 145.99 47.93 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 179.519 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.489 ' CD1' HD11 ' A' ' 73' ' ' ILE . 1.1 mm -124.83 136.28 61.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-O 121.278 0.561 . . . . 0.0 110.865 -179.092 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.475 HD13 ' NE ' ' A' ' 60' ' ' ARG . 0.3 OUTLIER -123.0 124.1 42.38 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.85 -179.615 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.523 ' O ' ' OE1' ' A' ' 24' ' ' GLN . 1.7 tm0? -130.92 102.2 5.95 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.418 -0.81 . . . . 0.0 109.459 178.774 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 79.04 -128.03 8.34 Favored Glycine 0 CA--C 1.525 0.659 0 N-CA-C 110.016 -1.234 . . . . 0.0 110.016 -178.705 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -99.75 12.07 37.6 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.732 0.301 . . . . 0.0 110.373 179.567 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.505 ' HB3' ' CZ2' ' A' ' 29' ' ' TRP . 0.0 OUTLIER -112.68 133.56 54.64 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.25 -0.432 . . . . 0.0 112.04 -178.815 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.44 ' HG2' ' N ' ' A' ' 29' ' ' TRP . 2.5 ttt85 -126.98 147.45 50.12 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.967 -0.56 . . . . 0.0 109.896 179.146 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.55 ' NE1' ' O ' ' A' ' 48' ' ' ASP . 6.6 m-90 -146.13 155.64 42.88 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.538 -0.755 . . . . 0.0 110.541 -179.214 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -100.19 137.49 38.55 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 179.144 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.573 ' O ' ' O ' ' A' ' 20' ' ' SER . 16.7 m -146.14 156.65 12.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-O 121.2 0.524 . . . . 0.0 111.077 -179.429 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.502 HD12 ' O ' ' A' ' 18' ' ' ALA . 10.2 tp -95.67 129.95 42.71 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 108.042 -1.096 . . . . 0.0 108.042 178.421 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.479 ' N ' HD12 ' A' ' 32' ' ' LEU . 1.3 tt -92.35 124.89 36.74 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.334 0.587 . . . . 0.0 109.99 -179.89 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 72.6 m-70 -90.29 -27.86 19.16 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.287 -0.87 . . . . 0.0 111.864 -178.429 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.5 ' OD2' ' NH2' ' A' ' 13' ' ' ARG . 2.8 p30 -172.91 161.91 4.62 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 119.531 -0.867 . . . . 0.0 111.331 177.732 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.533 HG22 ' H ' ' A' ' 37' ' ' SER . 4.6 p -144.95 168.76 8.8 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.161 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.121 -179.186 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.533 ' H ' HG22 ' A' ' 36' ' ' VAL . 26.4 t -141.97 168.32 20.02 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 107.919 -1.141 . . . . 0.0 107.919 178.73 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 22.4 tp -64.92 -1.61 2.12 Favored 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 119.64 -0.824 . . . . 0.0 110.281 -179.495 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 3.2 p-80 -161.1 41.24 0.15 Allowed 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 120.569 -0.452 . . . . 0.0 111.857 179.655 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . 0.455 ' HA3' ' N3 ' ' A' ' 501' ' ' C2E . . . -178.76 155.96 17.65 Favored Glycine 0 CA--C 1.528 0.863 0 N-CA-C 111.255 -0.738 . . . . 0.0 111.255 179.635 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.461 ' CG2' HG21 ' A' ' 73' ' ' ILE . 0.1 OUTLIER -147.29 148.72 16.26 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.321 0 CA-C-O 121.332 0.587 . . . . 0.0 111.991 -178.995 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.465 HD23 ' N ' ' A' ' 43' ' ' VAL . 1.0 OUTLIER -121.76 133.53 54.92 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 114.941 -1.027 . . . . 0.0 108.498 178.735 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.465 ' N ' HD23 ' A' ' 42' ' ' LEU . 32.2 m -138.76 175.19 8.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-O 121.278 0.561 . . . . 0.0 111.891 -179.036 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -97.58 144.18 17.15 Favored Glycine 0 CA--C 1.527 0.842 0 N-CA-C 109.161 -1.575 . . . . 0.0 109.161 177.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . 0.495 ' CD ' ' O ' ' A' ' 45' ' ' GLN . 0.0 OUTLIER -87.34 118.63 70.17 Favored Pre-proline 0 CA--C 1.534 0.342 0 CA-C-N 118.159 0.98 . . . . 0.0 111.941 -178.339 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 95.6 Cg_endo -86.45 162.19 9.61 Favored 'Trans proline' 0 C--N 1.307 -1.608 0 C-N-CA 121.586 1.524 . . . . 0.0 111.196 178.649 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 4.0 mm100 -65.45 -40.23 92.98 Favored 'General case' 0 CA--C 1.533 0.322 0 N-CA-C 112.347 0.499 . . . . 0.0 112.347 -178.959 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.55 ' O ' ' NE1' ' A' ' 29' ' ' TRP . 7.7 m-20 -71.78 8.83 1.04 Allowed 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.059 0.392 . . . . 0.0 112.059 -178.677 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' TRP . . . . . 0.471 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 64.0 t-105 -60.28 67.77 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 112.054 0.39 . . . . 0.0 112.054 -179.425 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.549 ' ND2' ' C ' ' A' ' 50' ' ' ASN . 0.6 OUTLIER -93.29 78.56 4.48 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 120.195 -0.602 . . . . 0.0 109.394 178.395 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -144.6 145.41 14.84 Favored Glycine 0 CA--C 1.527 0.822 0 C-N-CA 121.165 -0.541 . . . . 0.0 111.807 -179.326 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 45.7 t0 -78.02 122.41 85.39 Favored Pre-proline 0 CA--C 1.536 0.419 0 CA-C-N 115.505 -0.348 . . . . 0.0 110.824 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 20.6 Cg_endo -60.96 -22.3 74.05 Favored 'Trans proline' 0 N--CA 1.498 1.769 0 C-N-CA 122.805 2.336 . . . . 0.0 112.079 -179.576 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 32.1 mt-30 -78.72 -23.53 45.45 Favored 'General case' 0 C--N 1.324 -0.54 0 C-N-CA 120.633 -0.427 . . . . 0.0 111.374 -179.264 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.567 ' O ' ' CE1' ' A' ' 57' ' ' PHE . 34.3 mtp85 -93.85 147.31 33.3 Favored Pre-proline 0 C--N 1.332 -0.186 0 C-N-CA 120.876 -0.33 . . . . 0.0 110.492 -179.741 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -60.71 160.96 22.8 Favored 'Trans proline' 0 N--CA 1.496 1.67 0 C-N-CA 123.041 2.494 . . . . 0.0 113.399 -178.817 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.567 ' CE1' ' O ' ' A' ' 55' ' ' ARG . 39.1 m-85 -130.44 157.14 43.44 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 115.162 -0.927 . . . . 0.0 109.117 179.414 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -124.02 137.62 54.57 Favored 'General case' 0 N--CA 1.469 0.523 0 N-CA-C 109.486 -0.561 . . . . 0.0 109.486 178.683 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -118.55 136.7 53.7 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 112.41 0.522 . . . . 0.0 112.41 -178.093 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.475 ' NE ' HD13 ' A' ' 23' ' ' LEU . 0.6 OUTLIER -121.55 127.43 50.95 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 108.075 -1.083 . . . . 0.0 108.075 176.631 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.494 HD11 ' SD ' ' A' ' 71' ' ' MET . 12.6 mt -110.11 151.18 27.55 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.93 0.395 . . . . 0.0 110.977 -178.63 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 55.6 m-85 -132.31 108.58 9.3 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.528 179.938 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.555 ' C ' HD23 ' A' ' 63' ' ' LEU . 3.9 tt -104.17 -82.83 0.5 Allowed 'General case' 0 C--N 1.333 -0.121 0 CA-C-N 115.65 -0.705 . . . . 0.0 109.359 179.238 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.453 ' H ' ' HB ' ' A' ' 67' ' ' VAL . . . -77.59 176.11 53.85 Favored Glycine 0 CA--C 1.521 0.418 0 N-CA-C 109.094 -1.602 . . . . 0.0 109.094 178.279 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.718 HD13 ' C ' ' A' ' 65' ' ' LEU . 3.1 tm? -72.2 -35.91 69.06 Favored 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 119.852 -0.739 . . . . 0.0 109.768 -179.693 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.478 ' OD1' ' O ' ' A' ' 66' ' ' ASP . 15.2 t0 -98.55 9.51 43.05 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.15 179.608 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.539 ' O ' HG12 ' A' ' 67' ' ' VAL . 15.0 t -107.1 96.47 4.66 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.296 0 CA-C-O 121.453 0.644 . . . . 0.0 112.069 -178.719 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -112.53 118.19 34.44 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 108.173 -1.047 . . . . 0.0 108.173 178.208 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.792 HG23 ' OG ' ' A' ' 94' ' ' SER . 3.3 mt -113.37 144.21 21.48 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.233 0 CA-C-O 121.065 0.46 . . . . 0.0 111.373 -178.694 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.43 ' HD3' ' N ' ' A' ' 70' ' ' ARG . 0.0 OUTLIER -128.14 131.53 48.96 Favored 'General case' 0 C--O 1.239 0.508 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.868 179.407 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . 0.494 ' SD ' HD11 ' A' ' 61' ' ' LEU . 0.0 OUTLIER -143.26 149.74 38.31 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.11 -179.628 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -104.88 127.24 52.63 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 107.945 -1.131 . . . . 0.0 107.945 178.307 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.656 HD12 ' CG ' ' A' ' 85' ' ' PHE . 14.0 pt -134.9 157.91 41.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 N-CA-C 112.888 0.699 . . . . 0.0 112.888 -177.507 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 9.2 p -122.69 156.06 35.14 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.045 -0.98 . . . . 0.0 109.911 179.032 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.447 ' HA ' HD12 ' A' ' 75' ' ' LEU . 7.2 tp -65.42 119.05 10.3 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.885 0.374 . . . . 0.0 111.054 -179.447 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -97.63 -41.98 7.87 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.554 177.614 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' TRP . . . . . 0.597 ' NE1' ' HA3' ' A' ' 84' ' ' GLY . 67.7 p-90 -171.01 170.02 6.39 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 115.828 -0.624 . . . . 0.0 109.894 -179.741 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -151.32 124.02 8.52 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 110.017 -0.364 . . . . 0.0 110.017 178.84 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . 0.45 ' NE ' " O2'" ' A' ' 502' ' ' C2E . 1.0 OUTLIER -152.15 133.64 14.58 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 119.833 -0.747 . . . . 0.0 112.91 179.67 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . 0.448 ' OD2' ' NH1' ' A' ' 79' ' ' ARG . 61.5 m-20 56.75 47.43 18.16 Favored 'General case' 0 N--CA 1.462 0.168 0 N-CA-C 114.131 1.16 . . . . 0.0 114.131 176.357 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 84.97 -28.35 4.59 Favored Glycine 0 CA--C 1.524 0.649 0 C-N-CA 120.425 -0.893 . . . . 0.0 113.311 177.043 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 4.5 mt -89.84 158.03 17.65 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 117.705 0.752 . . . . 0.0 110.567 -178.915 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 58.4 mt -129.95 135.59 48.49 Favored 'General case' 0 CA--C 1.517 -0.301 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.443 -179.13 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . 0.597 ' HA3' ' NE1' ' A' ' 77' ' ' TRP . . . -96.86 151.77 19.93 Favored Glycine 0 N--CA 1.451 -0.323 0 N-CA-C 109.517 -1.433 . . . . 0.0 109.517 178.522 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . 0.656 ' CG ' HD12 ' A' ' 73' ' ' ILE . 25.2 m-85 -145.56 132.32 20.03 Favored 'General case' 0 C--N 1.318 -0.804 0 C-N-CA 120.711 -0.396 . . . . 0.0 110.884 -179.205 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.464 ' O ' ' NE2' ' A' ' 88' ' ' GLN . 34.3 tt0 -104.04 126.58 51.27 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 179.614 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . 0.573 ' HA ' HG22 ' A' ' 73' ' ' ILE . 39.1 t -69.23 122.2 18.37 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.005 0.431 . . . . 0.0 112.083 -178.486 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . 0.464 ' NE2' ' O ' ' A' ' 86' ' ' GLU . 51.6 mm-40 -95.28 -33.31 12.61 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.14 179.113 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -162.11 141.92 9.88 Favored 'General case' 0 C--O 1.223 -0.313 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.067 179.974 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.617 HD11 ' OG ' ' A' ' 94' ' ' SER . 10.5 tt -145.05 141.17 23.01 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-O 121.237 0.541 . . . . 0.0 110.049 -179.467 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -59.44 141.52 54.48 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 115.319 -0.855 . . . . 0.0 112.382 -177.987 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.508 ' HA ' HD12 ' A' ' 95' ' ' ILE . 14.6 tp -54.21 -41.71 68.94 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 114.963 -1.017 . . . . 0.0 110.669 -179.549 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -65.49 -40.13 92.74 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 179.339 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . 0.792 ' OG ' HG23 ' A' ' 69' ' ' ILE . 2.3 t -69.54 -35.01 75.06 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.149 179.392 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . 0.508 HD12 ' HA ' ' A' ' 92' ' ' LEU . 36.1 mt -58.37 -38.35 68.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.802 -0.636 . . . . 0.0 109.821 -179.906 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -70.75 -37.98 73.46 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 120.383 -0.527 . . . . 0.0 111.051 -179.202 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 61.9 m-70 -63.75 -35.85 81.94 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 119.381 -0.927 . . . . 0.0 109.112 179.772 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.444 ' O ' HG23 ' A' ' 102' ' ' VAL . 6.4 mp -67.33 -33.82 76.05 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 177.872 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 3.8 mtt-85 -61.6 -39.02 89.73 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 178.732 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 38.2 mtp180 -57.92 -45.73 86.08 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.549 179.0 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.42 ' HB3' HG21 ' A' ' 14' ' ' ILE . 7.3 mp -63.84 -34.75 78.64 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.692 -0.685 . . . . 0.0 109.697 179.97 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . 0.444 HG23 ' O ' ' A' ' 98' ' ' LEU . 85.1 t -68.74 -40.51 81.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 116.037 -0.528 . . . . 0.0 110.151 178.97 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -65.5 -48.6 72.01 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.828 -0.623 . . . . 0.0 111.552 -179.35 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 6.5 mp -67.81 -43.01 80.64 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 120.702 -0.399 . . . . 0.0 111.211 -179.037 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . 0.697 ' CG ' HG23 ' A' ' 14' ' ' ILE . 6.7 m-80 -64.41 -34.34 77.95 Favored 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 120.685 -0.406 . . . . 0.0 110.905 -179.704 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 8.1 mt -56.26 -18.82 11.64 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.778 -0.453 . . . . 0.0 109.778 179.686 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -104.26 -14.2 24.81 Favored Glycine 0 CA--C 1.524 0.6 0 N-CA-C 110.661 -0.976 . . . . 0.0 110.661 179.766 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 72.3 m-20 54.97 -169.3 0.07 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.803 0.335 . . . . 0.0 110.549 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . 0.637 ' CD ' ' H ' ' A' ' 109' ' ' GLU . 5.6 mp0 -67.84 -123.47 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.131 179.717 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . 0.415 ' O ' ' O ' ' A' ' 109' ' ' GLU . 45.3 mt-10 -47.99 -96.36 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.217 179.699 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . 0.447 ' O ' ' O ' ' A' ' 112' ' ' LEU . 44.3 tp -173.22 -90.62 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.225 -0.443 . . . . 0.0 109.984 179.664 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.447 ' O ' ' O ' ' A' ' 111' ' ' LEU . 0.7 OUTLIER 58.78 137.36 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.808 179.544 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 -47.08 102.16 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.519 179.916 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . 0.462 ' O ' ' CB ' ' A' ' 115' ' ' GLU . 18.1 ttm180 -161.37 118.32 2.24 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.667 179.946 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . 0.462 ' CB ' ' O ' ' A' ' 114' ' ' ARG . 7.5 tt0 162.15 -48.22 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.81 -0.632 . . . . 0.0 109.517 -179.854 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 6.3 tt -67.33 -35.11 78.73 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.472 -0.786 . . . . 0.0 111.025 179.678 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -65.59 -23.16 66.77 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-O 121.173 0.511 . . . . 0.0 110.727 -178.687 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.417 ' O ' ' CB ' ' A' ' 121' ' ' SER . 34.2 mt -57.21 -40.38 77.37 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 178.695 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . 0.54 ' C ' ' H ' ' A' ' 121' ' ' SER . 3.9 mm? -57.22 -47.37 81.5 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 107.634 -1.247 . . . . 0.0 107.634 179.118 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . 0.48 ' O ' HG12 ' A' ' 120' ' ' VAL . 24.1 t -58.72 1.0 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.847 177.344 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' SER . . . . . 0.54 ' H ' ' C ' ' A' ' 119' ' ' LEU . 1.5 t -98.98 -41.85 7.39 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 108.429 -0.952 . . . . 0.0 108.429 177.155 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . 0.434 ' O ' ' O ' ' A' ' 123' ' ' HIS . . . -131.12 63.72 1.59 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.171 -0.922 . . . . 0.0 110.484 -179.941 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . 0.754 ' CG ' ' N ' ' A' ' 124' ' ' ASP . 0.0 OUTLIER -56.37 -158.3 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 120.714 -0.394 . . . . 0.0 111.181 -178.687 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . 0.754 ' N ' ' CG ' ' A' ' 123' ' ' HIS . 9.0 t70 157.44 -24.41 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.865 179.639 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 . . . . . 0 C--O 1.221 -0.427 0 CA-C-O 117.938 -1.029 . . . . 0.0 110.587 179.985 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 501' ' ' C2E . . . . . 0.9 ' O21' " H4'" ' A' ' 501' ' ' C2E . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 502' ' ' C2E . . . . . 0.582 ' N71' ' NH2' ' A' ' 8' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.5 mtt . . . . . 0 N--CA 1.491 1.578 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 59.5 p -105.48 86.18 2.37 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.651 -179.968 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . 0.48 ' N ' ' OD1' ' A' ' 3' ' ' ASP . 0.4 OUTLIER -99.81 103.84 15.49 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 109.157 -0.683 . . . . 0.0 109.157 177.942 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.942 ' H ' ' NE2' ' A' ' 4' ' ' GLN . 0.0 OUTLIER -108.13 -34.12 6.96 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.725 -0.67 . . . . 0.0 111.09 -179.149 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . 0.879 ' H ' HE21 ' A' ' 4' ' ' GLN . 40.1 m170 -111.48 -106.35 0.37 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.44 -0.346 . . . . 0.0 111.012 -179.242 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . 0.477 ' O ' ' N71' ' A' ' 502' ' ' C2E . 24.7 m-20 54.57 163.77 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.998 -0.371 . . . . 0.0 109.998 -179.499 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -104.32 127.75 52.03 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 120.888 0.375 . . . . 0.0 111.43 -179.418 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.654 ' NH2' ' C21' ' A' ' 501' ' ' C2E . 0.0 OUTLIER -123.9 -12.57 7.52 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.476 -179.794 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.649 ' HG2' ' O61' ' A' ' 502' ' ' C2E . 8.0 ptt85 -116.14 83.72 1.99 Allowed 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 120.831 0.348 . . . . 0.0 110.251 179.654 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.549 ' C ' ' O ' ' A' ' 9' ' ' ARG . 0.0 OUTLIER 18.86 -83.03 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.381 -0.827 . . . . 0.0 111.39 -179.938 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . 0.588 ' N ' ' O ' ' A' ' 9' ' ' ARG . 0.1 OUTLIER -117.68 171.16 8.21 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-O 120.947 0.403 . . . . 0.0 110.609 179.969 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . 0.526 ' C ' ' HE ' ' A' ' 13' ' ' ARG . 0.0 OUTLIER -73.45 -0.39 14.77 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.471 -179.409 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.526 ' HE ' ' C ' ' A' ' 12' ' ' HIS . 9.8 mtm180 67.85 178.28 0.24 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.835 0.35 . . . . 0.0 110.277 -179.656 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.644 ' N ' HD12 ' A' ' 14' ' ' ILE . 1.4 mp -84.6 105.64 13.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.455 -179.901 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -95.46 119.72 34.46 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.459 0.647 . . . . 0.0 111.55 -179.883 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -150.02 155.12 39.35 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 114.904 -1.044 . . . . 0.0 108.293 177.891 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . 0.53 ' OD1' ' N ' ' A' ' 17' ' ' ASP . 17.9 p-10 -95.6 146.22 24.64 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 120.09 -0.644 . . . . 0.0 111.005 -178.626 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -178.65 174.9 1.14 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.244 179.588 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 3.5 t0 -96.07 133.91 39.75 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.854 -179.669 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.539 ' O ' ' O ' ' A' ' 31' ' ' VAL . 27.7 p -133.71 152.51 51.9 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.253 0.549 . . . . 0.0 110.358 178.729 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.482 ' OE1' ' NH2' ' A' ' 28' ' ' ARG . 6.7 mm-40 -131.34 151.96 51.04 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 108.976 -0.75 . . . . 0.0 108.976 179.533 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.428 ' HA ' ' O ' ' A' ' 58' ' ' GLU . 22.6 mt -134.44 136.25 53.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 C-N-CA 120.053 -0.659 . . . . 0.0 111.304 -179.376 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -124.16 123.27 39.93 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.473 -0.785 . . . . 0.0 111.402 -179.142 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.536 ' OE1' ' CZ ' ' A' ' 57' ' ' PHE . 24.1 tt0 -128.12 102.07 6.56 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.538 -0.755 . . . . 0.0 109.811 178.61 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 80.97 -125.8 7.06 Favored Glycine 0 CA--C 1.522 0.528 0 N-CA-C 109.974 -1.25 . . . . 0.0 109.974 -178.894 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -100.55 12.19 37.86 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.954 0.407 . . . . 0.0 110.014 179.489 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.595 ' HB3' ' CZ2' ' A' ' 29' ' ' TRP . 24.1 mtt85 -114.27 135.84 53.62 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 112.968 0.729 . . . . 0.0 112.968 -178.062 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.482 ' NH2' ' OE1' ' A' ' 21' ' ' GLU . 72.0 ttt-85 -128.69 151.38 49.59 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.017 178.77 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.595 ' CZ2' ' HB3' ' A' ' 27' ' ' ARG . 6.5 m-90 -149.25 156.56 42.31 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.59 -179.249 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -100.83 140.07 35.64 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.09 -0.504 . . . . 0.0 109.676 179.321 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.539 ' O ' ' O ' ' A' ' 20' ' ' SER . 12.5 m -149.92 158.45 5.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-O 121.324 0.583 . . . . 0.0 111.19 -179.267 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 1.049 ' H ' HD23 ' A' ' 32' ' ' LEU . 1.0 OUTLIER -99.02 129.95 45.33 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 108.577 -0.897 . . . . 0.0 108.577 178.556 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.2 tt -95.18 125.51 39.87 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 120.306 -0.558 . . . . 0.0 109.787 -179.62 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 20.3 m-70 -90.62 -26.17 19.77 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.402 -0.817 . . . . 0.0 111.714 -178.455 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -172.16 161.31 5.42 Favored 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 119.544 -0.862 . . . . 0.0 111.271 177.403 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.545 HG22 ' N ' ' A' ' 37' ' ' SER . 8.4 p -145.17 168.59 8.59 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.823 -178.792 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.545 ' N ' HG22 ' A' ' 36' ' ' VAL . 6.4 t -141.77 169.66 17.17 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 108.045 -1.094 . . . . 0.0 108.045 178.801 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.476 HD23 ' O ' ' A' ' 38' ' ' LEU . 5.7 tt -67.69 -1.97 6.13 Favored 'General case' 0 C--N 1.323 -0.556 0 C-N-CA 119.872 -0.731 . . . . 0.0 110.69 -179.325 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . 0.569 ' CE1' ' O ' ' A' ' 87' ' ' CYS . 58.1 t60 -156.98 35.42 0.29 Allowed 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 120.777 -0.369 . . . . 0.0 111.501 -179.756 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . 0.45 ' HA3' ' N3 ' ' A' ' 501' ' ' C2E . . . -175.96 158.98 26.17 Favored Glycine 0 CA--C 1.527 0.787 0 N-CA-C 111.241 -0.744 . . . . 0.0 111.241 179.811 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -149.36 149.58 14.65 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.388 0 CA-C-O 121.104 0.478 . . . . 0.0 111.532 -178.963 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.803 HD23 ' N ' ' A' ' 43' ' ' VAL . 2.7 tt -122.09 141.86 50.96 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 115.527 -0.761 . . . . 0.0 109.105 178.519 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.803 ' N ' HD23 ' A' ' 42' ' ' LEU . 20.0 m -145.26 174.98 2.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-O 121.263 0.554 . . . . 0.0 111.684 -179.562 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -98.72 145.63 17.8 Favored Glycine 0 CA--C 1.528 0.846 0 N-CA-C 109.808 -1.317 . . . . 0.0 109.808 178.811 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 47.5 tt0 -87.22 113.27 53.0 Favored Pre-proline 0 N--CA 1.463 0.22 0 CA-C-N 117.611 0.706 . . . . 0.0 111.699 -178.654 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 96.9 Cg_endo -83.96 161.35 13.82 Favored 'Trans proline' 0 C--N 1.306 -1.682 0 C-N-CA 121.56 1.507 . . . . 0.0 111.372 179.031 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.612 ' CD ' ' H ' ' A' ' 47' ' ' GLN . 0.0 OUTLIER -65.12 -26.24 68.11 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 112.388 0.514 . . . . 0.0 112.388 -178.797 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.534 ' O ' ' N ' ' A' ' 50' ' ' ASN . 1.3 p30 -86.65 8.42 22.45 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 112.085 0.402 . . . . 0.0 112.085 -178.619 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' TRP . . . . . 0.435 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 58.9 t-105 -60.52 68.56 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 111.786 0.291 . . . . 0.0 111.786 -179.69 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.534 ' N ' ' O ' ' A' ' 48' ' ' ASP . 0.3 OUTLIER -93.15 78.77 4.54 Favored 'General case' 0 C--N 1.324 -0.509 0 C-N-CA 120.129 -0.628 . . . . 0.0 109.763 178.607 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -145.02 160.17 27.99 Favored Glycine 0 CA--C 1.525 0.708 0 N-CA-C 111.047 -0.821 . . . . 0.0 111.047 -179.611 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 30.1 t0 -95.31 110.89 52.98 Favored Pre-proline 0 CA--C 1.533 0.296 0 C-N-CA 121.267 -0.173 . . . . 0.0 110.924 -179.646 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_exo -47.79 -22.35 3.13 Favored 'Trans proline' 0 N--CA 1.493 1.485 0 C-N-CA 122.362 2.041 . . . . 0.0 112.357 179.614 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 83.7 mt-30 -76.77 -23.85 52.93 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.382 -179.411 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.521 ' O ' ' CE1' ' A' ' 57' ' ' PHE . 15.9 mtp180 -95.46 151.88 38.89 Favored Pre-proline 0 CA--C 1.531 0.227 0 N-CA-C 110.08 -0.341 . . . . 0.0 110.08 179.987 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . 0.454 ' O ' ' OE1' ' A' ' 24' ' ' GLN . 35.4 Cg_endo -64.85 160.87 38.8 Favored 'Trans proline' 0 N--CA 1.495 1.579 0 C-N-CA 122.852 2.368 . . . . 0.0 113.331 -178.497 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.536 ' CZ ' ' OE1' ' A' ' 24' ' ' GLN . 57.8 m-85 -130.71 154.66 47.72 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 114.997 -1.001 . . . . 0.0 109.192 179.486 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.428 ' O ' ' HA ' ' A' ' 22' ' ' ILE . 16.5 mt-10 -119.31 136.01 54.44 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 108.863 -0.792 . . . . 0.0 108.863 178.667 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . 0.533 ' C ' ' HE ' ' A' ' 60' ' ' ARG . . . -120.47 139.43 52.88 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.281 0.563 . . . . 0.0 112.507 -177.871 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.533 ' HE ' ' C ' ' A' ' 59' ' ' ALA . 2.4 mmp_? -123.96 127.67 48.29 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 108.418 -0.956 . . . . 0.0 108.418 177.304 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.422 HD12 ' C ' ' A' ' 60' ' ' ARG . 9.6 mp -105.78 150.36 25.61 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 120.701 -0.4 . . . . 0.0 110.386 -179.234 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' TYR . . . . . 0.446 ' CD1' ' N ' ' A' ' 62' ' ' TYR . 18.3 m-85 -133.9 108.99 8.75 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.46 179.643 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.54 ' C ' HD23 ' A' ' 63' ' ' LEU . 2.4 tt -104.97 -84.7 0.49 Allowed 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.582 -0.736 . . . . 0.0 109.207 179.382 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.436 ' H ' ' HB ' ' A' ' 67' ' ' VAL . . . -75.72 178.11 48.69 Favored Glycine 0 CA--C 1.52 0.384 0 N-CA-C 109.23 -1.548 . . . . 0.0 109.23 178.508 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 11.6 mt -73.34 -33.8 65.31 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 119.949 -0.7 . . . . 0.0 110.31 -179.588 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -100.87 9.31 42.48 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.822 179.913 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.579 ' O ' HG12 ' A' ' 67' ' ' VAL . 8.7 t -104.94 94.97 3.43 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-O 121.334 0.588 . . . . 0.0 111.901 -178.824 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 6.1 tp -112.37 117.46 32.51 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 177.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.716 HG23 ' OG ' ' A' ' 94' ' ' SER . 3.4 mt -112.63 144.78 19.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 120.946 0.403 . . . . 0.0 111.148 -178.942 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 5.9 mtt85 -127.98 131.6 49.24 Favored 'General case' 0 C--O 1.239 0.506 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.75 179.344 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -142.95 149.03 37.85 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.211 -179.822 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 17.6 tp10 -100.44 134.2 43.74 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 107.635 -1.246 . . . . 0.0 107.635 178.123 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.59 HD12 ' CB ' ' A' ' 85' ' ' PHE . 4.5 pt -144.1 157.34 15.63 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.157 0 C-N-CA 119.084 -1.046 . . . . 0.0 113.138 -177.707 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 29.7 m -122.06 152.86 39.36 Favored 'General case' 0 N--CA 1.463 0.225 0 CA-C-N 115.012 -0.995 . . . . 0.0 109.965 178.877 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.589 HD22 ' CE1' ' A' ' 85' ' ' PHE . 0.2 OUTLIER -65.31 120.31 12.55 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-O 120.964 0.411 . . . . 0.0 110.398 -179.197 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . 0.575 ' N ' HD13 ' A' ' 75' ' ' LEU . . . -97.31 -37.63 9.97 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.166 177.53 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' TRP . . . . . 0.728 ' NE1' ' HA3' ' A' ' 84' ' ' GLY . 69.6 p-90 -171.12 169.91 6.33 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.745 179.725 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -151.45 123.9 8.37 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.178 178.459 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 21.6 ttm-85 -152.36 131.44 12.66 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 120.308 -0.557 . . . . 0.0 112.35 179.441 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 19.5 t70 55.95 47.28 20.31 Favored 'General case' 0 N--CA 1.466 0.325 0 N-CA-C 113.634 0.976 . . . . 0.0 113.634 176.257 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 68.74 12.28 64.2 Favored Glycine 0 CA--C 1.523 0.549 0 C-N-CA 120.325 -0.941 . . . . 0.0 111.594 178.603 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 32.4 mt -114.36 139.93 49.07 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 178.156 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 27.6 mt -128.45 135.28 49.26 Favored 'General case' 0 CA--C 1.512 -0.515 0 C-N-CA 120.298 -0.561 . . . . 0.0 111.51 -178.805 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . 0.728 ' HA3' ' NE1' ' A' ' 77' ' ' TRP . . . -103.49 155.39 17.92 Favored Glycine 0 N--CA 1.446 -0.667 0 N-CA-C 109.179 -1.568 . . . . 0.0 109.179 178.436 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . 0.59 ' CB ' HD12 ' A' ' 73' ' ' ILE . 49.6 m-85 -145.75 136.79 24.66 Favored 'General case' 0 C--N 1.311 -1.093 0 C-N-CA 120.792 -0.363 . . . . 0.0 110.417 -179.535 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.444 ' O ' ' NE2' ' A' ' 88' ' ' GLN . 4.6 pt-20 -103.89 127.76 51.4 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 179.232 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . 0.569 ' O ' ' CE1' ' A' ' 39' ' ' HIS . 4.8 t -75.73 126.08 30.3 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.889 0.376 . . . . 0.0 111.985 -178.305 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . 0.444 ' NE2' ' O ' ' A' ' 86' ' ' GLU . 0.0 OUTLIER -102.1 -28.5 12.3 Favored 'General case' 0 N--CA 1.462 0.143 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.49 179.318 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . 0.554 ' ND1' ' N ' ' A' ' 90' ' ' ILE . 0.1 OUTLIER -161.0 141.26 11.1 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.958 0.409 . . . . 0.0 110.377 179.712 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.826 HD11 ' OG ' ' A' ' 94' ' ' SER . 7.9 tt -146.01 141.34 21.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.186 -179.422 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . 0.526 ' N ' ' OD1' ' A' ' 91' ' ' ASP . 0.3 OUTLIER -55.24 143.15 28.88 Favored 'General case' 0 N--CA 1.462 0.139 0 CA-C-N 115.381 -0.827 . . . . 0.0 111.98 -178.293 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.509 ' HA ' HD12 ' A' ' 95' ' ' ILE . 59.2 tp -54.08 -41.66 68.46 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.066 -0.97 . . . . 0.0 109.705 -179.579 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -67.88 -38.33 82.91 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.001 -0.545 . . . . 0.0 109.554 179.081 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . 0.826 ' OG ' HD11 ' A' ' 90' ' ' ILE . 5.6 t -68.25 -35.14 77.45 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.946 179.368 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . 0.509 HD12 ' HA ' ' A' ' 92' ' ' LEU . 44.2 mt -58.74 -38.26 70.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.786 -0.643 . . . . 0.0 109.702 179.507 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -71.42 -42.11 68.7 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.947 -179.728 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' HIS . . . . . 0.42 ' O ' ' HB2' ' A' ' 100' ' ' ARG . 61.3 m-70 -61.79 -37.52 84.68 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 119.745 -0.782 . . . . 0.0 109.718 -179.996 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 2.6 mp -67.54 -34.05 76.31 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 177.711 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 8.8 mtt85 -66.31 -37.11 84.63 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 177.551 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . 0.42 ' HB2' ' O ' ' A' ' 97' ' ' HIS . 56.1 mtp180 -61.67 -44.2 97.41 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.105 -0.952 . . . . 0.0 110.969 178.916 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.408 HD23 ' HA ' ' A' ' 101' ' ' LEU . 5.0 mt -62.16 -39.61 93.24 Favored 'General case' 0 C--N 1.332 -0.174 0 C-N-CA 120.608 -0.437 . . . . 0.0 109.824 -179.318 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . 0.478 ' O ' ' N ' ' A' ' 106' ' ' LEU . 72.6 t -68.5 -43.2 83.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.57 179.72 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -59.06 -48.74 80.51 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.017 -179.609 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 8.7 mt -67.44 -42.21 83.51 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.741 -0.383 . . . . 0.0 110.421 -179.629 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -72.38 -29.01 63.37 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.435 179.88 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.478 ' N ' ' O ' ' A' ' 102' ' ' VAL . 41.7 tp -63.84 -21.77 66.6 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.756 -0.461 . . . . 0.0 109.756 179.614 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -172.91 138.6 4.77 Favored Glycine 0 CA--C 1.525 0.714 0 N-CA-C 110.949 -0.86 . . . . 0.0 110.949 179.767 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 29.4 m-20 -126.14 -62.35 1.17 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.778 0.323 . . . . 0.0 110.505 -179.89 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . 0.53 ' O ' ' N ' ' A' ' 111' ' ' LEU . 1.4 pm0 -146.04 127.32 14.84 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.254 179.559 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -38.67 90.73 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.907 -179.844 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . 0.53 ' N ' ' O ' ' A' ' 109' ' ' GLU . 0.6 OUTLIER -92.46 -163.16 1.01 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.247 179.678 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 33.2 tp -88.67 -78.54 0.34 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.261 179.901 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 30.1 mt-10 -57.19 -171.34 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.451 179.794 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . 0.439 ' CZ ' ' O ' ' A' ' 114' ' ' ARG . 19.7 ttp85 -159.68 46.09 0.26 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.655 179.592 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . 0.418 ' HB3' HD12 ' A' ' 118' ' ' LEU . 5.3 mp0 56.81 20.8 5.45 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.675 179.695 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 23.9 mt -67.74 -39.95 84.2 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.631 -179.68 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -58.24 -22.58 52.81 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-O 121.54 0.686 . . . . 0.0 110.236 -178.852 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.418 HD12 ' HB3' ' A' ' 115' ' ' GLU . 11.3 mt -58.37 -31.38 67.57 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 114.742 -1.117 . . . . 0.0 108.892 177.668 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 11.9 mt -55.97 -45.93 78.77 Favored 'General case' 0 C--N 1.332 -0.167 0 N-CA-C 108.428 -0.953 . . . . 0.0 108.428 -179.899 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . 0.429 ' O ' HG12 ' A' ' 120' ' ' VAL . 61.9 t -57.47 -8.75 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.055 178.603 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' SER . . . . . 0.676 ' O ' ' O ' ' A' ' 122' ' ' ALA . 0.0 OUTLIER -109.4 -38.82 5.38 Favored 'General case' 0 C--N 1.332 -0.164 0 N-CA-C 108.45 -0.945 . . . . 0.0 108.45 177.799 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . 0.676 ' O ' ' O ' ' A' ' 121' ' ' SER . . . -46.1 -143.75 0.0 OUTLIER 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 114.974 -1.012 . . . . 0.0 111.657 179.832 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . 0.678 ' CD2' ' N ' ' A' ' 124' ' ' ASP . 0.4 OUTLIER -25.25 -42.19 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.551 -179.594 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . 0.678 ' N ' ' CD2' ' A' ' 123' ' ' HIS . 11.5 t0 61.72 -68.18 0.06 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.17 -179.484 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 125' ' ' ASP . . . . . 0.553 ' N ' ' O ' ' A' ' 123' ' ' HIS . 21.6 t0 . . . . . 0 C--O 1.22 -0.455 0 CA-C-O 117.985 -1.007 . . . . 0.0 111.438 -179.528 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 501' ' ' C2E . . . . . 0.654 ' C21' ' NH2' ' A' ' 8' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 502' ' ' C2E . . . . . 0.649 ' O61' ' HG2' ' A' ' 9' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.1 mtp . . . . . 0 N--CA 1.49 1.555 0 N-CA-C 109.4 -0.592 . . . . 0.0 109.4 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.682 ' O ' ' N ' ' A' ' 4' ' ' GLN . 3.3 p 176.32 52.61 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.446 179.964 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -58.58 62.47 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.182 0.515 . . . . 0.0 110.449 -179.622 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.682 ' N ' ' O ' ' A' ' 2' ' ' SER . 23.4 mm-40 -71.1 -3.14 18.31 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.474 -0.784 . . . . 0.0 110.576 -179.178 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . 0.444 ' O ' ' C ' ' A' ' 6' ' ' ASP . 25.2 m170 -80.74 -16.83 52.85 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 178.352 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . 0.444 ' C ' ' O ' ' A' ' 5' ' ' HIS . 99.3 m-20 -31.38 147.84 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 115.166 -0.925 . . . . 0.0 110.963 178.94 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -81.36 133.35 35.41 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.149 0.499 . . . . 0.0 110.099 179.888 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.678 ' H ' ' C61' ' A' ' 502' ' ' C2E . 0.0 OUTLIER -123.44 -10.14 7.97 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.332 -179.679 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.737 ' O ' ' N ' ' A' ' 11' ' ' PHE . 3.4 mtt180 -97.79 74.99 2.38 Favored 'General case' 0 CA--C 1.516 -0.33 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 -179.903 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.523 ' C ' ' O ' ' A' ' 9' ' ' ARG . 0.0 OUTLIER 22.71 -78.12 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.662 -179.5 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . 0.737 ' N ' ' O ' ' A' ' 9' ' ' ARG . 9.9 m-85 -129.27 152.42 48.86 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.622 -0.51 . . . . 0.0 109.622 178.945 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . 0.672 ' H ' ' CD2' ' A' ' 12' ' ' HIS . 2.0 p80 -47.17 157.24 0.19 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.812 0.339 . . . . 0.0 110.75 -179.505 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.618 ' NH1' ' N1 ' ' A' ' 501' ' ' C2E . 0.1 OUTLIER -103.61 -165.37 1.15 Allowed 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.499 -179.821 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.528 HG13 HG22 ' A' ' 102' ' ' VAL . 41.8 mm -102.77 96.25 4.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.491 179.982 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -93.83 119.96 33.46 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.274 0.559 . . . . 0.0 110.95 179.834 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 5.0 p90 -149.99 158.08 43.8 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 108.522 -0.918 . . . . 0.0 108.522 178.07 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 17.8 p-10 -95.6 145.92 24.87 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 120.185 -0.606 . . . . 0.0 110.746 -179.126 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -178.94 177.08 0.86 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.99 -0.55 . . . . 0.0 109.81 179.52 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 37.3 t0 -96.39 133.27 41.01 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 120.763 -0.375 . . . . 0.0 110.783 -179.679 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.56 ' O ' ' O ' ' A' ' 31' ' ' VAL . 2.9 p -132.97 150.61 52.15 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.371 0.605 . . . . 0.0 110.106 178.734 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 28.9 mm-40 -129.44 135.74 49.05 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.453 -0.794 . . . . 0.0 108.962 179.82 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -117.59 136.13 55.76 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.438 0 C-N-CA 120.227 -0.589 . . . . 0.0 110.376 -179.66 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.506 ' H ' HD12 ' A' ' 23' ' ' LEU . 0.1 OUTLIER -125.38 123.2 38.81 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.518 -0.764 . . . . 0.0 111.08 -179.167 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.527 ' OE1' ' CZ ' ' A' ' 57' ' ' PHE . 20.1 tt0 -130.05 102.71 6.38 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.382 -0.826 . . . . 0.0 109.493 178.419 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 78.31 -127.93 8.44 Favored Glycine 0 CA--C 1.522 0.476 0 N-CA-C 109.672 -1.371 . . . . 0.0 109.672 -178.69 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.47 ' OE1' ' O ' ' A' ' 26' ' ' GLU . 2.5 pp20? -99.77 11.25 39.72 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.627 0.251 . . . . 0.0 110.387 179.468 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.562 ' HB3' ' CZ2' ' A' ' 29' ' ' TRP . 2.5 mpt_? -110.89 132.08 54.51 Favored 'General case' 0 CA--C 1.522 -0.134 0 CA-C-O 121.032 0.444 . . . . 0.0 111.872 -179.536 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.597 ' NH2' ' NH2' ' A' ' 60' ' ' ARG . 5.9 ttt180 -126.88 146.49 50.27 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.767 -0.651 . . . . 0.0 109.776 179.227 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.562 ' CZ2' ' HB3' ' A' ' 27' ' ' ARG . 6.5 m-90 -144.63 155.1 43.45 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.464 -179.097 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -100.24 128.62 46.27 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.785 -0.643 . . . . 0.0 109.934 179.734 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.56 ' O ' ' O ' ' A' ' 20' ' ' SER . 35.3 m -140.83 155.83 22.36 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-O 121.109 0.481 . . . . 0.0 111.202 -179.703 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.571 ' H ' HD23 ' A' ' 32' ' ' LEU . 0.3 OUTLIER -94.03 131.34 39.62 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 108.553 -0.906 . . . . 0.0 108.553 178.375 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.5 tt -89.91 127.22 35.97 Favored 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 120.298 -0.561 . . . . 0.0 109.852 -179.735 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' HIS . . . . . 0.417 ' NE2' HD12 ' A' ' 32' ' ' LEU . 74.0 m-70 -92.45 -27.32 17.54 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.501 -0.772 . . . . 0.0 111.581 -178.634 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 -175.16 162.32 2.99 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 119.693 -0.803 . . . . 0.0 111.536 177.599 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.5 HG22 ' H ' ' A' ' 37' ' ' SER . 4.5 p -145.29 168.55 8.4 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.179 0 CA-C-N 115.503 -0.771 . . . . 0.0 111.094 -179.182 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.5 ' H ' HG22 ' A' ' 36' ' ' VAL . 20.1 t -142.08 169.71 17.07 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 107.738 -1.208 . . . . 0.0 107.738 178.474 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.611 ' H ' HD23 ' A' ' 38' ' ' LEU . 0.3 OUTLIER -66.31 -0.72 2.78 Favored 'General case' 0 C--N 1.322 -0.598 0 C-N-CA 119.552 -0.859 . . . . 0.0 110.874 -179.256 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . 0.5 ' CE1' ' O ' ' A' ' 87' ' ' CYS . 47.6 t60 -158.9 38.16 0.22 Allowed 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 120.639 -0.424 . . . . 0.0 111.566 -179.828 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . 0.538 ' HA3' ' N3 ' ' A' ' 501' ' ' C2E . . . -177.46 158.16 23.33 Favored Glycine 0 CA--C 1.528 0.906 0 C-N-CA 120.606 -0.807 . . . . 0.0 111.422 179.871 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -148.49 148.95 15.56 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.374 0 CA-C-O 121.421 0.629 . . . . 0.0 111.768 -178.736 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.49 HD12 ' NH2' ' A' ' 13' ' ' ARG . 0.6 OUTLIER -122.39 138.5 54.51 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 115.01 -0.996 . . . . 0.0 108.947 178.96 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 23.6 m -142.83 174.58 5.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-O 121.16 0.505 . . . . 0.0 111.491 -179.695 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -95.13 144.9 17.47 Favored Glycine 0 CA--C 1.529 0.923 0 N-CA-C 109.528 -1.429 . . . . 0.0 109.528 178.285 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . 0.557 ' NE2' ' O ' ' A' ' 46' ' ' PRO . 18.0 tm0? -87.58 115.5 63.07 Favored Pre-proline 0 N--CA 1.464 0.264 0 CA-C-N 118.121 0.96 . . . . 0.0 112.099 -178.523 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.557 ' O ' ' NE2' ' A' ' 45' ' ' GLN . 96.1 Cg_endo -85.97 161.96 10.31 Favored 'Trans proline' 0 C--N 1.308 -1.588 0 C-N-CA 121.562 1.508 . . . . 0.0 111.213 178.587 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.2 mt-30 -65.14 -40.36 94.29 Favored 'General case' 0 N--CA 1.466 0.37 0 N-CA-C 112.585 0.587 . . . . 0.0 112.585 -178.709 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.572 ' O ' ' N ' ' A' ' 50' ' ' ASN . 6.4 m-20 -72.89 8.88 1.33 Allowed 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 112.035 0.383 . . . . 0.0 112.035 -178.479 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' TRP . . . . . 0.46 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 64.5 t-105 -58.97 69.06 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.729 -0.214 . . . . 0.0 111.531 -179.878 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.572 ' N ' ' O ' ' A' ' 48' ' ' ASP . 0.1 OUTLIER -93.25 78.55 4.5 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 120.201 -0.6 . . . . 0.0 109.531 178.812 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . 0.436 ' CA ' HE21 ' A' ' 24' ' ' GLN . . . -142.54 160.16 27.3 Favored Glycine 0 CA--C 1.52 0.401 0 N-CA-C 111.295 -0.722 . . . . 0.0 111.295 -179.557 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -95.02 121.97 61.21 Favored Pre-proline 0 C--N 1.325 -0.465 0 CA-C-N 115.367 -0.416 . . . . 0.0 110.662 -179.637 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 17.4 Cg_endo -60.15 -22.48 70.17 Favored 'Trans proline' 0 N--CA 1.494 1.519 0 C-N-CA 122.259 1.973 . . . . 0.0 111.564 -179.742 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 6.4 mm-40 -77.73 -21.68 51.52 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.472 179.927 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.511 ' O ' ' CE1' ' A' ' 57' ' ' PHE . 72.2 mtt-85 -97.65 149.86 36.17 Favored Pre-proline 0 CA--C 1.53 0.208 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.108 179.74 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . 0.411 ' O ' ' OE1' ' A' ' 24' ' ' GLN . 37.5 Cg_endo -65.56 160.93 40.74 Favored 'Trans proline' 0 N--CA 1.497 1.683 0 C-N-CA 123.116 2.544 . . . . 0.0 113.476 -179.093 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.527 ' CZ ' ' OE1' ' A' ' 24' ' ' GLN . 26.9 m-85 -129.58 156.61 43.91 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 114.905 -1.043 . . . . 0.0 108.599 179.076 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.403 ' O ' HD12 ' A' ' 23' ' ' LEU . 58.6 mt-10 -122.54 139.67 53.63 Favored 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 109.238 -0.652 . . . . 0.0 109.238 178.604 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -121.06 137.4 54.67 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.117 0.484 . . . . 0.0 111.74 -178.223 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.597 ' NH2' ' NH2' ' A' ' 28' ' ' ARG . 51.9 mtm-85 -123.19 127.84 49.2 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 177.524 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.487 HD11 ' SD ' ' A' ' 71' ' ' MET . 0.1 OUTLIER -107.9 151.1 26.23 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 120.493 -0.483 . . . . 0.0 111.066 -178.614 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 28.9 m-85 -134.0 109.67 9.15 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.17 179.527 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 1.6 tt -104.63 -82.7 0.51 Allowed 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 115.838 -0.619 . . . . 0.0 109.398 179.529 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.464 ' H ' ' HB ' ' A' ' 67' ' ' VAL . . . -77.76 179.27 51.3 Favored Glycine 0 CA--C 1.523 0.533 0 N-CA-C 109.416 -1.474 . . . . 0.0 109.416 178.568 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.812 HD22 ' N ' ' A' ' 65' ' ' LEU . 1.9 mm? -73.78 -31.89 63.52 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 119.925 -0.71 . . . . 0.0 110.129 -179.752 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.9 p30 -103.44 9.22 37.83 Favored 'General case' 0 C--N 1.332 -0.17 0 C-N-CA 122.775 0.43 . . . . 0.0 111.198 -179.927 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.538 ' O ' HG12 ' A' ' 67' ' ' VAL . 8.7 t -105.07 96.37 4.54 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.37 0 CA-C-O 121.2 0.524 . . . . 0.0 111.807 -178.78 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.443 HD12 ' N ' ' A' ' 69' ' ' ILE . 1.8 tp -114.37 118.48 33.98 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 178.678 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.443 ' N ' HD12 ' A' ' 68' ' ' LEU . 2.9 mt -113.9 145.0 20.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.339 -0.392 . . . . 0.0 111.353 -178.791 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 8.4 ptm180 -128.41 131.06 48.48 Favored 'General case' 0 C--O 1.24 0.562 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.078 179.033 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . 0.487 ' SD ' HD11 ' A' ' 61' ' ' LEU . 0.4 OUTLIER -139.59 147.98 41.88 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.607 -0.724 . . . . 0.0 109.953 179.451 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -112.57 118.46 35.16 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 107.661 -1.237 . . . . 0.0 107.661 178.077 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.702 HD12 ' CB ' ' A' ' 85' ' ' PHE . 3.3 pt -129.32 168.02 23.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 N-CA-C 113.466 0.913 . . . . 0.0 113.466 -176.146 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 58.7 m -121.94 150.74 41.58 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 114.961 -1.018 . . . . 0.0 109.807 178.837 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.537 HD12 ' CE1' ' A' ' 85' ' ' PHE . 14.3 tp -66.6 123.58 20.47 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 121.268 0.556 . . . . 0.0 110.175 -179.837 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -98.15 -45.1 6.34 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 115.448 -0.796 . . . . 0.0 111.306 178.533 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' TRP . . . . . 0.507 ' CE2' ' HA3' ' A' ' 84' ' ' GLY . 66.5 p-90 -167.82 167.41 13.05 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.224 -178.965 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -146.4 123.85 11.7 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 109.824 -0.435 . . . . 0.0 109.824 178.622 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 41.4 ttt180 -152.11 133.54 14.54 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 119.917 -0.713 . . . . 0.0 112.804 179.843 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 56.77 46.91 19.1 Favored 'General case' 0 N--CA 1.464 0.233 0 N-CA-C 114.034 1.124 . . . . 0.0 114.034 176.763 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 83.16 -26.82 4.21 Favored Glycine 0 CA--C 1.523 0.569 0 C-N-CA 120.417 -0.897 . . . . 0.0 113.01 177.166 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 4.7 mt -89.56 153.34 20.85 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 117.528 0.664 . . . . 0.0 110.514 -179.06 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 79.4 mt -126.88 135.62 51.21 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.995 -179.256 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . 0.507 ' HA3' ' CE2' ' A' ' 77' ' ' TRP . . . -106.07 149.14 16.61 Favored Glycine 0 N--CA 1.454 -0.123 0 N-CA-C 109.75 -1.34 . . . . 0.0 109.75 178.906 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . 0.702 ' CB ' HD12 ' A' ' 73' ' ' ILE . 78.7 m-85 -142.05 142.93 32.89 Favored 'General case' 0 C--N 1.32 -0.697 0 C-N-CA 120.824 -0.35 . . . . 0.0 110.626 -179.748 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 23.9 tt0 -103.73 128.59 51.08 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 179.246 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . 0.503 ' HA ' HG22 ' A' ' 73' ' ' ILE . 14.7 t -68.43 120.85 15.17 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.087 0.47 . . . . 0.0 111.84 -178.463 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -95.52 -36.98 11.08 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.366 179.561 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . 0.569 ' ND1' ' N ' ' A' ' 90' ' ' ILE . 0.0 OUTLIER -161.74 141.92 10.43 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.185 179.981 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.569 ' N ' ' ND1' ' A' ' 89' ' ' HIS . 6.3 tt -145.22 140.87 22.74 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-O 121.239 0.543 . . . . 0.0 110.058 -179.251 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -55.44 143.62 28.41 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-N 115.244 -0.889 . . . . 0.0 112.109 -178.325 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 3.8 tt -54.49 -42.07 70.31 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.166 -0.925 . . . . 0.0 109.956 -179.686 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -68.89 -38.7 79.8 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.604 -0.517 . . . . 0.0 109.604 179.206 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . 0.421 ' HB3' HG23 ' A' ' 69' ' ' ILE . 7.4 m -64.75 -36.2 83.52 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.779 -0.646 . . . . 0.0 109.59 179.14 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 24.1 mt -59.0 -38.36 73.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.648 -0.705 . . . . 0.0 109.998 179.677 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -71.25 -42.29 69.0 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 120.312 -0.555 . . . . 0.0 111.283 -179.189 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' HIS . . . . . 0.45 ' O ' ' HB2' ' A' ' 100' ' ' ARG . 62.0 m-70 -61.94 -38.41 88.35 Favored 'General case' 0 C--N 1.325 -0.486 0 C-N-CA 119.638 -0.825 . . . . 0.0 109.49 -179.757 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.42 -34.18 76.71 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 178.139 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 48.1 mtt-85 -65.36 -38.06 88.93 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 108.362 -0.977 . . . . 0.0 108.362 177.719 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . 0.45 ' HB2' ' O ' ' A' ' 97' ' ' HIS . 1.6 mtp180 -61.44 -45.96 92.08 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 115.102 -0.954 . . . . 0.0 110.659 178.06 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -59.08 -37.9 78.19 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 -179.503 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . 0.528 HG22 HG13 ' A' ' 14' ' ' ILE . 70.0 t -68.6 -47.79 75.13 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 115.648 -0.706 . . . . 0.0 111.278 -179.955 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -65.67 -42.12 91.7 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.757 -179.079 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.455 ' CD2' ' N ' ' A' ' 104' ' ' LEU . 2.4 mm? -73.37 -40.31 64.46 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.611 -0.268 . . . . 0.0 111.179 -179.534 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . 0.434 ' OD1' ' CG2' ' A' ' 14' ' ' ILE . 2.2 m120 -69.02 -47.72 64.75 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 120.844 -0.342 . . . . 0.0 110.599 -179.866 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.628 HD21 ' HB1' ' A' ' 117' ' ' ALA . 8.5 tp -55.96 -30.64 62.03 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.491 -179.895 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 125.89 134.33 4.07 Favored Glycine 0 CA--C 1.524 0.627 0 N-CA-C 110.786 -0.926 . . . . 0.0 110.786 179.903 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . 0.704 ' O ' HD21 ' A' ' 111' ' ' LEU . 7.1 m-20 -71.82 -13.07 61.58 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.871 0.367 . . . . 0.0 110.274 179.812 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . 0.512 ' N ' ' OE1' ' A' ' 109' ' ' GLU . 30.6 mp0 -93.95 10.31 33.94 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.699 -179.849 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 80.7 mm-40 -140.6 67.75 1.36 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.624 179.915 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . 0.962 ' H ' HD22 ' A' ' 111' ' ' LEU . 0.4 OUTLIER -84.5 -12.97 53.24 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.268 179.753 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.449 ' O ' ' HB2' ' A' ' 117' ' ' ALA . 1.5 mt -52.67 98.16 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.579 -179.852 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . 0.551 ' CD ' ' H ' ' A' ' 113' ' ' GLU . 0.1 OUTLIER -68.74 171.54 7.65 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.384 179.706 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . 0.496 ' CB ' ' O ' ' A' ' 113' ' ' GLU . 0.1 OUTLIER 83.58 -174.56 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.456 179.957 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . 0.478 ' H ' ' HG3' ' A' ' 114' ' ' ARG . 7.7 pt-20 -54.38 -7.44 0.15 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.852 -179.834 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.475 ' O ' HG23 ' A' ' 120' ' ' VAL . 8.0 mp -65.14 -49.43 69.95 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.119 0.485 . . . . 0.0 110.464 -179.886 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 117' ' ' ALA . . . . . 0.628 ' HB1' HD21 ' A' ' 106' ' ' LEU . . . -62.0 -50.43 72.09 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.456 -0.793 . . . . 0.0 112.897 -178.9 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.57 HD22 ' CG ' ' A' ' 11' ' ' PHE . 2.4 mt -57.0 -48.62 78.03 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.033 -0.531 . . . . 0.0 112.149 -177.464 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 17.6 mt -73.6 -50.47 20.99 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 119.716 -0.794 . . . . 0.0 110.401 179.615 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . 0.485 ' O ' HG12 ' A' ' 120' ' ' VAL . 55.0 t -66.57 -13.91 16.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 N-CA-C 112.644 0.609 . . . . 0.0 112.644 -178.325 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 121' ' ' SER . . . . . 0.481 ' OG ' ' O ' ' A' ' 118' ' ' LEU . 7.3 p -64.81 -39.81 94.2 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 120.167 -0.613 . . . . 0.0 111.276 -178.389 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -165.71 159.82 16.68 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.388 -0.525 . . . . 0.0 111.257 179.729 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . 0.849 ' CG ' ' H ' ' A' ' 124' ' ' ASP . 12.2 p80 -171.2 -72.15 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.392 -179.726 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . 0.849 ' H ' ' CG ' ' A' ' 123' ' ' HIS . 31.4 t0 -116.38 45.99 1.68 Allowed 'General case' 0 C--N 1.334 -0.099 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.668 -179.61 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 125' ' ' ASP . . . . . 0.466 ' CB ' ' O ' ' A' ' 124' ' ' ASP . 0.5 OUTLIER . . . . . 0 C--O 1.22 -0.453 0 CA-C-O 117.945 -1.026 . . . . 0.0 110.071 -179.879 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 501' ' ' C2E . . . . . 0.967 ' O21' " H4'" ' A' ' 501' ' ' C2E . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 502' ' ' C2E . . . . . 0.678 ' C61' ' H ' ' A' ' 8' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.637 ' O ' ' CB ' ' A' ' 2' ' ' SER . 4.4 ptt? . . . . . 0 N--CA 1.491 1.578 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.637 ' CB ' ' O ' ' A' ' 1' ' ' MET . 16.5 m 112.28 -166.73 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.665 0 O-C-N 123.806 0.691 . . . . 0.0 110.683 179.922 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 11.1 p-10 -99.54 42.09 1.12 Allowed 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.125 178.811 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.417 ' HA ' ' NE2' ' A' ' 4' ' ' GLN . 7.4 tp60 -115.25 14.36 16.87 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.241 177.841 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . 0.589 ' NE2' ' N ' ' A' ' 1' ' ' MET . 2.7 m170 -92.19 -4.3 54.37 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.801 179.946 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -47.88 152.45 0.76 Allowed 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 179.864 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -91.27 132.44 36.13 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 120.173 -0.611 . . . . 0.0 111.384 -179.277 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.7 HH21 ' C21' ' A' ' 501' ' ' C2E . 0.0 OUTLIER -121.52 -5.89 9.25 Favored 'General case' 0 CA--C 1.529 0.137 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.968 -179.573 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.554 ' O ' ' C ' ' A' ' 10' ' ' ARG . 1.6 ptt85 -105.56 133.94 49.48 Favored 'General case' 0 N--CA 1.465 0.289 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 179.136 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.554 ' C ' ' O ' ' A' ' 9' ' ' ARG . 0.4 OUTLIER -22.67 -67.66 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.607 -179.516 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . 0.41 ' O ' ' O ' ' A' ' 12' ' ' HIS . 7.2 p90 -151.03 158.83 44.61 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.823 0.344 . . . . 0.0 110.698 179.076 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . 0.433 ' HE2' ' CD ' ' A' ' 115' ' ' GLU . 0.0 OUTLIER -43.35 167.59 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.294 179.635 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -117.93 166.34 12.62 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 120.9 0.381 . . . . 0.0 110.799 -179.99 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.522 HG13 HG22 ' A' ' 102' ' ' VAL . 39.5 mm -71.09 97.51 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.02 179.424 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -95.07 120.04 34.6 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.513 0.673 . . . . 0.0 111.649 -179.351 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 2.2 p90 -149.99 158.05 43.77 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 108.146 -1.057 . . . . 0.0 108.146 177.659 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . 0.482 ' OD1' ' N ' ' A' ' 18' ' ' ALA . 23.7 t0 -95.62 146.18 24.68 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 120.049 -0.661 . . . . 0.0 111.085 -178.822 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.482 ' N ' ' OD1' ' A' ' 17' ' ' ASP . . . -179.16 175.79 0.93 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.06 179.392 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -96.17 134.11 39.65 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.688 -179.676 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.639 ' O ' ' O ' ' A' ' 31' ' ' VAL . 5.8 p -135.47 157.21 47.46 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.142 179.044 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.519 ' HB3' ' NH1' ' A' ' 28' ' ' ARG . 50.2 mt-10 -142.04 145.56 34.52 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 179.168 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 28.1 mt -123.01 136.39 59.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-O 121.168 0.508 . . . . 0.0 111.787 -178.235 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.493 ' H ' HD12 ' A' ' 23' ' ' LEU . 0.2 OUTLIER -119.58 123.38 43.79 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.562 -0.744 . . . . 0.0 110.603 179.919 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.425 ' O ' ' OE1' ' A' ' 24' ' ' GLN . 1.5 tm0? -130.51 101.91 5.92 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.404 -0.817 . . . . 0.0 109.671 178.929 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 80.33 -126.79 7.59 Favored Glycine 0 CA--C 1.524 0.624 0 N-CA-C 109.949 -1.26 . . . . 0.0 109.949 -178.715 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.3 pt-20 -100.66 11.96 38.42 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.872 0.367 . . . . 0.0 110.047 179.57 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.52 ' HB3' ' CZ2' ' A' ' 29' ' ' TRP . 38.4 mtt-85 -114.58 136.0 53.52 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 112.771 0.656 . . . . 0.0 112.771 -178.036 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.777 ' CG ' HH11 ' A' ' 28' ' ' ARG . 0.0 OUTLIER -128.11 149.64 50.32 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.261 179.1 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.539 ' NE1' ' O ' ' A' ' 48' ' ' ASP . 6.7 m-90 -146.74 155.03 42.08 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.454 -0.794 . . . . 0.0 110.297 -179.477 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 11.9 mt-10 -100.33 136.61 39.95 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.042 -0.526 . . . . 0.0 109.912 179.502 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.639 ' O ' ' O ' ' A' ' 20' ' ' SER . 17.1 m -147.38 156.93 9.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-O 121.25 0.547 . . . . 0.0 111.167 -179.552 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 1.072 ' H ' HD23 ' A' ' 32' ' ' LEU . 1.4 pt? -95.88 130.29 42.88 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 108.817 -0.808 . . . . 0.0 108.817 178.498 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.6 tt -91.7 126.0 36.63 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.267 0.556 . . . . 0.0 110.092 -179.527 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 74.5 m-70 -91.95 -27.45 17.87 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.276 -0.875 . . . . 0.0 111.803 -178.531 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -173.7 161.14 3.85 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 119.574 -0.85 . . . . 0.0 111.317 177.576 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.525 HG22 ' N ' ' A' ' 37' ' ' SER . 5.6 p -144.57 168.84 9.51 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.118 0 CA-C-N 115.584 -0.735 . . . . 0.0 111.067 -179.09 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.525 ' N ' HG22 ' A' ' 36' ' ' VAL . 10.8 m -142.28 169.65 17.19 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 107.982 -1.118 . . . . 0.0 107.982 178.518 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.586 ' H ' HD12 ' A' ' 38' ' ' LEU . 2.0 mp -65.57 -1.21 2.45 Favored 'General case' 0 C--N 1.324 -0.517 0 C-N-CA 119.583 -0.847 . . . . 0.0 110.305 -179.803 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . 0.532 ' NE2' ' NH1' ' A' ' 10' ' ' ARG . 47.7 p-80 -163.11 41.25 0.1 Allowed 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 120.748 -0.381 . . . . 0.0 111.469 179.813 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -176.07 152.24 12.66 Favored Glycine 0 CA--C 1.525 0.661 0 N-CA-C 110.997 -0.841 . . . . 0.0 110.997 179.835 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -147.31 148.67 16.31 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.208 0 CA-C-O 121.495 0.664 . . . . 0.0 111.647 -179.135 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -121.76 140.33 52.47 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 114.836 -1.075 . . . . 0.0 108.719 178.977 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.2 m -144.11 175.13 3.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-O 121.328 0.585 . . . . 0.0 111.752 -179.441 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -97.15 144.57 17.41 Favored Glycine 0 CA--C 1.529 0.938 0 N-CA-C 109.247 -1.541 . . . . 0.0 109.247 178.01 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . 0.551 HE21 ' C ' ' A' ' 45' ' ' GLN . 0.0 OUTLIER -87.42 115.6 63.33 Favored Pre-proline 0 N--CA 1.464 0.274 0 CA-C-N 118.127 0.963 . . . . 0.0 111.75 -178.431 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 79.4 Cg_endo -86.07 162.22 10.16 Favored 'Trans proline' 0 C--N 1.307 -1.65 0 C-N-CA 121.765 1.643 . . . . 0.0 111.462 178.931 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.498 ' OE1' ' N ' ' A' ' 47' ' ' GLN . 25.9 mp0 -65.28 -40.24 93.64 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 112.153 0.427 . . . . 0.0 112.153 -179.0 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.539 ' O ' ' NE1' ' A' ' 29' ' ' TRP . 16.4 m-20 -72.56 8.41 1.44 Allowed 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.05 0.389 . . . . 0.0 112.05 -178.538 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' TRP . . . . . 0.448 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 60.7 t-105 -61.45 68.43 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 111.696 0.258 . . . . 0.0 111.696 -179.657 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.52 ' N ' ' O ' ' A' ' 48' ' ' ASP . 0.5 OUTLIER -93.28 78.98 4.47 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 120.023 -0.671 . . . . 0.0 109.682 178.688 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -141.77 158.22 26.57 Favored Glycine 0 CA--C 1.525 0.696 0 N-CA-C 111.369 -0.692 . . . . 0.0 111.369 -179.501 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 33.7 t0 -93.99 111.49 53.26 Favored Pre-proline 0 CA--C 1.533 0.311 0 CA-C-N 115.744 -0.228 . . . . 0.0 110.774 -179.89 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 76.7 Cg_exo -47.24 -22.28 2.31 Favored 'Trans proline' 0 N--CA 1.496 1.63 0 C-N-CA 122.597 2.198 . . . . 0.0 112.413 179.858 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 37.3 mt-30 -79.13 -24.01 43.64 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.82 -178.581 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.55 ' O ' ' CE1' ' A' ' 57' ' ' PHE . 3.0 mpt_? -94.82 151.4 38.99 Favored Pre-proline 0 C--N 1.33 -0.257 0 C-N-CA 120.581 -0.448 . . . . 0.0 109.962 179.69 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 35.3 Cg_endo -64.3 160.86 36.83 Favored 'Trans proline' 0 N--CA 1.495 1.6 0 C-N-CA 122.816 2.344 . . . . 0.0 113.285 -178.77 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.55 ' CE1' ' O ' ' A' ' 55' ' ' ARG . 44.5 m-85 -130.5 155.68 46.06 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 114.991 -1.004 . . . . 0.0 109.005 179.419 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -121.61 134.46 55.0 Favored 'General case' 0 C--O 1.22 -0.452 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 178.728 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . 0.555 ' HB2' HD13 ' A' ' 73' ' ' ILE . . . -115.86 135.66 53.79 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.113 0.483 . . . . 0.0 112.108 -178.454 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.46 ' NE ' HD13 ' A' ' 23' ' ' LEU . 2.4 mpt_? -121.35 127.72 51.54 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 177.361 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 10.6 mt -108.93 137.15 47.3 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.914 0.387 . . . . 0.0 110.636 -179.061 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' TYR . . . . . 0.613 ' CD1' ' N ' ' A' ' 62' ' ' TYR . 1.0 OUTLIER -120.34 110.21 16.28 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.348 179.785 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.528 ' C ' HD23 ' A' ' 63' ' ' LEU . 2.2 tt -104.54 -84.55 0.48 Allowed 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.413 179.401 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.45 ' H ' ' HB ' ' A' ' 67' ' ' VAL . . . -76.52 -176.89 43.17 Favored Glycine 0 CA--C 1.521 0.455 0 N-CA-C 109.503 -1.439 . . . . 0.0 109.503 178.62 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 3.2 mt -76.11 -32.22 59.07 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.015 -0.674 . . . . 0.0 110.319 -179.703 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.446 ' N ' ' OD1' ' A' ' 66' ' ' ASP . 1.3 m-20 -104.06 8.8 36.58 Favored 'General case' 0 C--N 1.332 -0.191 0 C-N-CA 122.759 0.424 . . . . 0.0 111.105 -179.913 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.55 ' O ' HG12 ' A' ' 67' ' ' VAL . 9.3 t -103.34 95.05 3.54 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.296 0 CA-C-O 121.529 0.681 . . . . 0.0 111.8 -178.759 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -112.15 117.74 33.43 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 114.753 -1.112 . . . . 0.0 108.259 178.208 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.534 HG23 ' CB ' ' A' ' 94' ' ' SER . 6.0 mt -113.9 143.62 23.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.887 0.375 . . . . 0.0 110.562 -179.043 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 11.6 mtm180 -128.26 131.26 48.76 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.914 179.191 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 2.2 mtp -140.39 148.88 41.92 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.917 -0.583 . . . . 0.0 109.945 179.651 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . 0.417 ' HB2' ' CD2' ' A' ' 89' ' ' HIS . 12.0 tm-20 -102.39 134.71 45.26 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 107.48 -1.304 . . . . 0.0 107.48 178.247 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.555 HD13 ' HB2' ' A' ' 59' ' ' ALA . 5.3 pt -143.97 157.46 15.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 N-CA-C 113.472 0.916 . . . . 0.0 113.472 -177.352 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -121.18 150.17 41.71 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 114.759 -1.109 . . . . 0.0 109.444 178.604 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.572 HD12 ' CE1' ' A' ' 85' ' ' PHE . 8.7 tp -66.71 123.76 21.01 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.265 0.555 . . . . 0.0 110.242 -179.638 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -98.0 -43.99 6.84 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 115.05 -0.977 . . . . 0.0 111.011 178.138 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' TRP . . . . . 0.586 ' NE1' ' HA3' ' A' ' 84' ' ' GLY . 68.0 p-90 -168.63 168.06 11.06 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.047 -179.13 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -146.45 123.72 11.57 Favored 'General case' 0 N--CA 1.464 0.257 0 N-CA-C 109.804 -0.443 . . . . 0.0 109.804 178.291 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . 0.408 ' NH1' " O2'" ' A' ' 502' ' ' C2E . 6.7 ttt-85 -152.26 133.93 14.69 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 119.922 -0.711 . . . . 0.0 112.906 179.979 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 56.64 47.16 18.95 Favored 'General case' 0 N--CA 1.465 0.285 0 N-CA-C 113.649 0.981 . . . . 0.0 113.649 176.752 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 81.78 -26.49 3.66 Favored Glycine 0 CA--C 1.522 0.529 0 C-N-CA 120.506 -0.854 . . . . 0.0 113.104 177.386 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 4.7 mt -89.6 153.79 20.48 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 117.685 0.742 . . . . 0.0 110.447 -179.289 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 43.5 mt -126.27 135.5 51.62 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.981 -179.395 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . 0.586 ' HA3' ' NE1' ' A' ' 77' ' ' TRP . . . -98.83 152.61 19.72 Favored Glycine 0 N--CA 1.451 -0.31 0 N-CA-C 109.949 -1.26 . . . . 0.0 109.949 178.963 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . 0.572 ' CE1' HD12 ' A' ' 75' ' ' LEU . 40.7 m-85 -145.51 136.69 24.85 Favored 'General case' 0 C--N 1.319 -0.753 0 C-N-CA 120.673 -0.411 . . . . 0.0 111.017 -179.227 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.458 ' O ' ' NE2' ' A' ' 88' ' ' GLN . 31.5 tt0 -103.66 127.61 51.08 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 179.231 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 3.7 t -73.76 124.81 26.76 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.062 0.458 . . . . 0.0 112.042 -178.445 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . 0.458 ' NE2' ' O ' ' A' ' 86' ' ' GLU . 39.1 mm-40 -99.41 -32.12 11.31 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.692 -0.685 . . . . 0.0 110.228 179.277 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . 0.57 ' ND1' ' C ' ' A' ' 89' ' ' HIS . 0.0 OUTLIER -161.75 141.8 10.35 Favored 'General case' 0 C--O 1.225 -0.222 0 CA-C-O 121.033 0.444 . . . . 0.0 110.151 179.433 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.452 HG23 ' CG1' ' A' ' 95' ' ' ILE . 5.7 tt -145.66 141.29 22.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-O 121.436 0.636 . . . . 0.0 110.151 -179.577 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . 0.509 ' N ' ' OD1' ' A' ' 91' ' ' ASP . 0.0 OUTLIER -54.07 140.28 32.27 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 114.873 -1.058 . . . . 0.0 112.125 -178.39 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 16.6 tp -54.18 -41.87 69.04 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.043 -0.98 . . . . 0.0 110.01 -179.78 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -69.67 -40.2 76.55 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 179.252 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . 0.534 ' CB ' HG23 ' A' ' 69' ' ' ILE . 4.0 m -64.48 -35.87 82.35 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.956 179.459 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . 0.452 ' CG1' HG23 ' A' ' 90' ' ' ILE . 30.4 mt -58.51 -37.41 64.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 115.888 -0.597 . . . . 0.0 109.786 179.487 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -70.74 -41.86 71.27 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.148 -179.121 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 64.3 m-70 -61.75 -36.3 80.61 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 119.41 -0.916 . . . . 0.0 109.365 179.941 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.447 ' O ' HG23 ' A' ' 102' ' ' VAL . 5.4 mp -67.57 -33.72 75.59 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 177.763 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 2.4 mtp180 -64.29 -36.76 85.16 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 178.324 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . 0.414 ' HG2' HH11 ' A' ' 100' ' ' ARG . 20.7 mtt-85 -60.36 -45.85 92.02 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.962 179.043 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.465 ' O ' ' ND2' ' A' ' 105' ' ' ASN . 2.8 mt -63.04 -34.94 78.66 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 -179.822 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . 0.522 HG22 HG13 ' A' ' 14' ' ' ILE . 79.1 t -68.4 -42.38 84.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.604 179.658 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 73.9 mt-10 -65.17 -44.92 86.96 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.771 -179.227 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 30.2 mt -70.43 -43.13 70.57 Favored 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 120.546 -0.462 . . . . 0.0 111.522 -178.718 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . 0.465 ' ND2' ' O ' ' A' ' 101' ' ' LEU . 1.9 m-80 -68.28 -25.84 65.36 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 120.705 -0.398 . . . . 0.0 110.895 -179.438 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 13.1 tp -55.9 -29.42 60.01 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.927 0.394 . . . . 0.0 110.201 179.802 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 104.33 149.68 20.09 Favored Glycine 0 CA--C 1.524 0.602 0 N-CA-C 110.913 -0.875 . . . . 0.0 110.913 179.979 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 88.5 m-20 -77.38 -42.4 36.56 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.814 0.34 . . . . 0.0 110.552 -179.949 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -48.68 130.0 17.07 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.398 -179.958 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 69.4 mm-40 -88.68 80.62 7.22 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.71 179.985 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 8.0 mt -58.95 134.43 56.94 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.547 179.987 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.409 HD13 ' HA ' ' A' ' 112' ' ' LEU . 4.1 mm? -55.92 -23.12 29.71 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.358 179.827 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -135.02 174.17 10.91 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.229 -179.996 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . 0.408 ' C ' ' H ' ' A' ' 116' ' ' LEU . 10.0 ptm180 -177.75 172.85 1.67 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.721 -179.902 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . 0.433 ' CD ' ' HE2' ' A' ' 12' ' ' HIS . 56.9 mt-10 -73.89 41.04 0.12 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.956 -179.656 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.408 ' H ' ' C ' ' A' ' 114' ' ' ARG . 1.4 mt -67.68 -40.49 84.42 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 112.483 0.549 . . . . 0.0 112.483 -179.015 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 117' ' ' ALA . . . . . 0.578 ' O ' HG23 ' A' ' 120' ' ' VAL . . . -70.78 -26.51 63.37 Favored 'General case' 0 N--CA 1.463 0.217 0 N-CA-C 112.218 0.451 . . . . 0.0 112.218 179.803 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.408 ' C ' ' N ' ' A' ' 120' ' ' VAL . 6.8 mt -56.36 -36.58 68.96 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 120.607 -0.437 . . . . 0.0 111.651 -177.59 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . 0.428 ' O ' ' O ' ' A' ' 122' ' ' ALA . 12.7 mt -55.52 -10.84 0.72 Allowed 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 119.965 -0.694 . . . . 0.0 110.153 -178.147 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . 0.578 HG23 ' O ' ' A' ' 117' ' ' ALA . 21.0 t -56.52 -14.27 1.85 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.422 179.977 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 4.9 p -78.52 -32.25 47.93 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.516 179.961 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . 0.428 ' O ' ' O ' ' A' ' 119' ' ' LEU . . . -163.94 158.34 19.62 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.368 -179.9 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . 0.704 ' CG ' ' H ' ' A' ' 124' ' ' ASP . 19.5 p80 -116.78 -61.93 1.65 Allowed 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.729 179.967 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . 0.704 ' H ' ' CG ' ' A' ' 123' ' ' HIS . 3.8 m-20 61.17 18.02 8.69 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.919 0.39 . . . . 0.0 110.281 -179.741 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 125' ' ' ASP . . . . . 0.416 ' OD1' ' O ' ' A' ' 125' ' ' ASP . 49.9 t0 . . . . . 0 C--O 1.22 -0.49 0 CA-C-O 118.036 -0.983 . . . . 0.0 110.557 179.962 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 501' ' ' C2E . . . . . 0.7 ' C21' HH21 ' A' ' 8' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 502' ' ' C2E . . . . . 0.505 ' C4 ' ' CE2' ' A' ' 77' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.466 ' O ' ' OG ' ' A' ' 2' ' ' SER . 15.2 ttt . . . . . 0 N--CA 1.49 1.534 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.466 ' OG ' ' O ' ' A' ' 1' ' ' MET . 3.6 m -169.85 19.21 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.716 179.806 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 95.1 m-20 -98.22 109.52 22.26 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 179.26 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.756 ' H ' ' NE2' ' A' ' 4' ' ' GLN . 0.0 OUTLIER -109.53 14.59 23.44 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.476 -0.784 . . . . 0.0 109.855 179.613 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . 0.65 ' CD2' ' O ' ' A' ' 4' ' ' GLN . 1.5 p-80 41.95 17.3 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.414 -179.215 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . 0.595 ' O ' ' CZ ' ' A' ' 8' ' ' ARG . 0.5 OUTLIER 39.82 83.43 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.467 179.745 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.496 ' CD ' ' O ' ' A' ' 7' ' ' GLU . 0.3 OUTLIER -88.65 128.64 35.6 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 120.306 -0.558 . . . . 0.0 110.5 -179.69 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.652 ' NH2' ' C21' ' A' ' 501' ' ' C2E . 0.0 OUTLIER -125.65 -8.26 6.8 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.235 -179.19 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.733 ' O ' ' N ' ' A' ' 11' ' ' PHE . 2.1 ptt85 -110.87 96.91 6.45 Favored 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 120.919 -0.312 . . . . 0.0 110.174 179.977 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.765 ' NH1' ' H ' ' A' ' 124' ' ' ASP . 0.0 OUTLIER 16.71 -74.01 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 115.171 -0.922 . . . . 0.0 111.19 -179.658 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . 0.733 ' N ' ' O ' ' A' ' 9' ' ' ARG . 0.1 OUTLIER -150.36 170.47 18.96 Favored 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 179.338 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . 0.441 ' CD2' ' N ' ' A' ' 12' ' ' HIS . 0.2 OUTLIER -43.23 161.19 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.867 0.365 . . . . 0.0 110.702 -179.826 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.433 ' O ' ' N ' ' A' ' 15' ' ' ALA . 21.2 mtm180 -111.57 147.82 34.6 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.185 -179.906 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.678 HG12 HG22 ' A' ' 102' ' ' VAL . 1.3 mp -53.8 92.39 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 179.705 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.433 ' N ' ' O ' ' A' ' 13' ' ' ARG . . . -95.65 120.06 35.23 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.486 0.66 . . . . 0.0 112.134 -179.039 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 6.4 p90 -149.85 158.6 44.32 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 107.968 -1.123 . . . . 0.0 107.968 177.183 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -95.33 146.32 24.46 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 120.138 -0.625 . . . . 0.0 110.943 -178.809 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -178.92 176.37 0.92 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.863 179.427 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -96.62 133.82 40.63 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.831 -179.829 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.572 ' O ' ' O ' ' A' ' 31' ' ' VAL . 13.0 t -133.74 152.92 52.01 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 121.103 0.478 . . . . 0.0 110.255 178.617 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 91.0 mt-10 -132.32 151.8 51.68 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 179.497 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.406 ' HA ' ' O ' ' A' ' 58' ' ' GLU . 79.5 mt -132.71 136.38 55.92 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.468 0 C-N-CA 120.066 -0.654 . . . . 0.0 111.427 -179.568 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.522 HD13 ' NE ' ' A' ' 60' ' ' ARG . 0.2 OUTLIER -123.45 123.35 40.46 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.33 -0.85 . . . . 0.0 111.054 -179.398 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.548 ' OE1' ' CE2' ' A' ' 57' ' ' PHE . 18.8 tt0 -129.58 102.05 6.2 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.428 -0.805 . . . . 0.0 109.614 178.472 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 80.3 -127.22 7.82 Favored Glycine 0 CA--C 1.523 0.561 0 N-CA-C 109.847 -1.301 . . . . 0.0 109.847 -178.781 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.434 ' OE1' ' O ' ' A' ' 26' ' ' GLU . 2.9 pp20? -100.04 12.2 37.48 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.969 0.414 . . . . 0.0 110.095 179.434 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.521 ' HB3' ' CZ2' ' A' ' 29' ' ' TRP . 27.5 mtt-85 -113.77 135.25 54.16 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.883 -0.599 . . . . 0.0 112.605 -178.401 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.435 ' HG3' ' N ' ' A' ' 29' ' ' TRP . 11.1 ttt-85 -129.01 150.48 50.4 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.169 179.132 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.521 ' CZ2' ' HB3' ' A' ' 27' ' ' ARG . 6.7 m-90 -147.94 156.18 42.39 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.518 -179.365 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 12.4 mt-10 -99.9 138.09 37.45 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 178.978 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.572 ' O ' ' O ' ' A' ' 20' ' ' SER . 11.0 m -147.77 157.37 9.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-O 121.255 0.55 . . . . 0.0 111.214 -179.255 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 1.009 ' H ' HD23 ' A' ' 32' ' ' LEU . 0.6 OUTLIER -98.01 130.61 44.83 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 108.428 -0.953 . . . . 0.0 108.428 178.499 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.6 tt -94.35 125.05 38.75 Favored 'General case' 0 C--N 1.324 -0.524 0 C-N-CA 120.385 -0.526 . . . . 0.0 109.786 -179.679 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 16.1 m-70 -90.7 -27.16 19.17 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.469 -0.787 . . . . 0.0 111.764 -178.341 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 -172.62 160.81 4.75 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 119.566 -0.854 . . . . 0.0 111.084 177.498 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.54 HG22 ' H ' ' A' ' 37' ' ' SER . 4.8 p -145.33 169.34 7.45 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.004 -178.965 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.54 ' H ' HG22 ' A' ' 36' ' ' VAL . 24.9 t -141.64 167.84 21.19 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 107.883 -1.154 . . . . 0.0 107.883 178.262 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.634 ' H ' HD23 ' A' ' 38' ' ' LEU . 0.1 OUTLIER -64.77 -1.57 2.01 Favored 'General case' 0 C--N 1.321 -0.669 0 C-N-CA 119.95 -0.7 . . . . 0.0 110.562 -179.259 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . 0.553 ' NE2' ' O ' ' A' ' 87' ' ' CYS . 19.9 t60 -159.14 41.68 0.23 Allowed 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 120.786 -0.366 . . . . 0.0 111.397 -179.523 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . 0.416 ' HA3' ' N3 ' ' A' ' 501' ' ' C2E . . . 177.77 158.69 21.26 Favored Glycine 0 CA--C 1.527 0.798 0 N-CA-C 111.165 -0.774 . . . . 0.0 111.165 179.697 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.409 HG21 HG21 ' A' ' 73' ' ' ILE . 0.1 OUTLIER -148.56 148.95 15.53 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.321 0 CA-C-O 121.342 0.591 . . . . 0.0 111.584 -178.856 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.615 HD23 ' N ' ' A' ' 43' ' ' VAL . 1.6 tt -121.59 136.19 54.96 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 115.177 -0.92 . . . . 0.0 108.706 178.729 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.615 ' N ' HD23 ' A' ' 42' ' ' LEU . 24.0 m -141.33 174.84 6.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-O 121.294 0.568 . . . . 0.0 111.964 -179.295 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -98.19 144.81 17.47 Favored Glycine 0 CA--C 1.529 0.912 0 N-CA-C 109.215 -1.554 . . . . 0.0 109.215 178.049 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . 0.578 ' CD ' ' O ' ' A' ' 45' ' ' GLN . 3.8 pp0? -88.03 116.72 67.05 Favored Pre-proline 0 CA--C 1.535 0.37 0 CA-C-N 118.078 0.939 . . . . 0.0 111.723 -178.349 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -84.82 162.57 12.09 Favored 'Trans proline' 0 C--N 1.305 -1.73 0 C-N-CA 121.384 1.389 . . . . 0.0 110.91 178.595 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 7.5 mp0 -64.52 -40.18 95.16 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.698 0.285 . . . . 0.0 111.539 -178.965 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.521 ' O ' ' NE1' ' A' ' 29' ' ' TRP . 1.0 OUTLIER -70.45 8.64 0.77 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.821 -179.058 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' TRP . . . . . 0.461 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 60.7 t-105 -63.3 67.72 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 120.742 -0.383 . . . . 0.0 111.725 -179.39 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.573 ' C ' HD22 ' A' ' 50' ' ' ASN . 0.5 OUTLIER -93.08 78.84 4.58 Favored 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 120.332 -0.547 . . . . 0.0 109.932 178.857 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -141.21 160.16 26.76 Favored Glycine 0 CA--C 1.525 0.696 0 N-CA-C 111.462 -0.655 . . . . 0.0 111.462 -179.528 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . 0.436 ' OD1' ' OE1' ' A' ' 54' ' ' GLN . 25.7 t0 -95.46 110.73 52.39 Favored Pre-proline 0 CA--C 1.533 0.326 0 CA-C-N 115.79 -0.205 . . . . 0.0 110.739 -179.873 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 71.4 Cg_exo -46.66 -22.66 1.92 Allowed 'Trans proline' 0 N--CA 1.496 1.671 0 C-N-CA 122.626 2.217 . . . . 0.0 112.751 -179.811 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.436 ' OE1' ' OD1' ' A' ' 52' ' ' ASP . 11.0 mp0 -80.29 -23.91 40.39 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 120.541 -0.464 . . . . 0.0 111.818 -178.968 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.539 ' O ' ' CE1' ' A' ' 57' ' ' PHE . 18.2 mtt-85 -92.72 151.03 40.63 Favored Pre-proline 0 C--N 1.331 -0.224 0 C-N-CA 120.354 -0.538 . . . . 0.0 109.736 179.563 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . 0.431 ' O ' ' OE1' ' A' ' 24' ' ' GLN . 35.7 Cg_endo -64.76 160.88 38.45 Favored 'Trans proline' 0 C--N 1.308 -1.594 0 C-N-CA 122.723 2.282 . . . . 0.0 113.187 -178.735 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.548 ' CE2' ' OE1' ' A' ' 24' ' ' GLN . 42.9 m-85 -130.34 154.4 47.7 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 114.889 -1.051 . . . . 0.0 108.897 179.178 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.406 ' O ' ' HA ' ' A' ' 22' ' ' ILE . 83.4 mt-10 -120.6 134.96 55.23 Favored 'General case' 0 N--CA 1.467 0.392 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 178.469 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . 0.486 ' HB2' ' CD1' ' A' ' 73' ' ' ILE . . . -117.0 137.28 52.33 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.212 0.529 . . . . 0.0 112.296 -178.187 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.522 ' NE ' HD13 ' A' ' 23' ' ' LEU . 0.9 OUTLIER -122.72 127.66 49.52 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.214 -0.903 . . . . 0.0 108.681 177.254 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 7.8 mt -110.66 139.01 46.32 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 120.73 -0.388 . . . . 0.0 110.419 -179.348 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' TYR . . . . . 0.5 ' CD1' ' N ' ' A' ' 62' ' ' TYR . 6.7 m-85 -120.27 111.24 17.54 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.935 -179.871 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.572 ' C ' HD23 ' A' ' 63' ' ' LEU . 5.8 tt -105.09 -83.51 0.51 Allowed 'General case' 0 N--CA 1.462 0.15 0 CA-C-N 115.849 -0.614 . . . . 0.0 109.492 179.14 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.453 ' H ' ' HB ' ' A' ' 67' ' ' VAL . . . -77.81 178.85 51.81 Favored Glycine 0 CA--C 1.523 0.542 0 N-CA-C 109.523 -1.431 . . . . 0.0 109.523 178.786 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.532 ' O ' HD23 ' A' ' 65' ' ' LEU . 0.9 OUTLIER -73.81 -33.23 64.09 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 119.898 -0.721 . . . . 0.0 110.119 -179.627 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 39.3 t0 -102.88 8.65 39.15 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.097 179.881 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.566 ' O ' HG12 ' A' ' 67' ' ' VAL . 7.7 t -104.75 96.27 4.46 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.284 0 CA-C-O 121.308 0.575 . . . . 0.0 111.927 -178.812 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 6.0 tp -113.01 117.17 31.28 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 108.172 -1.048 . . . . 0.0 108.172 178.1 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.495 HG23 ' CB ' ' A' ' 94' ' ' SER . 3.3 mt -111.91 143.69 21.2 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-O 120.818 0.342 . . . . 0.0 110.498 -179.061 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.412 ' C ' ' HG2' ' A' ' 71' ' ' MET . 24.7 mtm-85 -128.35 130.46 47.79 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.878 179.257 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . 0.807 ' SD ' HD12 ' A' ' 90' ' ' ILE . 0.9 OUTLIER -139.48 148.78 43.16 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.858 -0.61 . . . . 0.0 109.741 179.575 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 72.1 tt0 -102.28 129.48 48.71 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 107.798 -1.186 . . . . 0.0 107.798 178.448 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.486 ' CD1' ' HB2' ' A' ' 59' ' ' ALA . 13.8 pt -138.16 157.54 31.79 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 C-N-CA 119.637 -0.825 . . . . 0.0 113.138 -177.491 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . 0.587 ' N ' ' OE1' ' A' ' 88' ' ' GLN . 95.6 p -121.44 151.23 40.45 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 114.74 -1.118 . . . . 0.0 109.61 178.521 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.48 ' CD1' ' CZ ' ' A' ' 85' ' ' PHE . 8.0 tp -66.53 123.05 18.98 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.105 0.479 . . . . 0.0 110.431 -179.449 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -98.1 -44.38 6.64 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.964 178.042 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' TRP . . . . . 0.709 ' NE1' ' HA3' ' A' ' 84' ' ' GLY . 69.3 p-90 -164.95 170.55 15.11 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.185 -179.454 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -151.34 124.43 8.72 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 121.155 -0.218 . . . . 0.0 110.732 179.117 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . 0.552 ' NE ' " O2'" ' A' ' 502' ' ' C2E . 0.0 OUTLIER -151.95 131.68 13.19 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 112.933 0.716 . . . . 0.0 112.933 179.245 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 54.26 47.06 23.91 Favored 'General case' 0 N--CA 1.468 0.425 0 N-CA-C 113.791 1.034 . . . . 0.0 113.791 176.069 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 72.15 13.06 76.36 Favored Glycine 0 CA--C 1.522 0.503 0 C-N-CA 120.18 -1.01 . . . . 0.0 111.739 178.338 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 48.8 mt -116.91 138.06 51.79 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 178.818 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.488 HD11 ' CB ' ' A' ' 45' ' ' GLN . 29.7 mt -125.78 135.02 51.55 Favored 'General case' 0 CA--C 1.513 -0.456 0 C-N-CA 120.382 -0.527 . . . . 0.0 111.491 -178.98 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . 0.709 ' HA3' ' NE1' ' A' ' 77' ' ' TRP . . . -98.4 153.95 20.02 Favored Glycine 0 N--CA 1.447 -0.629 0 N-CA-C 109.334 -1.506 . . . . 0.0 109.334 178.381 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . 0.484 ' CG ' HD12 ' A' ' 73' ' ' ILE . 28.8 m-85 -145.39 131.94 19.82 Favored 'General case' 0 C--N 1.312 -1.045 0 C-N-CA 120.794 -0.362 . . . . 0.0 110.568 -179.274 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.501 ' O ' ' NE2' ' A' ' 88' ' ' GLN . 20.3 pt-20 -103.6 128.77 50.82 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 179.692 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . 0.553 ' O ' ' NE2' ' A' ' 39' ' ' HIS . 5.2 t -75.71 124.52 27.4 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 112.234 0.457 . . . . 0.0 112.234 -178.028 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . 0.695 ' CA ' HE21 ' A' ' 88' ' ' GLN . 0.0 OUTLIER -102.12 -30.42 11.16 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.088 179.124 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . 0.609 ' ND1' ' N ' ' A' ' 90' ' ' ILE . 0.0 OUTLIER -158.77 140.47 13.53 Favored 'General case' 0 C--O 1.225 -0.198 0 CA-C-O 120.989 0.424 . . . . 0.0 110.202 179.298 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.807 HD12 ' SD ' ' A' ' 71' ' ' MET . 6.2 tt -146.18 140.73 21.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.043 -179.384 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . 0.529 ' O ' ' OG ' ' A' ' 94' ' ' SER . 0.1 OUTLIER -53.94 142.27 25.14 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 115.308 -0.86 . . . . 0.0 111.993 -178.534 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 8.0 tp -54.37 -42.3 70.17 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.238 -0.892 . . . . 0.0 110.168 -179.831 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 3.6 p30 -69.03 -42.08 76.83 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.02 179.499 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . 0.529 ' OG ' ' O ' ' A' ' 91' ' ' ASP . 2.0 p -60.26 -37.74 81.37 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.975 179.606 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 63.5 mt -58.77 -38.12 70.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.128 179.53 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -70.42 -40.44 73.84 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 120.292 -0.563 . . . . 0.0 110.988 -178.87 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 68.1 m-70 -64.29 -44.23 92.31 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 119.978 -0.689 . . . . 0.0 109.847 179.923 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.676 ' O ' HG23 ' A' ' 102' ' ' VAL . 0.2 OUTLIER -68.13 -35.49 78.19 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.35 179.299 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.402 HH11 ' HD3' ' A' ' 99' ' ' ARG . 13.0 mtp-105 -66.22 -41.94 89.4 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 120.94 -0.304 . . . . 0.0 111.466 -179.688 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 3.6 ptm85 -68.95 -36.1 77.53 Favored 'General case' 0 C--N 1.331 -0.201 0 C-N-CA 120.162 -0.615 . . . . 0.0 109.587 177.606 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.557 HD21 HD12 ' A' ' 63' ' ' LEU . 2.2 mp -57.83 -34.91 70.19 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 177.443 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . 0.678 HG22 HG12 ' A' ' 14' ' ' ILE . 95.3 t -68.75 -45.44 81.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.195 179.232 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 -63.93 -35.59 81.17 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.644 179.898 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 9.1 mt -73.07 -42.55 62.93 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.576 -179.54 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -58.28 -50.5 73.38 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.444 179.892 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 9.3 mp -62.39 -25.23 67.82 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.272 179.939 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 110.93 -155.64 15.99 Favored Glycine 0 CA--C 1.522 0.501 0 N-CA-C 110.587 -1.005 . . . . 0.0 110.587 -179.877 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . 0.468 ' O ' ' N ' ' A' ' 110' ' ' GLU . 22.8 t70 -96.86 170.44 9.17 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.796 0.332 . . . . 0.0 110.351 179.877 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . 0.453 ' N ' ' CG ' ' A' ' 108' ' ' ASP . 0.0 OUTLIER -67.28 55.98 0.05 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.582 -179.957 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . 0.468 ' N ' ' O ' ' A' ' 108' ' ' ASP . 3.4 tt0 -46.46 174.7 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.445 179.932 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 1.4 mp -61.24 -33.13 73.01 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.743 -179.924 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.675 ' O ' HD23 ' A' ' 112' ' ' LEU . 0.4 OUTLIER -156.25 167.38 30.6 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.6 179.763 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . 0.42 ' O ' ' O ' ' A' ' 114' ' ' ARG . 19.3 tp10 -176.34 104.44 0.07 Allowed 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.602 179.96 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . 0.44 ' C ' ' H ' ' A' ' 116' ' ' LEU . 0.0 OUTLIER -53.09 -172.2 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.164 179.8 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . 0.41 ' OE1' ' CE1' ' A' ' 12' ' ' HIS . 5.2 mt-10 65.43 -0.55 1.15 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.975 0.416 . . . . 0.0 110.507 179.873 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.44 ' H ' ' C ' ' A' ' 114' ' ' ARG . 2.4 pp -67.27 -41.21 85.88 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.948 -179.689 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 117' ' ' ALA . . . . . 0.62 ' O ' HG23 ' A' ' 120' ' ' VAL . . . -69.13 -24.29 64.08 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 111.921 0.341 . . . . 0.0 111.921 -179.836 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 96.4 mt -55.13 -32.51 62.12 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 111.847 0.314 . . . . 0.0 111.847 -177.872 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . 0.531 ' C ' ' H ' ' A' ' 121' ' ' SER . 4.0 mm? -55.71 -16.95 4.88 Favored 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 119.961 -0.696 . . . . 0.0 109.465 -178.938 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . 0.639 ' O ' HG12 ' A' ' 120' ' ' VAL . 54.1 t -57.92 0.17 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.661 179.069 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 121' ' ' SER . . . . . 0.614 ' O ' ' HB3' ' A' ' 122' ' ' ALA . 8.2 t -69.85 -18.64 63.44 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.998 -0.547 . . . . 0.0 111.275 -179.604 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . 0.653 ' O ' ' O ' ' A' ' 123' ' ' HIS . . . 76.58 21.85 1.26 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.971 0.415 . . . . 0.0 110.083 -179.61 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . 0.653 ' O ' ' O ' ' A' ' 122' ' ' ALA . 0.1 OUTLIER 47.52 133.58 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 115.403 -0.817 . . . . 0.0 111.474 179.503 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . 0.765 ' H ' ' NH1' ' A' ' 10' ' ' ARG . 0.5 OUTLIER 32.45 26.82 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 115.653 -0.703 . . . . 0.0 111.848 179.286 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 125' ' ' ASP . . . . . 0.619 ' N ' ' O ' ' A' ' 123' ' ' HIS . 0.0 OUTLIER . . . . . 0 C--O 1.221 -0.434 0 CA-C-O 117.986 -1.007 . . . . 0.0 111.18 179.895 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 501' ' ' C2E . . . . . 0.918 ' O21' " H4'" ' A' ' 501' ' ' C2E . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 502' ' ' C2E . . . . . 0.576 ' C2 ' ' CD1' ' A' ' 77' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 6.6 mmt . . . . . 0 N--CA 1.489 1.522 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 7.9 t -119.14 116.77 27.03 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.412 -179.906 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -102.25 91.82 4.46 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 175.888 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.578 ' O ' ' NE2' ' A' ' 4' ' ' GLN . 0.0 OUTLIER -99.94 -34.4 10.13 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 120.832 -0.347 . . . . 0.0 111.718 -178.843 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 6.2 m80 -95.42 41.17 1.1 Allowed 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.507 -0.477 . . . . 0.0 111.022 -179.458 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . 0.558 ' O ' ' NE ' ' A' ' 8' ' ' ARG . 15.7 m-20 -57.45 120.13 7.71 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.059 -0.519 . . . . 0.0 109.782 179.218 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 18.0 tt0 -86.49 116.69 24.79 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.886 0.374 . . . . 0.0 110.593 -179.444 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.71 ' NH2' ' N11' ' A' ' 501' ' ' C2E . 0.0 OUTLIER -124.33 -2.48 8.04 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.26 -179.36 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.657 ' NH1' ' NH1' ' A' ' 13' ' ' ARG . 12.2 mtt180 -92.79 107.09 18.95 Favored 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 120.931 -0.308 . . . . 0.0 111.178 -178.967 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.572 ' C ' ' O ' ' A' ' 9' ' ' ARG . 0.0 OUTLIER -14.74 -57.81 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.016 179.943 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . 0.521 ' N ' ' O ' ' A' ' 9' ' ' ARG . 1.2 t80 -139.18 143.03 37.93 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.192 179.963 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . 0.675 ' H ' ' CD2' ' A' ' 12' ' ' HIS . 1.3 m-70 -53.54 119.45 4.88 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.761 -179.771 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.657 ' NH1' ' NH1' ' A' ' 9' ' ' ARG . 0.0 OUTLIER -68.12 178.38 1.89 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.906 0.384 . . . . 0.0 110.173 179.706 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.523 ' N ' HD12 ' A' ' 14' ' ' ILE . 1.7 mp -98.54 113.49 33.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.093 179.776 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -95.14 119.76 34.2 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.307 0.575 . . . . 0.0 111.039 -179.755 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.56 ' CZ ' HD21 ' A' ' 101' ' ' LEU . 0.4 OUTLIER -149.66 149.26 30.36 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.109 -0.95 . . . . 0.0 108.442 178.631 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -95.54 149.28 21.6 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 120.116 -0.634 . . . . 0.0 111.335 -178.19 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.515 ' O ' HD12 ' A' ' 32' ' ' LEU . . . 179.06 177.96 0.49 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.466 -0.788 . . . . 0.0 109.891 179.802 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -96.22 133.94 39.93 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.622 179.95 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.58 ' O ' ' O ' ' A' ' 31' ' ' VAL . 20.5 p -134.03 154.34 51.21 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.992 0.425 . . . . 0.0 110.209 178.688 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 16.3 mt-10 -136.24 146.6 46.92 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 108.798 -0.816 . . . . 0.0 108.798 179.409 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.439 ' HA ' ' O ' ' A' ' 58' ' ' GLU . 39.8 mt -125.75 136.24 61.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 C-N-CA 120.037 -0.665 . . . . 0.0 111.329 -178.982 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.476 ' H ' HD12 ' A' ' 23' ' ' LEU . 0.1 OUTLIER -120.67 123.75 43.52 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.329 -0.85 . . . . 0.0 110.846 -179.497 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.491 ' O ' ' OE1' ' A' ' 24' ' ' GLN . 1.6 tm0? -131.49 102.2 5.84 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.513 -0.767 . . . . 0.0 109.606 178.811 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 78.97 -128.15 8.42 Favored Glycine 0 CA--C 1.525 0.664 0 N-CA-C 109.912 -1.275 . . . . 0.0 109.912 -178.711 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -99.14 12.32 36.47 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.865 0.364 . . . . 0.0 110.144 179.417 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.562 ' HB3' ' CZ2' ' A' ' 29' ' ' TRP . 18.6 mtt180 -113.41 135.43 53.87 Favored 'General case' 0 C--N 1.332 -0.177 0 N-CA-C 112.439 0.533 . . . . 0.0 112.439 -178.514 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.432 ' HG2' ' N ' ' A' ' 29' ' ' TRP . 7.0 ttt85 -128.86 148.25 50.88 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.184 179.282 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.562 ' CZ2' ' HB3' ' A' ' 27' ' ' ARG . 6.9 m-90 -146.65 155.82 42.73 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.628 -179.087 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 21.5 mt-10 -100.06 137.28 38.72 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 179.124 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.58 ' O ' ' O ' ' A' ' 20' ' ' SER . 17.3 m -146.88 157.69 10.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 121.31 0.576 . . . . 0.0 111.437 -179.361 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.515 HD12 ' O ' ' A' ' 18' ' ' ALA . 10.7 tp -96.55 128.88 43.89 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 178.576 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.445 ' N ' HD12 ' A' ' 32' ' ' LEU . 2.0 tt -93.37 124.99 37.74 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.232 0.539 . . . . 0.0 109.758 179.789 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 66.3 m-70 -91.24 -24.67 19.81 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.535 -0.757 . . . . 0.0 111.776 -178.434 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.59 ' CG ' ' HE ' ' A' ' 13' ' ' ARG . 2.8 p30 -174.59 163.61 3.58 Favored 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 119.579 -0.849 . . . . 0.0 111.635 177.516 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.523 HG22 ' H ' ' A' ' 37' ' ' SER . 5.0 p -147.17 168.8 4.78 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.123 0 CA-C-N 115.434 -0.803 . . . . 0.0 111.275 -178.903 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.523 ' H ' HG22 ' A' ' 36' ' ' VAL . 5.8 t -142.34 170.45 15.68 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 107.867 -1.16 . . . . 0.0 107.867 178.473 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.638 ' H ' HD23 ' A' ' 38' ' ' LEU . 0.1 OUTLIER -67.44 -2.58 6.56 Favored 'General case' 0 C--N 1.323 -0.566 0 C-N-CA 119.617 -0.833 . . . . 0.0 110.333 -179.687 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . 0.55 ' CD2' ' O ' ' A' ' 87' ' ' CYS . 1.6 t60 -156.67 37.97 0.32 Allowed 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 120.634 -0.426 . . . . 0.0 111.578 -179.627 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . 0.517 ' HA3' ' N3 ' ' A' ' 501' ' ' C2E . . . -178.73 158.4 22.74 Favored Glycine 0 CA--C 1.529 0.941 0 C-N-CA 120.505 -0.855 . . . . 0.0 111.526 179.795 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -149.82 150.17 13.97 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.362 0 CA-C-O 121.353 0.597 . . . . 0.0 111.565 -179.006 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.617 HD23 ' N ' ' A' ' 43' ' ' VAL . 1.5 tt -122.24 141.28 51.65 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 115.06 -0.973 . . . . 0.0 108.783 178.815 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.617 ' N ' HD23 ' A' ' 42' ' ' LEU . 15.9 m -145.34 175.03 2.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-O 121.202 0.525 . . . . 0.0 111.88 -179.242 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -99.56 144.85 17.25 Favored Glycine 0 CA--C 1.53 1.004 0 N-CA-C 109.68 -1.368 . . . . 0.0 109.68 178.423 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . 0.555 ' O ' ' NE2' ' A' ' 45' ' ' GLN . 0.0 OUTLIER -86.77 116.79 67.26 Favored Pre-proline 0 N--CA 1.465 0.307 0 CA-C-N 117.85 0.825 . . . . 0.0 111.939 -178.505 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 76.3 Cg_endo -87.1 151.65 8.22 Favored 'Trans proline' 0 C--N 1.309 -1.526 0 C-N-CA 121.567 1.511 . . . . 0.0 111.32 178.527 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -56.44 -13.74 2.5 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 112.658 0.614 . . . . 0.0 112.658 -178.76 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.53 ' O ' ' N ' ' A' ' 50' ' ' ASN . 81.9 m-20 -97.52 8.81 43.94 Favored 'General case' 0 N--CA 1.467 0.398 0 N-CA-C 112.324 0.49 . . . . 0.0 112.324 -178.432 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' TRP . . . . . 0.444 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 58.4 t-105 -60.55 67.67 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 112.119 0.415 . . . . 0.0 112.119 -179.358 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.53 ' N ' ' O ' ' A' ' 48' ' ' ASP . 0.3 OUTLIER -93.53 78.64 4.35 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 178.042 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -142.81 162.99 27.38 Favored Glycine 0 CA--C 1.524 0.609 0 N-CA-C 111.538 -0.625 . . . . 0.0 111.538 -179.146 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . 0.516 ' OD2' ' NH1' ' A' ' 55' ' ' ARG . 15.8 t0 -95.95 122.05 59.38 Favored Pre-proline 0 CA--C 1.534 0.328 0 CA-C-N 115.608 -0.296 . . . . 0.0 110.423 180.0 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -60.82 -21.71 71.28 Favored 'Trans proline' 0 N--CA 1.495 1.611 0 C-N-CA 122.472 2.115 . . . . 0.0 112.183 -179.315 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 22.9 mt-30 -78.67 -24.06 45.34 Favored 'General case' 0 C--N 1.326 -0.448 0 C-N-CA 120.435 -0.506 . . . . 0.0 111.619 -179.19 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.542 ' O ' ' CE1' ' A' ' 57' ' ' PHE . 1.2 mpp_? -93.35 153.18 41.51 Favored Pre-proline 0 N--CA 1.464 0.239 0 C-N-CA 120.595 -0.442 . . . . 0.0 110.004 179.698 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_endo -65.4 160.73 41.21 Favored 'Trans proline' 0 C--N 1.308 -1.585 0 C-N-CA 122.737 2.291 . . . . 0.0 113.273 -178.899 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.542 ' CE1' ' O ' ' A' ' 55' ' ' ARG . 48.3 m-85 -130.87 155.24 47.07 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 114.891 -1.05 . . . . 0.0 109.117 179.633 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.439 ' O ' ' HA ' ' A' ' 22' ' ' ILE . 13.2 mm-40 -123.04 138.36 54.7 Favored 'General case' 0 N--CA 1.469 0.521 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 178.753 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . 0.449 ' HB2' HD13 ' A' ' 73' ' ' ILE . . . -119.63 137.4 53.9 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.231 0.539 . . . . 0.0 112.133 -178.296 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.891 ' HE ' ' HE ' ' A' ' 70' ' ' ARG . 40.0 mtt85 -124.17 128.2 48.88 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.27 -0.877 . . . . 0.0 108.788 177.729 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.405 HD23 ' N ' ' A' ' 61' ' ' LEU . 0.0 OUTLIER -113.33 146.46 39.4 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.021 0.439 . . . . 0.0 110.634 -179.25 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' TYR . . . . . 0.449 ' CD1' ' N ' ' A' ' 62' ' ' TYR . 24.0 m-85 -124.03 108.85 12.82 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.173 179.56 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.471 ' C ' HD23 ' A' ' 63' ' ' LEU . 1.8 tt -103.13 -86.5 0.44 Allowed 'General case' 0 C--N 1.333 -0.138 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 179.551 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.447 ' H ' ' HB ' ' A' ' 67' ' ' VAL . . . -74.3 174.06 50.36 Favored Glycine 0 CA--C 1.522 0.524 0 N-CA-C 109.147 -1.581 . . . . 0.0 109.147 178.367 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.569 ' N ' HD12 ' A' ' 65' ' ' LEU . 7.9 mp -71.31 -33.16 69.42 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 119.94 -0.704 . . . . 0.0 110.018 -179.788 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -102.52 9.55 39.44 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.902 179.912 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.469 ' O ' HG12 ' A' ' 67' ' ' VAL . 24.2 t -107.59 98.81 7.45 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.324 0 CA-C-O 121.204 0.526 . . . . 0.0 112.02 -178.742 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.501 HD12 ' N ' ' A' ' 69' ' ' ILE . 4.4 tp -113.86 117.77 32.35 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.268 -0.878 . . . . 0.0 108.709 178.55 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.501 ' N ' HD12 ' A' ' 68' ' ' LEU . 3.1 mt -112.15 144.28 20.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.935 0.398 . . . . 0.0 111.208 -179.04 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.891 ' HE ' ' HE ' ' A' ' 60' ' ' ARG . 1.0 OUTLIER -128.34 131.3 48.6 Favored 'General case' 0 C--O 1.237 0.421 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.677 179.277 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 2.7 mtp -140.07 149.24 42.88 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.055 179.633 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . 0.413 ' OE1' ' OE2' ' A' ' 58' ' ' GLU . 23.9 tt0 -105.01 132.4 51.29 Favored 'General case' 0 CA--C 1.516 -0.33 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 177.995 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.613 HD12 ' CB ' ' A' ' 85' ' ' PHE . 1.5 pt -141.88 158.48 20.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 C-N-CA 119.521 -0.872 . . . . 0.0 113.266 -177.465 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . 0.5 ' OG ' ' NE2' ' A' ' 88' ' ' GLN . 0.3 OUTLIER -118.91 149.16 42.05 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 114.966 -1.015 . . . . 0.0 109.205 178.35 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.518 HD12 ' CE1' ' A' ' 85' ' ' PHE . 16.2 tp -65.76 123.11 18.89 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.236 0.541 . . . . 0.0 110.199 -179.022 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -98.26 -44.62 6.5 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 115.261 -0.882 . . . . 0.0 111.257 178.423 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' TRP . . . . . 0.613 ' NE1' ' HA3' ' A' ' 84' ' ' GLY . 68.8 p-90 -166.05 169.58 14.43 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.412 -179.152 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -148.68 123.66 10.03 Favored 'General case' 0 N--CA 1.465 0.28 0 N-CA-C 109.446 -0.575 . . . . 0.0 109.446 178.222 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 37.6 ttt180 -152.37 133.54 14.3 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 119.762 -0.775 . . . . 0.0 112.809 -179.975 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 36.2 t0 57.24 47.15 17.47 Favored 'General case' 0 N--CA 1.465 0.276 0 N-CA-C 114.055 1.132 . . . . 0.0 114.055 176.845 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 82.9 -26.71 4.13 Favored Glycine 0 CA--C 1.521 0.452 0 C-N-CA 120.388 -0.911 . . . . 0.0 113.048 177.271 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 5.2 mt -89.66 161.6 16.03 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 117.689 0.744 . . . . 0.0 110.842 -179.057 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 40.5 mt -134.78 135.98 42.23 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.198 -179.25 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . 0.613 ' HA3' ' NE1' ' A' ' 77' ' ' TRP . . . -102.33 153.91 18.51 Favored Glycine 0 N--CA 1.453 -0.203 0 N-CA-C 109.741 -1.343 . . . . 0.0 109.741 178.529 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . 0.613 ' CB ' HD12 ' A' ' 73' ' ' ILE . 54.6 m-85 -145.64 139.63 26.75 Favored 'General case' 0 C--N 1.318 -0.777 0 C-N-CA 120.828 -0.349 . . . . 0.0 110.71 -179.725 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 20.4 pt-20 -103.86 130.08 51.4 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.084 -0.71 . . . . 0.0 109.084 179.764 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . 0.55 ' O ' ' CD2' ' A' ' 39' ' ' HIS . 5.2 t -77.33 124.36 27.75 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.006 0.431 . . . . 0.0 111.581 -178.556 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . 0.5 ' NE2' ' OG ' ' A' ' 74' ' ' SER . 0.0 OUTLIER -101.2 -29.67 11.97 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.206 179.685 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . 0.532 ' ND1' ' C ' ' A' ' 89' ' ' HIS . 0.0 OUTLIER -161.71 141.72 10.36 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.063 0.459 . . . . 0.0 110.273 179.471 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.451 HG23 ' CG1' ' A' ' 95' ' ' ILE . 6.6 tt -145.57 141.1 22.25 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-N 115.755 -0.657 . . . . 0.0 109.971 -179.547 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . 0.516 ' CG ' ' H ' ' A' ' 94' ' ' SER . 0.1 OUTLIER -53.69 141.05 27.5 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 115.164 -0.925 . . . . 0.0 111.747 -178.444 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.445 ' N ' ' OD1' ' A' ' 91' ' ' ASP . 3.1 tp -54.27 -42.53 70.1 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.122 -0.945 . . . . 0.0 110.593 -179.558 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 11.5 t0 -70.15 -36.83 75.01 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 179.476 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . 0.516 ' H ' ' CG ' ' A' ' 91' ' ' ASP . 3.6 m -64.53 -37.85 88.98 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.661 -0.699 . . . . 0.0 109.784 179.162 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . 0.451 ' CG1' HG23 ' A' ' 90' ' ' ILE . 50.1 mt -58.74 -37.82 68.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.056 179.529 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -70.56 -41.06 72.93 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.717 -179.167 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' HIS . . . . . 0.437 ' O ' ' HG2' ' A' ' 100' ' ' ARG . 64.1 m-70 -63.74 -44.07 94.59 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 119.932 -0.707 . . . . 0.0 109.764 179.786 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.449 HD21 ' CG1' ' A' ' 36' ' ' VAL . 0.4 OUTLIER -67.43 -36.38 81.12 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 120.681 -0.408 . . . . 0.0 109.941 179.093 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 43.9 mtt-85 -66.58 -41.68 88.15 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.454 -0.499 . . . . 0.0 110.553 179.298 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . 0.437 ' HG2' ' O ' ' A' ' 97' ' ' HIS . 15.1 ptt85 -69.24 -37.41 77.96 Favored 'General case' 0 CA--C 1.53 0.193 0 N-CA-C 109.853 -0.425 . . . . 0.0 109.853 177.449 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.56 HD21 ' CZ ' ' A' ' 16' ' ' PHE . 17.0 tp -58.72 -41.15 85.71 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 109.338 -0.615 . . . . 0.0 109.338 177.438 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 42.3 t -67.4 -36.75 77.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.922 -179.921 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . 0.481 ' O ' ' O ' ' A' ' 107' ' ' GLY . 22.6 tt0 -58.95 -40.77 85.69 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.031 -179.423 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 69.0 mt -65.36 -39.79 92.77 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 120.938 -0.305 . . . . 0.0 110.914 -179.677 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . 0.459 ' CG ' HG23 ' A' ' 14' ' ' ILE . 4.8 m-80 -67.44 -49.23 64.58 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 120.79 -0.364 . . . . 0.0 110.412 179.932 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -61.05 -39.64 90.6 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.296 179.906 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . 0.481 ' O ' ' O ' ' A' ' 103' ' ' GLU . . . 142.24 -142.46 11.75 Favored Glycine 0 CA--C 1.526 0.753 0 N-CA-C 110.893 -0.883 . . . . 0.0 110.893 179.878 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -173.66 97.89 0.11 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.915 0.388 . . . . 0.0 110.526 179.888 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 15.7 mm-40 47.97 89.14 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.5 -179.876 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -142.25 -40.77 0.35 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.224 -179.911 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . 0.652 HD22 ' N ' ' A' ' 111' ' ' LEU . 3.3 mm? 50.86 74.71 0.22 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.57 -179.863 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.531 ' O ' ' N ' ' A' ' 114' ' ' ARG . 24.2 tp -84.26 101.73 12.12 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.295 179.903 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -58.0 78.27 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.713 -179.836 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . 0.531 ' N ' ' O ' ' A' ' 112' ' ' LEU . 36.4 ttp180 -173.45 -77.33 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.072 179.876 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 1.3 pt-20 -85.46 10.13 13.78 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.665 -0.494 . . . . 0.0 109.665 179.35 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 6.4 tp -67.2 -38.24 85.0 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.357 -179.746 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 117' ' ' ALA . . . . . 0.593 ' O ' HG23 ' A' ' 120' ' ' VAL . . . -69.82 -24.25 63.44 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.647 179.528 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.423 HD23 ' HA ' ' A' ' 118' ' ' LEU . 47.7 mt -54.86 -36.43 65.07 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 120.173 -0.611 . . . . 0.0 110.743 -177.941 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . 0.583 HD22 ' N ' ' A' ' 119' ' ' LEU . 4.0 mm? -55.85 -15.44 3.29 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.123 -0.631 . . . . 0.0 110.018 -178.618 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . 0.618 ' O ' HG12 ' A' ' 120' ' ' VAL . 54.7 t -56.93 0.11 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 120.984 0.421 . . . . 0.0 110.338 -179.748 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 121' ' ' SER . . . . . 0.576 ' H ' ' C ' ' A' ' 119' ' ' LEU . 28.2 t -74.73 -24.57 58.74 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 109.544 -0.539 . . . . 0.0 109.544 178.83 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -163.1 157.18 20.36 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.067 179.652 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . 0.61 ' HD1' ' C ' ' A' ' 123' ' ' HIS . 0.1 OUTLIER 176.35 178.34 0.22 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.48 -179.901 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 59.2 m-20 -123.15 -10.08 8.13 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.356 179.743 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 1.5 t70 . . . . . 0 C--O 1.22 -0.452 0 CA-C-O 118.032 -0.985 . . . . 0.0 110.527 -179.863 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 501' ' ' C2E . . . . . 0.923 ' O21' " H4'" ' A' ' 501' ' ' C2E . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 502' ' ' C2E . . . . . 0.521 ' C2 ' ' CD1' ' A' ' 77' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.649 ' O ' ' CB ' ' A' ' 2' ' ' SER . 8.3 mmm . . . . . 0 N--CA 1.489 1.512 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.649 ' CB ' ' O ' ' A' ' 1' ' ' MET . 41.3 t 120.61 -29.8 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.541 0 O-C-N 123.942 0.776 . . . . 0.0 110.182 -179.857 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -99.28 -7.54 26.24 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.977 179.646 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.774 ' H ' ' NE2' ' A' ' 4' ' ' GLN . 0.0 OUTLIER -112.66 -0.83 14.97 Favored 'General case' 0 N--CA 1.464 0.248 0 C-N-CA 120.923 -0.311 . . . . 0.0 111.464 -179.938 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . 0.662 ' O ' ' NH1' ' A' ' 8' ' ' ARG . 12.7 m170 97.5 -96.92 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.456 0 O-C-N 123.533 0.521 . . . . 0.0 110.888 179.803 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . 0.401 ' O ' ' O ' ' A' ' 5' ' ' HIS . 10.1 m-20 60.09 152.52 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.784 -0.366 . . . . 0.0 110.281 -179.701 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.48 ' HA ' ' C61' ' A' ' 502' ' ' C2E . 3.4 tt0 -93.3 129.42 39.39 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-O 121.006 0.432 . . . . 0.0 110.719 -179.575 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.738 ' H ' ' C61' ' A' ' 502' ' ' C2E . 0.0 OUTLIER -126.2 -13.87 6.08 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.739 -178.618 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.713 ' O ' ' N ' ' A' ' 11' ' ' PHE . 3.2 ptt180 -108.12 79.57 1.28 Allowed 'General case' 0 N--CA 1.471 0.602 0 CA-C-O 121.108 0.48 . . . . 0.0 110.047 179.945 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.464 ' C ' ' O ' ' A' ' 9' ' ' ARG . 0.0 OUTLIER 20.24 -73.49 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.567 0 CA-C-N 114.8 -1.091 . . . . 0.0 112.062 -179.668 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . 0.713 ' N ' ' O ' ' A' ' 9' ' ' ARG . 0.7 OUTLIER -145.53 168.18 21.23 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-O 120.724 0.297 . . . . 0.0 110.397 -179.649 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . 0.782 ' CE1' HD13 ' A' ' 118' ' ' LEU . 0.0 OUTLIER -49.81 168.44 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.534 -179.76 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.662 HH12 HD12 ' A' ' 42' ' ' LEU . 8.4 mtm180 -119.03 165.19 14.43 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.375 180.0 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 7.2 mm -63.92 91.45 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 179.411 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -95.08 120.89 36.06 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.475 0.655 . . . . 0.0 111.992 -178.926 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 23.2 p90 -149.3 158.09 43.88 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 114.873 -1.058 . . . . 0.0 108.448 177.567 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -95.55 146.38 24.5 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 120.291 -0.564 . . . . 0.0 110.314 -179.591 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . 179.94 176.77 0.69 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.075 179.788 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -96.28 133.94 40.02 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.104 -179.686 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.47 ' O ' ' O ' ' A' ' 31' ' ' VAL . 11.4 p -132.94 150.32 52.17 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.081 -0.509 . . . . 0.0 109.941 178.338 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.559 ' OE1' ' NH2' ' A' ' 28' ' ' ARG . 8.3 mm-40 -132.51 138.2 47.45 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 179.59 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 43.0 mt -119.32 136.12 57.52 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 121.353 0.597 . . . . 0.0 110.987 -179.091 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.595 ' H ' HD12 ' A' ' 23' ' ' LEU . 0.1 OUTLIER -123.73 123.2 39.98 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.33 -0.85 . . . . 0.0 111.107 -179.135 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.482 ' O ' ' OE1' ' A' ' 24' ' ' GLN . 1.4 tm0? -128.65 101.57 6.2 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.328 -0.851 . . . . 0.0 109.687 178.918 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 80.99 -125.68 6.99 Favored Glycine 0 CA--C 1.525 0.662 0 N-CA-C 110.103 -1.199 . . . . 0.0 110.103 -178.664 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -101.17 11.63 39.07 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.86 0.362 . . . . 0.0 110.06 179.404 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.529 ' HB3' ' CZ2' ' A' ' 29' ' ' TRP . 36.1 mtt85 -113.5 134.65 54.56 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 112.652 0.612 . . . . 0.0 112.652 -178.146 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.559 ' NH2' ' OE1' ' A' ' 21' ' ' GLU . 70.0 ttt-85 -128.38 149.33 50.58 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.443 179.325 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.534 ' NE1' ' O ' ' A' ' 48' ' ' ASP . 7.8 m-90 -146.5 156.25 43.13 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.386 -0.825 . . . . 0.0 110.496 -179.382 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.531 ' CD ' ' H ' ' A' ' 30' ' ' GLU . 3.7 mp0 -100.77 138.85 37.27 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.975 -0.557 . . . . 0.0 109.621 179.35 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.47 ' O ' ' O ' ' A' ' 20' ' ' SER . 9.1 m -147.28 156.33 10.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-O 121.287 0.565 . . . . 0.0 110.962 -179.434 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 11.4 tp -97.04 129.92 44.42 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 108.123 -1.065 . . . . 0.0 108.123 178.631 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -92.08 124.09 35.92 Favored 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 120.29 -0.564 . . . . 0.0 110.072 -179.827 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 77.0 m-70 -90.67 -30.1 17.33 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.339 -0.846 . . . . 0.0 111.474 -178.803 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.401 ' OD1' ' C ' ' A' ' 35' ' ' ASP . 2.1 p30 -170.05 160.57 8.24 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 119.538 -0.865 . . . . 0.0 110.868 177.26 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.537 HG22 ' H ' ' A' ' 37' ' ' SER . 3.4 p -144.75 169.17 8.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.055 -178.825 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.537 ' H ' HG22 ' A' ' 36' ' ' VAL . 13.1 t -140.89 168.34 20.03 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 108.497 -0.927 . . . . 0.0 108.497 179.083 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.426 HD12 ' N ' ' A' ' 38' ' ' LEU . 0.3 OUTLIER -66.99 -2.02 4.82 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 119.92 -0.712 . . . . 0.0 110.687 -179.572 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . 0.421 ' N ' HD12 ' A' ' 38' ' ' LEU . 0.1 OUTLIER -158.71 35.91 0.22 Allowed 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 120.695 -0.402 . . . . 0.0 111.185 179.889 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -174.48 157.38 24.87 Favored Glycine 0 CA--C 1.526 0.78 0 N-CA-C 110.947 -0.861 . . . . 0.0 110.947 179.681 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -146.39 148.18 17.29 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.267 0 CA-C-O 121.484 0.659 . . . . 0.0 111.661 -179.239 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.662 HD12 HH12 ' A' ' 13' ' ' ARG . 0.8 OUTLIER -122.15 134.79 54.74 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 114.936 -1.029 . . . . 0.0 108.896 178.776 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.409 ' N ' HD23 ' A' ' 42' ' ' LEU . 22.0 m -139.37 174.95 8.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-O 121.227 0.537 . . . . 0.0 111.837 -179.311 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -96.77 143.33 16.67 Favored Glycine 0 CA--C 1.528 0.881 0 N-CA-C 109.331 -1.508 . . . . 0.0 109.331 178.071 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . 0.44 ' O ' ' OE1' ' A' ' 45' ' ' GLN . 2.1 tm0? -85.52 115.93 63.51 Favored Pre-proline 0 N--CA 1.465 0.275 0 CA-C-N 118.041 0.921 . . . . 0.0 111.678 -178.715 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 97.8 Cg_endo -86.27 161.5 9.86 Favored 'Trans proline' 0 C--N 1.308 -1.572 0 C-N-CA 121.543 1.495 . . . . 0.0 111.241 178.732 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 19.7 mt-30 -65.41 -40.21 93.1 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 112.591 0.589 . . . . 0.0 112.591 -178.789 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.534 ' O ' ' NE1' ' A' ' 29' ' ' TRP . 1.8 m-20 -71.64 8.4 1.14 Allowed 'General case' 0 N--CA 1.465 0.286 0 N-CA-C 112.013 0.375 . . . . 0.0 112.013 -178.709 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' TRP . . . . . 0.455 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 61.7 t-105 -60.56 67.84 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 111.832 0.308 . . . . 0.0 111.832 -179.426 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.547 HD22 ' C ' ' A' ' 50' ' ' ASN . 0.3 OUTLIER -93.46 78.89 4.37 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 120.155 -0.618 . . . . 0.0 109.816 178.698 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -141.24 160.3 26.79 Favored Glycine 0 CA--C 1.525 0.706 0 N-CA-C 111.223 -0.751 . . . . 0.0 111.223 -179.656 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 59.2 t0 -97.32 108.03 42.12 Favored Pre-proline 0 CA--C 1.531 0.242 0 N-CA-C 110.627 -0.138 . . . . 0.0 110.627 -179.842 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -47.52 -22.54 2.87 Favored 'Trans proline' 0 C--N 1.311 -1.439 0 C-N-CA 122.167 1.911 . . . . 0.0 112.341 179.973 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 25.1 mt-30 -74.85 -23.99 58.51 Favored 'General case' 0 C--N 1.324 -0.512 0 C-N-CA 120.51 -0.476 . . . . 0.0 111.233 -179.237 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.546 ' O ' ' CE1' ' A' ' 57' ' ' PHE . 0.0 OUTLIER -96.77 150.09 36.53 Favored Pre-proline 0 C--N 1.331 -0.237 0 N-CA-C 109.863 -0.421 . . . . 0.0 109.863 -179.948 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 25.5 Cg_endo -61.62 160.78 26.92 Favored 'Trans proline' 0 N--CA 1.495 1.615 0 C-N-CA 122.824 2.349 . . . . 0.0 113.298 -178.487 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.546 ' CE1' ' O ' ' A' ' 55' ' ' ARG . 52.5 m-85 -130.98 154.69 47.89 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.012 -0.994 . . . . 0.0 109.313 179.58 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -122.16 136.39 54.9 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 109.036 -0.728 . . . . 0.0 109.036 178.372 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . 0.627 ' HB2' HD13 ' A' ' 73' ' ' ILE . . . -118.1 138.27 52.38 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.225 0.536 . . . . 0.0 112.19 -178.099 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.477 ' HG3' HD11 ' A' ' 23' ' ' LEU . 20.0 mtm-85 -124.09 127.67 48.16 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 177.813 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 12.8 mt -109.76 151.02 27.48 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.002 0.43 . . . . 0.0 111.215 -178.741 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 38.2 m-85 -132.29 108.84 9.48 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.428 179.593 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.442 ' C ' HD23 ' A' ' 63' ' ' LEU . 1.1 tt -102.84 -84.59 0.46 Allowed 'General case' 0 C--N 1.332 -0.155 0 N-CA-C 108.941 -0.763 . . . . 0.0 108.941 179.089 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.451 ' H ' ' HB ' ' A' ' 67' ' ' VAL . . . -76.65 179.35 49.27 Favored Glycine 0 CA--C 1.523 0.548 0 N-CA-C 108.819 -1.712 . . . . 0.0 108.819 178.202 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.623 ' N ' HD12 ' A' ' 65' ' ' LEU . 7.5 mp -74.07 -32.3 63.22 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 119.708 -0.797 . . . . 0.0 110.251 -179.589 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.401 ' O ' ' OD1' ' A' ' 66' ' ' ASP . 51.9 t0 -102.35 9.4 39.85 Favored 'General case' 0 C--N 1.332 -0.154 0 C-N-CA 122.735 0.414 . . . . 0.0 111.166 -179.865 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.572 ' O ' HG12 ' A' ' 67' ' ' VAL . 8.6 t -104.36 94.36 3.12 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.238 0 CA-C-O 121.487 0.66 . . . . 0.0 111.533 -179.172 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 6.6 tp -109.74 117.44 33.9 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 114.863 -1.062 . . . . 0.0 108.214 178.542 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.49 HG23 ' CB ' ' A' ' 94' ' ' SER . 7.6 mt -115.79 143.79 24.92 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.373 0 CA-C-O 121.047 0.451 . . . . 0.0 111.228 -178.632 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.444 ' C ' ' HG2' ' A' ' 71' ' ' MET . 0.0 OUTLIER -128.2 130.84 48.63 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.056 179.197 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . 0.776 ' SD ' HD12 ' A' ' 90' ' ' ILE . 0.0 OUTLIER -139.91 148.04 41.44 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.625 -0.716 . . . . 0.0 109.611 179.511 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -100.43 132.78 45.62 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 107.081 -1.452 . . . . 0.0 107.081 177.731 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.627 HD13 ' HB2' ' A' ' 59' ' ' ALA . 7.7 pt -141.69 157.44 21.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 C-N-CA 119.407 -0.917 . . . . 0.0 113.458 -176.813 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . 0.506 ' OG ' ' NE2' ' A' ' 88' ' ' GLN . 0.5 OUTLIER -122.78 155.97 35.45 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 114.925 -1.034 . . . . 0.0 109.877 178.736 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.512 HD13 ' N ' ' A' ' 76' ' ' ALA . 0.2 OUTLIER -65.1 119.42 10.78 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.521 -0.308 . . . . 0.0 110.632 -179.533 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . 0.512 ' N ' HD13 ' A' ' 75' ' ' LEU . . . -97.1 -40.27 8.91 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 177.344 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' TRP . . . . . 0.623 ' NE1' ' HA3' ' A' ' 84' ' ' GLY . 69.2 p-90 -171.68 169.78 5.85 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.143 179.674 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -150.53 123.52 8.75 Favored 'General case' 0 N--CA 1.463 0.184 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 178.239 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 24.4 ttt85 -152.44 133.79 14.42 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 119.934 -0.706 . . . . 0.0 112.75 -179.948 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . 0.424 ' O ' ' OD1' ' A' ' 80' ' ' ASP . 25.7 t0 57.07 47.46 17.36 Favored 'General case' 0 N--CA 1.463 0.196 0 N-CA-C 113.764 1.024 . . . . 0.0 113.764 176.747 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 83.17 -27.95 3.86 Favored Glycine 0 CA--C 1.522 0.53 0 C-N-CA 120.241 -0.981 . . . . 0.0 113.284 177.073 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 4.3 mt -89.61 159.24 17.26 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 117.83 0.815 . . . . 0.0 110.436 -178.88 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 39.8 mt -131.48 135.98 47.54 Favored 'General case' 0 CA--C 1.518 -0.288 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.541 -178.811 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . 0.623 ' HA3' ' NE1' ' A' ' 77' ' ' TRP . . . -100.11 153.08 19.38 Favored Glycine 0 N--CA 1.453 -0.233 0 N-CA-C 109.748 -1.341 . . . . 0.0 109.748 178.471 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . 0.451 ' CE1' HD22 ' A' ' 75' ' ' LEU . 33.6 m-85 -145.7 135.72 23.67 Favored 'General case' 0 C--N 1.318 -0.768 0 C-N-CA 120.734 -0.386 . . . . 0.0 110.612 -179.575 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.408 ' H ' ' HG2' ' A' ' 86' ' ' GLU . 10.3 pt-20 -104.18 127.31 51.77 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.06 -0.719 . . . . 0.0 109.06 179.363 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -74.27 125.35 28.24 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.173 0.511 . . . . 0.0 111.542 -178.638 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . 0.506 ' NE2' ' OG ' ' A' ' 74' ' ' SER . 0.0 OUTLIER -102.5 -29.82 11.36 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.032 179.817 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . 0.636 ' ND1' ' N ' ' A' ' 90' ' ' ILE . 0.0 OUTLIER -158.38 140.23 13.81 Favored 'General case' 0 C--O 1.226 -0.163 0 N-CA-C 109.891 -0.411 . . . . 0.0 109.891 178.735 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.776 HD12 ' SD ' ' A' ' 71' ' ' MET . 7.0 tt -146.15 141.08 21.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-O 121.352 0.596 . . . . 0.0 109.988 -179.444 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . 0.494 ' CB ' ' OG ' ' A' ' 94' ' ' SER . 0.1 OUTLIER -53.75 142.03 24.84 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.287 -0.87 . . . . 0.0 112.05 -178.381 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 6.0 tp -54.43 -42.36 70.45 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.178 -0.919 . . . . 0.0 109.968 -179.993 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . 0.425 ' OD2' ' OD2' ' A' ' 91' ' ' ASP . 3.5 p30 -68.36 -42.49 79.13 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.145 -0.48 . . . . 0.0 109.97 179.636 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . 0.494 ' OG ' ' CB ' ' A' ' 91' ' ' ASP . 1.9 p -62.31 -36.24 81.55 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.037 -0.529 . . . . 0.0 109.998 179.373 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . 0.487 ' CG1' HG23 ' A' ' 90' ' ' ILE . 36.7 mt -58.86 -37.97 70.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.157 179.664 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -70.24 -39.71 74.89 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.257 -0.577 . . . . 0.0 110.914 -178.758 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 60.4 m-70 -61.84 -35.22 77.62 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 119.515 -0.874 . . . . 0.0 109.108 179.753 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.421 HD23 ' HA ' ' A' ' 98' ' ' LEU . 6.7 mt -67.44 -36.08 80.5 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 177.978 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 18.6 mtt-85 -66.55 -41.95 87.89 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 178.089 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 40.1 mtt85 -55.85 -37.87 69.33 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.022 178.194 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 4.1 mp -69.51 -44.6 70.72 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.542 -179.665 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . 0.42 ' CG1' ' N ' ' A' ' 103' ' ' GLU . 0.4 OUTLIER -61.39 -43.55 96.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.936 0.398 . . . . 0.0 110.086 179.968 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . 0.42 ' N ' ' CG1' ' A' ' 102' ' ' VAL . 1.8 tm-20 -65.78 -44.61 85.27 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.335 -179.769 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 27.0 mt -73.68 -22.62 59.88 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.413 -178.967 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -57.36 -36.86 71.75 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 120.761 -0.376 . . . . 0.0 110.511 -179.612 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.546 HD12 ' N ' ' A' ' 106' ' ' LEU . 7.0 mp -74.54 -25.18 59.16 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.682 -179.919 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 98.03 -83.82 0.69 Allowed Glycine 0 CA--C 1.525 0.694 0 N-CA-C 111.165 -0.774 . . . . 0.0 111.165 179.761 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -139.67 -76.64 0.34 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.557 0.217 . . . . 0.0 110.426 -179.796 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 173.24 18.78 0.0 OUTLIER 'General case' 0 CA--C 1.529 0.156 0 CA-C-N 116.528 -0.306 . . . . 0.0 110.493 179.92 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 82.0 mt-10 -111.59 -0.72 16.02 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.69 -179.972 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . 0.487 HD22 ' HA ' ' A' ' 111' ' ' LEU . 0.2 OUTLIER -144.63 108.31 4.67 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.346 179.983 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.599 HD22 ' N ' ' A' ' 112' ' ' LEU . 2.8 mm? -76.94 151.01 35.9 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.358 -179.699 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 23.3 tt0 -90.3 -70.06 0.69 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.834 -179.707 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 74.9 mtt180 -37.68 141.16 0.2 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.139 -179.823 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . 0.613 ' H ' HD12 ' A' ' 118' ' ' LEU . 34.4 tt0 -117.53 151.39 37.22 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.035 -0.53 . . . . 0.0 109.891 179.334 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.528 ' O ' HD13 ' A' ' 116' ' ' LEU . 0.1 OUTLIER -67.52 -34.69 77.63 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.102 -179.225 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 117' ' ' ALA . . . . . 0.614 ' O ' HG23 ' A' ' 120' ' ' VAL . . . -68.25 -24.6 64.91 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-O 121.404 0.621 . . . . 0.0 110.216 -179.406 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.782 HD13 ' CE1' ' A' ' 12' ' ' HIS . 28.8 mt -64.17 -30.87 71.91 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 115.175 -0.92 . . . . 0.0 109.751 178.265 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . 0.486 ' C ' ' H ' ' A' ' 121' ' ' SER . 0.3 OUTLIER -55.37 -10.23 0.58 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.351 -0.841 . . . . 0.0 109.255 -178.837 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . 0.614 HG23 ' O ' ' A' ' 117' ' ' ALA . 29.1 t -59.28 -1.45 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.327 176.253 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 121' ' ' SER . . . . . 0.486 ' H ' ' C ' ' A' ' 119' ' ' LEU . 0.3 OUTLIER -92.47 -16.73 25.45 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 111.907 0.336 . . . . 0.0 111.907 -178.915 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -97.64 -15.23 20.52 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.064 0.459 . . . . 0.0 110.832 -179.73 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . 0.654 ' CD2' ' C ' ' A' ' 123' ' ' HIS . 0.0 OUTLIER 179.75 -177.74 0.37 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.671 -0.695 . . . . 0.0 109.652 -178.618 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . 0.531 ' N ' ' CG ' ' A' ' 123' ' ' HIS . 17.3 t0 -175.2 -47.81 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 179.034 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 . . . . . 0 C--N 1.323 -0.564 0 CA-C-O 117.992 -1.004 . . . . 0.0 110.496 179.98 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 501' ' ' C2E . . . . . 0.667 ' C21' ' NH2' ' A' ' 8' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 502' ' ' C2E . . . . . 0.738 ' C61' ' H ' ' A' ' 8' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.496 ' O ' ' O ' ' A' ' 2' ' ' SER . 2.9 ttm . . . . . 0 N--CA 1.489 1.5 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.496 ' O ' ' O ' ' A' ' 1' ' ' MET . 6.2 m 39.62 99.69 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.927 179.732 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . 0.481 ' OD1' ' N ' ' A' ' 3' ' ' ASP . 0.0 OUTLIER -99.05 14.1 30.47 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.242 179.074 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.444 ' OE1' ' OD1' ' A' ' 3' ' ' ASP . 1.4 mp0 -114.22 12.1 17.64 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.087 177.883 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . 0.656 ' C ' ' CD2' ' A' ' 5' ' ' HIS . 0.0 OUTLIER 76.05 11.07 3.04 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.728 179.567 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . 0.581 ' OD1' ' N ' ' A' ' 6' ' ' ASP . 0.3 OUTLIER -29.81 149.8 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.329 179.942 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.475 ' HB3' ' HB2' ' A' ' 122' ' ' ALA . 1.0 OUTLIER -84.12 133.48 34.62 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.199 0.523 . . . . 0.0 110.71 -179.802 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.663 ' H ' ' C61' ' A' ' 502' ' ' C2E . 0.0 OUTLIER -124.96 -8.8 7.19 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.443 -0.799 . . . . 0.0 111.307 -179.111 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.693 HH11 ' NE ' ' A' ' 13' ' ' ARG . 4.6 mtt180 -96.03 30.87 2.28 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-O 120.971 0.415 . . . . 0.0 110.594 -179.372 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER 59.57 -62.02 0.05 Allowed 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.963 179.63 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . 0.624 ' N ' ' O ' ' A' ' 9' ' ' ARG . 0.2 OUTLIER -140.4 169.51 17.53 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 110.075 -0.343 . . . . 0.0 110.075 179.909 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 80.2 m-70 -61.92 145.06 53.98 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.883 -179.758 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.693 ' NE ' HH11 ' A' ' 9' ' ' ARG . 0.0 OUTLIER -93.72 149.07 21.54 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.151 179.759 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.66 ' N ' HD12 ' A' ' 14' ' ' ILE . 1.7 mp -59.68 89.86 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 179.019 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.41 ' N ' ' O ' ' A' ' 13' ' ' ARG . . . -94.42 120.41 34.61 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.403 0.621 . . . . 0.0 111.676 -178.963 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 1.6 p90 -149.67 158.09 43.85 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 114.768 -1.105 . . . . 0.0 108.212 177.85 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 31.4 m-20 -95.37 146.42 24.4 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 120.14 -0.624 . . . . 0.0 110.432 -179.22 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -179.27 176.83 0.82 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.967 -0.56 . . . . 0.0 109.742 179.652 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -96.66 134.43 39.91 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.195 -179.666 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.595 ' O ' ' O ' ' A' ' 31' ' ' VAL . 16.9 p -133.43 153.98 51.16 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.01 0.434 . . . . 0.0 109.875 178.445 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.4 mt-10 -134.61 140.43 46.06 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 179.658 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 2.7 mm -118.93 135.66 58.63 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-O 121.489 0.661 . . . . 0.0 110.404 -179.639 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -127.23 123.06 35.68 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.04 -0.982 . . . . 0.0 110.482 -179.254 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.581 ' O ' ' OE1' ' A' ' 24' ' ' GLN . 1.4 tm0? -128.39 102.22 6.56 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.444 -0.798 . . . . 0.0 109.485 178.935 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 80.23 -124.22 6.39 Favored Glycine 0 CA--C 1.524 0.629 0 N-CA-C 110.204 -1.158 . . . . 0.0 110.204 -178.797 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -102.38 11.62 37.76 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.78 0.324 . . . . 0.0 110.288 179.915 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.591 ' HB3' ' CZ2' ' A' ' 29' ' ' TRP . 46.5 mtt180 -114.34 136.53 52.87 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 112.844 0.683 . . . . 0.0 112.844 -177.962 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.414 ' HG2' ' N ' ' A' ' 29' ' ' TRP . 27.7 ttt180 -129.05 149.55 50.82 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.104 0.478 . . . . 0.0 110.272 179.344 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.591 ' CZ2' ' HB3' ' A' ' 27' ' ' ARG . 5.6 m-90 -150.26 125.66 10.15 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.682 -178.859 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -75.06 143.29 43.53 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 119.853 -0.739 . . . . 0.0 109.692 -179.0 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.595 ' O ' ' O ' ' A' ' 20' ' ' SER . 6.1 m -148.4 158.94 7.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-O 121.262 0.553 . . . . 0.0 111.176 -179.019 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 1.11 ' H ' HD23 ' A' ' 32' ' ' LEU . 1.5 pt? -99.05 130.35 45.37 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 108.816 -0.809 . . . . 0.0 108.816 178.729 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -94.24 124.94 38.58 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.311 0.577 . . . . 0.0 109.544 -179.939 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 71.1 m-70 -89.49 -26.18 21.05 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.379 -0.828 . . . . 0.0 111.882 -178.241 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -174.03 162.98 3.92 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 119.739 -0.784 . . . . 0.0 111.326 177.842 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.51 HG22 ' H ' ' A' ' 37' ' ' SER . 4.8 p -146.71 168.81 5.49 Favored 'Isoleucine or valine' 0 C--O 1.231 0.104 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.041 -179.097 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.51 ' H ' HG22 ' A' ' 36' ' ' VAL . 67.5 p -142.28 168.08 20.58 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 107.321 -1.363 . . . . 0.0 107.321 177.851 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -62.41 -0.81 0.63 Allowed 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 119.33 -0.948 . . . . 0.0 110.697 -179.239 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . 0.434 ' H ' ' C ' ' A' ' 37' ' ' SER . 0.4 OUTLIER -164.92 45.62 0.09 Allowed 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 120.628 -0.429 . . . . 0.0 111.425 179.978 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -179.17 150.98 9.81 Favored Glycine 0 CA--C 1.529 0.919 0 N-CA-C 110.812 -0.915 . . . . 0.0 110.812 179.75 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -146.36 148.14 17.35 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.267 0 CA-C-O 121.445 0.64 . . . . 0.0 111.903 -179.175 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.444 HD12 ' O6 ' ' A' ' 501' ' ' C2E . 0.9 OUTLIER -122.52 126.62 48.19 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 114.921 -1.036 . . . . 0.0 108.963 179.059 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 30.5 m -131.3 174.96 12.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 121.392 0.615 . . . . 0.0 111.742 -179.379 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -98.28 145.61 17.83 Favored Glycine 0 CA--C 1.528 0.883 0 N-CA-C 109.638 -1.385 . . . . 0.0 109.638 178.393 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 6.9 tt0 -87.41 113.98 56.58 Favored Pre-proline 0 N--CA 1.466 0.346 0 CA-C-N 117.886 0.843 . . . . 0.0 111.992 -178.486 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -84.58 161.37 12.57 Favored 'Trans proline' 0 C--N 1.308 -1.575 0 C-N-CA 121.663 1.575 . . . . 0.0 111.359 178.474 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 4.8 tt0 -65.43 -40.06 92.87 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 112.279 0.474 . . . . 0.0 112.279 -178.894 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.524 ' O ' ' N ' ' A' ' 50' ' ' ASN . 57.7 t0 -73.18 8.39 1.68 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.528 -0.306 . . . . 0.0 111.62 -178.755 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' TRP . . . . . 0.465 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 62.6 t-105 -60.93 68.2 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.564 -0.289 . . . . 0.0 111.567 -179.667 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.555 ' ND2' ' C ' ' A' ' 50' ' ' ASN . 0.6 OUTLIER -93.69 78.69 4.26 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 178.468 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -138.58 161.43 25.75 Favored Glycine 0 CA--C 1.524 0.602 0 C-N-CA 120.875 -0.679 . . . . 0.0 111.721 -179.429 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . 0.516 ' H ' ' NE2' ' A' ' 24' ' ' GLN . 0.4 OUTLIER -96.14 120.39 62.81 Favored Pre-proline 0 CA--C 1.535 0.385 0 N-CA-C 109.836 -0.431 . . . . 0.0 109.836 179.774 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_endo -63.86 -22.29 68.99 Favored 'Trans proline' 0 N--CA 1.492 1.44 0 C-N-CA 122.172 1.914 . . . . 0.0 112.48 -179.368 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 42.5 mm-40 -75.95 -23.84 55.43 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 120.353 -0.539 . . . . 0.0 111.12 -179.492 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.518 ' O ' ' CE1' ' A' ' 57' ' ' PHE . 80.6 mtt180 -96.87 146.79 31.91 Favored Pre-proline 0 CA--C 1.532 0.258 0 C-N-CA 120.748 -0.381 . . . . 0.0 110.396 179.956 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_exo -57.87 160.97 13.77 Favored 'Trans proline' 0 N--CA 1.496 1.653 0 C-N-CA 122.665 2.244 . . . . 0.0 113.177 -179.332 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.518 ' CE1' ' O ' ' A' ' 55' ' ' ARG . 33.9 m-85 -129.62 154.88 46.66 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 114.973 -1.012 . . . . 0.0 108.766 179.049 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 28.3 mt-10 -122.25 137.93 54.67 Favored 'General case' 0 N--CA 1.465 0.279 0 N-CA-C 109.319 -0.623 . . . . 0.0 109.319 178.54 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -121.41 139.47 53.41 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.033 0.444 . . . . 0.0 112.167 -178.026 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.503 ' CG ' HH11 ' A' ' 60' ' ' ARG . 1.9 mtt-85 -123.12 127.31 48.52 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 177.03 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.49 ' N ' HD12 ' A' ' 61' ' ' LEU . 9.6 mp -106.52 151.07 25.47 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 120.777 -0.369 . . . . 0.0 110.255 -179.433 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 28.4 m-85 -134.11 110.0 9.31 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.735 179.963 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.518 ' C ' HD23 ' A' ' 63' ' ' LEU . 2.2 tt -104.37 -82.39 0.51 Allowed 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 115.698 -0.683 . . . . 0.0 109.346 179.513 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.455 ' H ' ' HB ' ' A' ' 67' ' ' VAL . . . -79.43 179.18 53.23 Favored Glycine 0 CA--C 1.523 0.535 0 N-CA-C 109.343 -1.503 . . . . 0.0 109.343 178.561 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 1.6 mt -73.58 -34.5 65.14 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 119.767 -0.773 . . . . 0.0 110.426 -179.463 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -99.96 9.23 43.27 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.954 179.908 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.567 ' O ' HG12 ' A' ' 67' ' ' VAL . 9.6 t -106.35 96.04 4.29 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.228 0 CA-C-O 121.168 0.509 . . . . 0.0 111.96 -178.616 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.513 HD12 ' N ' ' A' ' 69' ' ' ILE . 1.2 tp -114.97 118.06 32.38 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 178.216 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.513 ' N ' HD12 ' A' ' 68' ' ' LEU . 3.1 mt -112.46 146.15 17.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-O 120.846 0.355 . . . . 0.0 111.791 -178.193 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.482 ' NH2' ' OD2' ' A' ' 91' ' ' ASP . 33.8 ptt180 -128.04 132.23 49.1 Favored 'General case' 0 C--O 1.237 0.444 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.053 179.254 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -143.95 150.18 37.94 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.341 -0.845 . . . . 0.0 110.26 -179.965 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -106.33 126.81 52.7 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 178.332 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.593 ' C ' HE21 ' A' ' 88' ' ' GLN . 10.5 pt -134.75 158.97 41.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 C-N-CA 119.77 -0.772 . . . . 0.0 113.01 -177.521 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . 0.579 ' OG ' ' NE2' ' A' ' 88' ' ' GLN . 0.5 OUTLIER -122.77 155.87 35.64 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 115.048 -0.978 . . . . 0.0 110.172 179.209 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.491 HD22 ' CZ ' ' A' ' 85' ' ' PHE . 0.1 OUTLIER -65.66 119.23 10.78 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.311 -179.902 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . 0.416 ' N ' HD13 ' A' ' 75' ' ' LEU . . . -96.98 -40.75 8.73 Favored 'General case' 0 C--N 1.331 -0.203 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 177.648 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' TRP . . . . . 0.585 ' NE1' ' HA3' ' A' ' 84' ' ' GLY . 68.1 p-90 -171.28 169.3 6.4 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.517 -0.765 . . . . 0.0 109.809 179.8 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -149.43 123.79 9.62 Favored 'General case' 0 N--CA 1.464 0.245 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 178.728 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 26.7 ttt180 -152.35 134.36 14.91 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 119.706 -0.798 . . . . 0.0 113.017 179.791 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . 0.515 ' O ' ' OD1' ' A' ' 80' ' ' ASP . 11.8 t0 57.07 47.51 17.27 Favored 'General case' 0 N--CA 1.463 0.18 0 N-CA-C 113.861 1.06 . . . . 0.0 113.861 176.702 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 82.54 -27.61 3.68 Favored Glycine 0 CA--C 1.523 0.548 0 C-N-CA 120.356 -0.926 . . . . 0.0 113.491 177.121 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 4.7 mt -89.62 157.19 18.13 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 117.756 0.778 . . . . 0.0 110.285 -179.156 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 26.3 mt -128.22 135.43 49.69 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.0 -179.077 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . 0.585 ' HA3' ' NE1' ' A' ' 77' ' ' TRP . . . -98.39 152.52 19.8 Favored Glycine 0 N--CA 1.45 -0.378 0 N-CA-C 109.65 -1.38 . . . . 0.0 109.65 178.734 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . 0.491 ' CZ ' HD22 ' A' ' 75' ' ' LEU . 22.4 m-85 -145.66 135.31 23.32 Favored 'General case' 0 C--N 1.317 -0.819 0 C-N-CA 120.642 -0.423 . . . . 0.0 110.913 -179.199 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -104.26 126.22 51.18 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 178.843 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . 0.414 ' HA ' HG22 ' A' ' 73' ' ' ILE . 2.2 t -69.13 122.39 18.68 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.956 0.407 . . . . 0.0 111.679 -178.451 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . 0.593 HE21 ' C ' ' A' ' 73' ' ' ILE . 24.3 mt-30 -96.17 -33.52 12.01 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.18 179.411 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . 0.5 ' ND1' ' C ' ' A' ' 89' ' ' HIS . 0.0 OUTLIER -162.99 142.54 8.89 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.394 -179.905 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.468 HG23 ' CG1' ' A' ' 95' ' ' ILE . 6.2 tt -145.21 141.08 22.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-N 115.856 -0.611 . . . . 0.0 109.695 -179.844 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . 0.483 ' OD1' ' N ' ' A' ' 93' ' ' ASP . 7.0 t70 -56.6 145.72 27.52 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 115.54 -0.755 . . . . 0.0 111.807 -178.109 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.435 ' N ' ' OD1' ' A' ' 91' ' ' ASP . 48.5 tp -54.24 -42.21 69.63 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 115.272 -0.877 . . . . 0.0 110.446 -179.144 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . 0.483 ' N ' ' OD1' ' A' ' 91' ' ' ASP . 1.3 m-20 -70.16 -33.07 71.32 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 179.523 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . 0.421 ' HB3' HD11 ' A' ' 90' ' ' ILE . 13.3 m -69.06 -37.81 78.73 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.838 -0.619 . . . . 0.0 109.84 179.309 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . 0.468 ' CG1' HG23 ' A' ' 90' ' ' ILE . 56.6 mt -58.87 -38.12 70.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.19 179.623 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -70.6 -42.06 71.5 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.421 -0.512 . . . . 0.0 111.364 -178.538 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 60.9 m-70 -61.74 -35.78 79.09 Favored 'General case' 0 C--N 1.324 -0.53 0 C-N-CA 119.143 -1.023 . . . . 0.0 109.126 179.51 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 6.0 mp -67.49 -34.86 78.02 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 177.41 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 58.3 mtp180 -66.25 -39.43 89.5 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 108.671 -0.863 . . . . 0.0 108.671 177.877 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 29.7 mmt-85 -60.15 -42.95 95.99 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.116 -0.947 . . . . 0.0 110.663 178.864 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.436 HD23 ' HA ' ' A' ' 101' ' ' LEU . 5.6 mt -61.14 -36.34 79.51 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 -179.765 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . 0.522 HG22 HG12 ' A' ' 14' ' ' ILE . 90.3 t -68.73 -44.86 81.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.258 179.793 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 66.2 mt-10 -65.33 -45.55 83.78 Favored 'General case' 0 N--CA 1.464 0.243 0 N-CA-C 112.261 0.467 . . . . 0.0 112.261 -178.595 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.507 ' O ' ' N ' ' A' ' 108' ' ' ASP . 6.4 mp -72.52 -41.22 66.12 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 120.872 -0.331 . . . . 0.0 111.453 -179.231 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . 0.434 ' OD1' ' O ' ' A' ' 101' ' ' LEU . 9.9 m120 -57.75 -25.79 60.95 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 120.658 -0.417 . . . . 0.0 110.201 179.909 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 1.6 tp -56.55 -18.87 13.16 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.572 -179.89 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . 0.568 ' O ' ' N ' ' A' ' 109' ' ' GLU . . . -148.5 -45.07 0.03 OUTLIER Glycine 0 CA--C 1.524 0.627 0 C-N-CA 120.865 -0.683 . . . . 0.0 111.568 -179.695 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . 0.507 ' N ' ' O ' ' A' ' 104' ' ' LEU . 7.8 m-20 -60.38 71.83 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.816 0.341 . . . . 0.0 110.496 -179.772 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . 0.568 ' N ' ' O ' ' A' ' 107' ' ' GLY . 2.7 tp10 -171.93 150.56 2.6 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.36 -179.736 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 23.5 mt-10 -62.17 -117.43 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.296 179.863 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . 0.659 HD12 ' N ' ' A' ' 111' ' ' LEU . 8.2 mp -67.6 -139.8 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.811 -0.44 . . . . 0.0 109.811 179.643 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 1.2 mp 56.4 40.16 29.79 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.664 0.268 . . . . 0.0 111.051 179.681 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -144.79 92.64 2.3 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.887 0.375 . . . . 0.0 110.408 179.797 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . 0.416 HH11 ' HB2' ' A' ' 116' ' ' LEU . 0.1 OUTLIER -173.09 122.32 0.39 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.595 179.976 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 75.5 mm-40 -48.81 -36.2 16.18 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.226 179.732 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.638 ' O ' HG23 ' A' ' 120' ' ' VAL . 9.9 mp -53.86 -44.86 70.74 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.355 179.539 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -66.18 -51.68 55.47 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.897 0.38 . . . . 0.0 111.282 179.888 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 15.1 mt -58.48 -49.02 78.85 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.987 -0.551 . . . . 0.0 112.458 -177.974 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . 0.516 ' O ' ' O ' ' A' ' 122' ' ' ALA . 0.7 OUTLIER -72.77 -49.36 31.26 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 120.008 -0.677 . . . . 0.0 111.567 -178.705 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . 0.638 HG23 ' O ' ' A' ' 116' ' ' LEU . 87.8 t -56.76 -12.56 1.27 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 C-N-CA 120.162 -0.615 . . . . 0.0 111.136 -176.19 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 121' ' ' SER . . . . . 0.484 ' O ' ' OG ' ' A' ' 121' ' ' SER . 1.8 t -88.51 18.48 4.53 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 178.185 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . 0.516 ' O ' ' O ' ' A' ' 119' ' ' LEU . . . 170.79 -170.66 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 115.431 -0.804 . . . . 0.0 109.695 179.86 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . 0.775 ' O ' ' N ' ' A' ' 125' ' ' ASP . 4.8 p80 -175.86 -173.1 0.57 Allowed 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.72 -0.392 . . . . 0.0 111.017 179.245 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . 0.656 ' O ' ' CB ' ' A' ' 125' ' ' ASP . 0.5 OUTLIER -30.38 -17.47 0.0 OUTLIER 'General case' 0 CA--C 1.531 0.214 0 N-CA-C 113.275 0.843 . . . . 0.0 113.275 -179.428 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 125' ' ' ASP . . . . . 0.775 ' N ' ' O ' ' A' ' 123' ' ' HIS . 25.1 t70 . . . . . 0 N--CA 1.472 0.654 0 CA-C-O 118.113 -0.946 . . . . 0.0 110.08 179.9 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 501' ' ' C2E . . . . . 0.999 ' O21' " H4'" ' A' ' 501' ' ' C2E . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 502' ' ' C2E . . . . . 0.663 ' C61' ' H ' ' A' ' 8' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.615 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 8.5 t -148.81 21.09 1.01 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.778 -179.748 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 51.2 m-20 -98.75 -7.26 27.94 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.084 0.468 . . . . 0.0 110.252 179.31 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.818 HE21 ' H ' ' A' ' 4' ' ' GLN . 0.0 OUTLIER -112.89 15.13 19.84 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.889 -179.093 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . 0.694 ' CD2' ' O ' ' A' ' 4' ' ' GLN . 0.0 OUTLIER 50.89 17.7 0.45 Allowed 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 108.046 -1.094 . . . . 0.0 108.046 -177.365 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . 0.736 ' H ' ' NE2' ' A' ' 4' ' ' GLN . 13.3 m-20 48.12 82.32 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 114.742 -1.117 . . . . 0.0 110.443 -179.355 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.427 ' HA ' ' C51' ' A' ' 502' ' ' C2E . 8.7 tt0 -83.72 119.69 25.11 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 179.074 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.61 ' NH2' ' N11' ' A' ' 501' ' ' C2E . 0.0 OUTLIER -126.14 21.96 7.32 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.489 -178.515 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.657 ' NH1' ' NE ' ' A' ' 13' ' ' ARG . 8.9 mtt180 -124.98 113.79 18.28 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 120.405 -0.518 . . . . 0.0 111.219 -179.14 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.664 ' CD ' ' H ' ' A' ' 11' ' ' PHE . 0.0 OUTLIER -30.19 -64.8 0.12 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.414 -0.812 . . . . 0.0 110.988 179.717 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . 0.664 ' H ' ' CD ' ' A' ' 10' ' ' ARG . 26.9 m-85 -111.83 170.91 7.82 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-O 120.97 0.414 . . . . 0.0 111.03 -179.622 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . 0.718 ' H ' ' CD2' ' A' ' 12' ' ' HIS . 0.3 OUTLIER -81.68 156.65 24.95 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.483 179.959 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.657 ' NE ' ' NH1' ' A' ' 9' ' ' ARG . 0.1 OUTLIER -102.9 145.46 29.78 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-O 120.995 0.426 . . . . 0.0 110.845 -179.899 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.628 ' N ' HD12 ' A' ' 14' ' ' ILE . 1.2 mp -82.52 102.21 8.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 179.162 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -94.96 120.25 34.86 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.582 0.706 . . . . 0.0 112.035 -178.924 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 2.5 p90 -149.77 158.79 44.5 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 114.686 -1.143 . . . . 0.0 107.959 177.605 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -95.26 147.11 23.83 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 119.981 -0.688 . . . . 0.0 110.574 -178.963 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.424 ' O ' HD12 ' A' ' 32' ' ' LEU . . . -179.67 178.48 0.64 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.902 -0.59 . . . . 0.0 109.763 179.915 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -96.55 134.04 40.26 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 120.786 -0.365 . . . . 0.0 110.976 179.987 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.583 ' O ' ' O ' ' A' ' 31' ' ' VAL . 7.6 p -135.78 157.04 47.84 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.18 179.044 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.406 ' C ' ' OE1' ' A' ' 21' ' ' GLU . 0.8 OUTLIER -144.74 144.38 31.16 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.122 -0.696 . . . . 0.0 109.122 178.702 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 1.2 mm -119.24 136.75 55.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-O 121.133 0.492 . . . . 0.0 111.591 -177.995 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.549 HD11 ' HG3' ' A' ' 60' ' ' ARG . 0.2 OUTLIER -121.63 123.15 41.24 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.617 -0.72 . . . . 0.0 111.017 -179.882 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.466 ' O ' ' OE1' ' A' ' 24' ' ' GLN . 1.4 tm0? -130.34 102.39 6.17 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.096 179.342 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 80.07 -126.06 7.24 Favored Glycine 0 CA--C 1.523 0.564 0 N-CA-C 109.821 -1.312 . . . . 0.0 109.821 -178.707 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -100.19 11.87 38.36 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 179.151 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.486 ' HB3' ' CZ2' ' A' ' 29' ' ' TRP . 2.2 mtt180 -112.74 131.25 55.76 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.846 -0.615 . . . . 0.0 112.364 -177.267 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.452 HH11 ' HD3' ' A' ' 28' ' ' ARG . 36.4 ttt180 -126.24 148.47 49.47 Favored 'General case' 0 CA--C 1.519 -0.238 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.783 178.875 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.53 ' NE1' ' O ' ' A' ' 48' ' ' ASP . 7.1 m-90 -147.47 156.44 42.85 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.459 -178.894 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.536 ' CD ' ' H ' ' A' ' 30' ' ' GLU . 3.1 mp0 -102.4 140.89 36.08 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.162 -0.472 . . . . 0.0 109.9 179.58 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.583 ' O ' ' O ' ' A' ' 20' ' ' SER . 12.4 m -150.25 157.25 6.16 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-O 121.159 0.504 . . . . 0.0 110.904 -179.697 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.507 HD12 ' N ' ' A' ' 33' ' ' LEU . 6.7 tp -94.23 128.54 40.74 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 107.475 -1.306 . . . . 0.0 107.475 178.144 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.802 ' O ' HD23 ' A' ' 33' ' ' LEU . 0.4 OUTLIER -90.22 126.01 35.68 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.57 -0.53 . . . . 0.0 109.57 -179.727 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 40.0 m-70 -93.06 -28.64 16.24 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.558 -0.747 . . . . 0.0 111.962 -178.218 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 2.0 p-10 -172.75 158.76 4.08 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 119.483 -0.887 . . . . 0.0 110.862 177.418 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.538 HG22 ' N ' ' A' ' 37' ' ' SER . 7.1 p -143.54 169.27 11.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.494 -0.775 . . . . 0.0 110.878 -178.904 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.538 ' N ' HG22 ' A' ' 36' ' ' VAL . 17.1 t -140.91 170.72 15.2 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 178.814 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.489 HD12 ' N ' ' A' ' 39' ' ' HIS . 1.1 pp -67.4 -0.11 3.39 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 119.976 -0.689 . . . . 0.0 111.11 -179.397 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . 0.514 ' NE2' ' O ' ' A' ' 87' ' ' CYS . 1.6 t60 -162.22 35.12 0.12 Allowed 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 120.73 -0.388 . . . . 0.0 111.217 179.776 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . 0.509 ' HA3' ' N3 ' ' A' ' 501' ' ' C2E . . . -171.66 156.06 25.23 Favored Glycine 0 CA--C 1.526 0.731 0 N-CA-C 110.759 -0.936 . . . . 0.0 110.759 179.903 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -148.03 150.37 14.43 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 CA-C-O 121.597 0.713 . . . . 0.0 112.606 -178.839 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.452 HD12 ' O6 ' ' A' ' 501' ' ' C2E . 0.6 OUTLIER -123.0 140.51 52.96 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 114.665 -1.152 . . . . 0.0 109.191 178.849 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.415 ' N ' HD23 ' A' ' 42' ' ' LEU . 10.6 m -145.58 174.99 2.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-O 121.091 0.472 . . . . 0.0 111.092 179.95 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -96.96 145.38 17.84 Favored Glycine 0 CA--C 1.526 0.775 0 N-CA-C 109.47 -1.452 . . . . 0.0 109.47 178.237 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 45.2 tt0 -86.6 115.63 62.99 Favored Pre-proline 0 N--CA 1.462 0.154 0 CA-C-N 117.732 0.766 . . . . 0.0 111.79 -178.538 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 66.4 Cg_endo -85.13 161.33 11.53 Favored 'Trans proline' 0 C--N 1.306 -1.67 0 C-N-CA 121.569 1.513 . . . . 0.0 111.134 178.856 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 58.7 mt-30 -65.17 -40.14 93.89 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 112.128 0.418 . . . . 0.0 112.128 -178.885 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.562 ' O ' ' N ' ' A' ' 50' ' ' ASN . 0.9 OUTLIER -72.21 8.63 1.24 Allowed 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 111.85 0.315 . . . . 0.0 111.85 -178.794 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' TRP . . . . . 0.486 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 64.9 t-105 -59.57 67.17 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 111.825 0.305 . . . . 0.0 111.825 -179.738 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.562 ' N ' ' O ' ' A' ' 48' ' ' ASP . 0.2 OUTLIER -93.33 78.34 4.47 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 120.159 -0.616 . . . . 0.0 109.59 178.325 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -144.58 144.34 13.18 Favored Glycine 0 CA--C 1.523 0.533 0 N-CA-C 111.17 -0.772 . . . . 0.0 111.17 -179.38 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 23.0 t0 -77.94 113.33 31.94 Favored Pre-proline 0 CA--C 1.533 0.318 0 CA-C-N 115.878 -0.161 . . . . 0.0 111.102 -179.709 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -50.07 -22.63 8.12 Favored 'Trans proline' 0 N--CA 1.495 1.584 0 C-N-CA 122.522 2.148 . . . . 0.0 112.673 179.578 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 16.7 mm100 -77.51 -23.99 50.12 Favored 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 120.642 -0.423 . . . . 0.0 111.769 -178.853 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.575 ' O ' ' CE1' ' A' ' 57' ' ' PHE . 66.8 mtm180 -92.94 151.04 40.34 Favored Pre-proline 0 C--N 1.33 -0.252 0 C-N-CA 120.671 -0.412 . . . . 0.0 110.077 179.741 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -62.94 160.73 32.32 Favored 'Trans proline' 0 N--CA 1.495 1.596 0 C-N-CA 122.834 2.356 . . . . 0.0 113.436 -178.701 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.575 ' CE1' ' O ' ' A' ' 55' ' ' ARG . 41.6 m-85 -130.59 155.18 46.97 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 114.897 -1.047 . . . . 0.0 109.147 179.343 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.411 ' O ' HD12 ' A' ' 23' ' ' LEU . 14.3 mt-10 -123.06 139.07 54.46 Favored 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 178.777 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . 0.429 ' HB2' HD13 ' A' ' 73' ' ' ILE . . . -118.66 135.93 54.2 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 112.501 0.556 . . . . 0.0 112.501 -177.772 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.574 ' C ' HD12 ' A' ' 61' ' ' LEU . 2.1 mmt85 -122.74 127.67 49.5 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 108.261 -1.014 . . . . 0.0 108.261 177.107 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.625 ' N ' HD12 ' A' ' 61' ' ' LEU . 7.9 mp -111.48 151.22 28.85 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 120.67 -0.412 . . . . 0.0 111.241 -178.558 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 9.8 m-85 -131.76 110.09 10.61 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.625 179.446 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.507 ' C ' HD23 ' A' ' 63' ' ' LEU . 2.0 tt -103.78 -85.43 0.46 Allowed 'General case' 0 C--N 1.333 -0.143 0 N-CA-C 108.991 -0.744 . . . . 0.0 108.991 178.968 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.45 ' H ' ' HB ' ' A' ' 67' ' ' VAL . . . -75.28 179.84 45.1 Favored Glycine 0 CA--C 1.522 0.508 0 N-CA-C 109.017 -1.633 . . . . 0.0 109.017 178.338 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.79 HD22 ' N ' ' A' ' 65' ' ' LEU . 2.5 mm? -74.42 -32.44 62.66 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 119.709 -0.796 . . . . 0.0 110.232 -179.479 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 24.7 m-20 -102.53 9.27 39.59 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 122.734 0.414 . . . . 0.0 111.063 -179.827 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.574 ' O ' HG12 ' A' ' 67' ' ' VAL . 8.5 t -103.22 93.76 2.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-O 121.34 0.59 . . . . 0.0 111.667 -178.905 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 4.4 tp -109.99 117.66 34.37 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 178.272 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.55 HG23 ' OG ' ' A' ' 94' ' ' SER . 6.3 mt -115.78 143.99 24.45 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.278 0 CA-C-O 120.982 0.42 . . . . 0.0 111.374 -178.88 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.502 ' NH2' ' OD2' ' A' ' 91' ' ' ASP . 28.5 ptt-85 -128.38 130.73 48.13 Favored 'General case' 0 C--O 1.237 0.441 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.007 179.223 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . 0.699 ' SD ' HD12 ' A' ' 90' ' ' ILE . 1.5 mtm -139.95 148.19 41.58 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 115.934 -0.576 . . . . 0.0 109.691 179.453 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -101.97 132.68 47.65 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 107.87 -1.159 . . . . 0.0 107.87 178.718 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.649 HD12 ' HB2' ' A' ' 85' ' ' PHE . 4.1 pt -142.7 157.41 18.5 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 C-N-CA 119.44 -0.904 . . . . 0.0 112.977 -177.666 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . 0.656 ' N ' HE22 ' A' ' 88' ' ' GLN . 3.3 t -121.91 155.45 35.42 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 115.47 -0.786 . . . . 0.0 109.763 179.032 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.593 HD13 ' N ' ' A' ' 76' ' ' ALA . 0.2 OUTLIER -65.02 118.43 9.11 Favored 'General case' 0 CA--C 1.521 -0.162 0 CA-C-O 121.161 0.505 . . . . 0.0 110.603 -178.575 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . 0.593 ' N ' HD13 ' A' ' 75' ' ' LEU . . . -97.22 -40.99 8.51 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.064 177.446 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' TRP . . . . . 0.595 ' CD1' ' C2 ' ' A' ' 502' ' ' C2E . 68.8 p-90 -170.42 169.76 7.33 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.79 -179.819 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -151.07 123.99 8.65 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 116.299 -0.409 . . . . 0.0 109.948 178.658 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -152.04 132.03 13.42 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 120.043 -0.663 . . . . 0.0 112.364 179.593 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 55.67 47.19 21.14 Favored 'General case' 0 N--CA 1.465 0.287 0 N-CA-C 113.089 0.774 . . . . 0.0 113.089 176.85 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 68.17 12.67 63.44 Favored Glycine 0 CA--C 1.523 0.547 0 C-N-CA 120.343 -0.932 . . . . 0.0 111.902 178.385 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 29.1 mt -115.74 136.13 53.36 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 108.474 -0.935 . . . . 0.0 108.474 178.488 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 37.6 mt -124.48 136.41 53.99 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.497 -178.928 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . 0.475 ' HA3' ' NE1' ' A' ' 77' ' ' TRP . . . -123.36 134.58 9.49 Favored Glycine 0 CA--C 1.519 0.337 0 N-CA-C 109.481 -1.448 . . . . 0.0 109.481 178.551 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . 0.649 ' HB2' HD12 ' A' ' 73' ' ' ILE . 26.0 m-85 -122.65 157.78 31.46 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.964 0.412 . . . . 0.0 110.096 -179.805 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -104.8 130.55 52.89 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 178.314 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . 0.514 ' O ' ' NE2' ' A' ' 39' ' ' HIS . 44.5 t -74.78 124.23 26.42 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.826 0.346 . . . . 0.0 111.336 -178.976 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . 0.656 HE22 ' N ' ' A' ' 74' ' ' SER . 0.0 OUTLIER -100.73 -31.2 11.31 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.458 179.598 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . 0.611 ' ND1' ' N ' ' A' ' 90' ' ' ILE . 0.0 OUTLIER -159.2 141.0 13.4 Favored 'General case' 0 C--O 1.225 -0.203 0 CA-C-O 120.909 0.385 . . . . 0.0 110.08 179.283 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.699 HD12 ' SD ' ' A' ' 71' ' ' MET . 7.7 tt -145.31 140.51 22.47 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-O 121.438 0.637 . . . . 0.0 110.15 -178.947 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . 0.502 ' OD2' ' NH2' ' A' ' 70' ' ' ARG . 0.1 OUTLIER -55.02 140.85 36.34 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 115.033 -0.985 . . . . 0.0 112.334 -178.058 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 6.6 tp -54.56 -42.62 71.21 Favored 'General case' 0 N--CA 1.462 0.136 0 CA-C-N 115.075 -0.966 . . . . 0.0 110.321 -179.642 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . 0.414 ' OD1' ' N ' ' A' ' 94' ' ' SER . 0.5 OUTLIER -71.93 -35.8 69.75 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 179.557 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . 0.55 ' OG ' HG23 ' A' ' 69' ' ' ILE . 1.5 t -64.53 -38.26 90.39 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.427 179.078 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . 0.442 ' CG1' HG23 ' A' ' 90' ' ' ILE . 22.0 mt -59.01 -37.49 68.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.372 179.133 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -70.19 -40.12 74.83 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.096 -0.641 . . . . 0.0 110.612 -178.938 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 59.7 m-70 -63.08 -37.07 85.76 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 119.475 -0.89 . . . . 0.0 109.097 179.315 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -67.52 -37.5 82.85 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 178.131 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 48.7 mtp85 -66.35 -38.52 87.8 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 178.402 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 23.0 mmt180 -57.15 -39.9 76.14 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.32 178.098 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.436 HD21 HD12 ' A' ' 63' ' ' LEU . 5.4 mp -69.6 -36.75 76.49 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.359 -0.837 . . . . 0.0 110.183 -179.797 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 87.8 t -68.4 -46.67 80.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.62 179.851 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 94.2 mt-10 -65.16 -42.22 93.94 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.031 -179.667 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 44.8 mt -69.37 -40.43 77.46 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.813 -0.355 . . . . 0.0 110.684 -179.485 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -58.14 -48.98 78.58 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.692 -0.403 . . . . 0.0 110.132 179.832 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 4.8 mp -55.73 -39.92 71.76 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.191 179.96 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . 0.51 ' O ' ' N ' ' A' ' 109' ' ' GLU . . . 64.66 85.56 0.07 OUTLIER Glycine 0 CA--C 1.523 0.556 0 N-CA-C 110.616 -0.994 . . . . 0.0 110.616 -179.954 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -65.17 57.01 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.762 0.315 . . . . 0.0 110.494 -179.838 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . 0.51 ' N ' ' O ' ' A' ' 107' ' ' GLY . 0.0 OUTLIER -71.75 79.5 0.85 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.495 -179.991 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 61.26 -155.29 0.36 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.053 179.87 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 4.8 tt -41.75 138.57 1.4 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.861 -179.635 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 8.0 tp -162.5 67.63 0.23 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.308 179.877 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 16.0 mm-40 -111.25 126.17 54.59 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.88 -179.667 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . 0.559 ' C ' ' H ' ' A' ' 116' ' ' LEU . 3.1 tpt180 -175.52 -84.34 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.193 179.845 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . 0.458 ' HB2' HD12 ' A' ' 118' ' ' LEU . 2.4 pt-20 -71.54 18.71 0.07 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.133 179.738 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.559 ' H ' ' C ' ' A' ' 114' ' ' ARG . 6.2 tp -66.77 -40.09 88.1 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.72 -0.673 . . . . 0.0 112.167 -179.134 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 117' ' ' ALA . . . . . 0.602 ' O ' HG23 ' A' ' 120' ' ' VAL . . . -68.83 -22.45 64.24 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 111.7 0.259 . . . . 0.0 111.7 -179.554 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.458 HD12 ' HB2' ' A' ' 115' ' ' GLU . 72.7 mt -53.26 -31.04 41.61 Favored 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 120.6 -0.44 . . . . 0.0 110.627 -178.508 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . 0.531 ' CD2' ' N ' ' A' ' 119' ' ' LEU . 1.4 mm? -58.99 -27.92 65.87 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 177.927 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . 0.602 HG23 ' O ' ' A' ' 117' ' ' ALA . 43.0 t -59.15 -46.81 91.78 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.169 0 CA-C-N 115.37 -0.832 . . . . 0.0 111.565 179.662 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 121' ' ' SER . . . . . 0.507 ' C ' ' H ' ' A' ' 123' ' ' HIS . 1.2 t -89.24 -30.73 18.3 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.743 -178.466 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -73.31 19.68 0.09 Allowed 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.157 -0.617 . . . . 0.0 110.583 -179.225 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . 0.654 ' CD2' ' N ' ' A' ' 124' ' ' ASP . 0.1 OUTLIER -106.6 -44.55 4.45 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.357 179.941 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . 0.654 ' N ' ' CD2' ' A' ' 123' ' ' HIS . 10.1 t0 -121.71 -27.01 4.78 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.828 -179.85 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 125' ' ' ASP . . . . . 0.461 ' O ' ' O ' ' A' ' 121' ' ' SER . 0.2 OUTLIER . . . . . 0 C--O 1.22 -0.471 0 CA-C-O 118.152 -0.928 . . . . 0.0 110.593 -179.593 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 501' ' ' C2E . . . . . 1.043 ' O21' " H4'" ' A' ' 501' ' ' C2E . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 502' ' ' C2E . . . . . 0.595 ' C2 ' ' CD1' ' A' ' 77' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.583 0 N-CA-C 109.408 -0.59 . . . . 0.0 109.408 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 51.6 p -119.44 65.32 0.79 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.356 179.74 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 18.1 p-10 -99.08 29.69 3.76 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.547 179.64 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.583 HE22 ' N ' ' A' ' 6' ' ' ASP . 0.4 OUTLIER -111.95 12.91 20.79 Favored 'General case' 0 N--CA 1.462 0.161 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.793 -179.871 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . 0.544 ' CG ' ' O4A' ' A' ' 502' ' ' C2E . 0.0 OUTLIER 46.43 102.42 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.053 179.764 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . 0.583 ' N ' HE22 ' A' ' 4' ' ' GLN . 6.0 m-20 -52.38 158.52 1.19 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.205 179.39 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.514 ' N ' ' OE1' ' A' ' 7' ' ' GLU . 16.0 pm0 -91.81 134.75 34.47 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-O 121.089 0.471 . . . . 0.0 110.798 -179.821 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.724 HH21 ' C21' ' A' ' 501' ' ' C2E . 0.0 OUTLIER -122.47 -8.03 8.61 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.254 -178.962 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.636 ' CD ' HH11 ' A' ' 13' ' ' ARG . 1.2 ptt85 -111.73 93.07 4.28 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-O 120.917 0.389 . . . . 0.0 110.184 179.946 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.521 ' C ' ' O ' ' A' ' 9' ' ' ARG . 0.0 OUTLIER 17.26 -82.55 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 115.363 -0.835 . . . . 0.0 111.672 -179.775 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . 0.563 ' N ' ' O ' ' A' ' 9' ' ' ARG . 0.9 OUTLIER -127.83 156.73 42.07 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-O 120.816 0.341 . . . . 0.0 110.332 -179.642 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . 0.521 ' O ' ' CD2' ' A' ' 12' ' ' HIS . 0.5 OUTLIER -51.06 135.17 25.6 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.608 -179.888 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.65 ' NH2' HD12 ' A' ' 42' ' ' LEU . 15.6 mtm-85 -76.68 160.65 29.18 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.783 -179.72 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.704 ' N ' HD12 ' A' ' 14' ' ' ILE . 1.5 mp -73.31 95.93 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.762 179.745 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -95.5 120.68 36.17 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.307 0.575 . . . . 0.0 112.497 -178.806 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 28.9 p90 -149.74 158.71 44.43 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.009 -0.996 . . . . 0.0 108.316 177.199 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -95.42 147.59 23.37 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 120.152 -0.619 . . . . 0.0 110.74 -179.174 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.617 ' O ' HD12 ' A' ' 32' ' ' LEU . . . 179.27 176.79 0.58 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.097 179.879 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -96.26 134.16 39.71 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.946 -179.927 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.492 ' O ' ' O ' ' A' ' 31' ' ' VAL . 11.7 p -134.44 153.37 51.95 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.925 0.393 . . . . 0.0 110.375 178.952 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 68.6 mt-10 -133.49 140.02 47.0 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 109.136 -0.69 . . . . 0.0 109.136 179.437 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.411 ' HA ' ' O ' ' A' ' 58' ' ' GLU . 0.6 OUTLIER -119.9 135.77 59.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-O 121.311 0.577 . . . . 0.0 110.639 -179.47 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.459 ' H ' HD12 ' A' ' 23' ' ' LEU . 0.2 OUTLIER -123.71 123.26 40.14 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.407 -0.815 . . . . 0.0 111.113 -179.075 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.496 ' OE1' ' NH1' ' A' ' 27' ' ' ARG . 1.5 tm0? -129.62 102.09 6.21 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.377 -0.828 . . . . 0.0 110.042 179.079 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 81.06 -126.44 7.38 Favored Glycine 0 CA--C 1.523 0.549 0 N-CA-C 109.961 -1.256 . . . . 0.0 109.961 -178.87 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 14.7 pt-20 -100.18 11.66 38.83 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 179.269 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.496 ' NH1' ' OE1' ' A' ' 24' ' ' GLN . 0.2 OUTLIER -114.51 133.07 56.05 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.604 -0.726 . . . . 0.0 112.607 -176.443 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.433 ' O ' ' CD1' ' A' ' 29' ' ' TRP . 41.8 ttt-85 -128.12 153.0 47.33 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.334 179.555 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.433 ' CD1' ' O ' ' A' ' 28' ' ' ARG . 6.3 m-90 -150.51 156.48 41.5 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.276 -0.875 . . . . 0.0 110.501 -179.41 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.453 ' N ' ' CD ' ' A' ' 30' ' ' GLU . 4.7 mp0 -100.72 138.59 37.57 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.692 -0.485 . . . . 0.0 109.692 179.462 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.492 ' O ' ' O ' ' A' ' 20' ' ' SER . 18.4 m -148.34 158.69 7.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 121.232 0.539 . . . . 0.0 111.357 -179.241 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.617 HD12 ' O ' ' A' ' 18' ' ' ALA . 15.9 tp -96.52 128.16 43.19 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 108.392 -0.966 . . . . 0.0 108.392 178.732 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -91.08 125.85 35.99 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.249 0.547 . . . . 0.0 110.061 -179.885 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 72.2 m-70 -92.1 -28.24 17.24 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.308 -0.86 . . . . 0.0 111.76 -178.809 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.59 ' CG ' HH21 ' A' ' 13' ' ' ARG . 3.6 p30 -173.78 162.47 4.02 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 119.409 -0.916 . . . . 0.0 111.449 177.677 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.504 HG22 ' H ' ' A' ' 37' ' ' SER . 3.3 p -145.35 168.84 7.93 Favored 'Isoleucine or valine' 0 C--O 1.231 0.124 0 CA-C-N 115.564 -0.744 . . . . 0.0 111.098 -179.063 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.518 ' CB ' HN22 ' A' ' 501' ' ' C2E . 30.1 t -140.99 169.32 17.84 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 107.93 -1.137 . . . . 0.0 107.93 178.694 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.68 ' H ' HD12 ' A' ' 38' ' ' LEU . 5.9 mp -64.65 0.21 1.19 Allowed 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 119.44 -0.904 . . . . 0.0 110.241 -179.256 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . 0.445 ' H ' ' C ' ' A' ' 37' ' ' SER . 32.9 p-80 -163.36 43.81 0.11 Allowed 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 120.633 -0.427 . . . . 0.0 111.581 179.995 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . 0.53 ' HA3' ' N3 ' ' A' ' 501' ' ' C2E . . . 178.78 158.18 20.79 Favored Glycine 0 CA--C 1.53 0.977 0 C-N-CA 120.716 -0.754 . . . . 0.0 111.525 179.784 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -149.34 149.19 15.01 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.352 0 CA-C-O 121.364 0.602 . . . . 0.0 111.751 -178.759 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.65 HD12 ' NH2' ' A' ' 13' ' ' ARG . 1.1 tt -121.88 127.75 50.82 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 114.93 -1.032 . . . . 0.0 108.442 178.325 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.416 ' N ' HD23 ' A' ' 42' ' ' LEU . 23.2 m -130.9 174.72 12.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-O 121.3 0.571 . . . . 0.0 111.543 -179.028 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -96.81 144.15 17.16 Favored Glycine 0 CA--C 1.526 0.774 0 N-CA-C 109.164 -1.574 . . . . 0.0 109.164 178.062 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . 0.554 HE21 ' C ' ' A' ' 45' ' ' GLN . 0.0 OUTLIER -85.4 115.49 61.59 Favored Pre-proline 0 N--CA 1.464 0.239 0 CA-C-N 117.995 0.897 . . . . 0.0 111.713 -178.633 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 78.2 Cg_endo -85.47 160.63 11.01 Favored 'Trans proline' 0 C--N 1.307 -1.616 0 C-N-CA 121.685 1.59 . . . . 0.0 111.259 178.923 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 16.5 pt20 -65.43 -30.59 71.4 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.127 0.417 . . . . 0.0 112.127 -179.106 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.543 ' O ' ' N ' ' A' ' 50' ' ' ASN . 40.7 m-20 -80.5 8.45 7.72 Favored 'General case' 0 N--CA 1.465 0.278 0 N-CA-C 111.957 0.355 . . . . 0.0 111.957 -178.699 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' TRP . . . . . 0.441 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 61.8 t-105 -60.1 66.75 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 112.089 0.403 . . . . 0.0 112.089 -179.389 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.551 HD22 ' C ' ' A' ' 50' ' ' ASN . 0.2 OUTLIER -93.25 78.9 4.48 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 120.002 -0.679 . . . . 0.0 109.555 178.386 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -143.9 160.27 27.73 Favored Glycine 0 CA--C 1.523 0.535 0 N-CA-C 111.098 -0.801 . . . . 0.0 111.098 -179.45 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -95.03 109.22 43.18 Favored Pre-proline 0 CA--C 1.534 0.358 0 CA-C-N 115.63 -0.285 . . . . 0.0 110.694 -179.756 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -48.68 -22.53 4.56 Favored 'Trans proline' 0 N--CA 1.494 1.51 0 C-N-CA 122.391 2.061 . . . . 0.0 112.549 179.831 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 8.2 mt-30 -75.71 -24.02 56.18 Favored 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 120.497 -0.481 . . . . 0.0 111.413 -179.13 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.518 ' O ' ' CE1' ' A' ' 57' ' ' PHE . 21.7 mtm180 -94.77 155.79 38.92 Favored Pre-proline 0 C--N 1.33 -0.242 0 C-N-CA 120.838 -0.345 . . . . 0.0 110.085 179.777 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -67.05 160.8 45.61 Favored 'Trans proline' 0 C--N 1.308 -1.569 0 C-N-CA 122.753 2.302 . . . . 0.0 112.935 -179.063 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.518 ' CE1' ' O ' ' A' ' 55' ' ' ARG . 58.8 m-85 -130.53 156.0 45.54 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.142 -0.936 . . . . 0.0 108.953 179.418 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.411 ' O ' ' HA ' ' A' ' 22' ' ' ILE . 33.9 mt-10 -122.5 138.61 54.5 Favored 'General case' 0 C--O 1.221 -0.434 0 N-CA-C 109.063 -0.717 . . . . 0.0 109.063 178.483 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . 0.474 ' HB2' HD13 ' A' ' 73' ' ' ILE . . . -119.86 138.3 53.48 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 112.463 0.542 . . . . 0.0 112.463 -177.876 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.505 ' CZ ' ' OH ' ' A' ' 62' ' ' TYR . 31.3 mtm180 -123.92 127.68 48.34 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 177.681 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.502 HD12 ' C ' ' A' ' 60' ' ' ARG . 11.2 mp -108.73 151.16 26.57 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.0 0.429 . . . . 0.0 111.053 -178.798 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' TYR . . . . . 0.505 ' OH ' ' CZ ' ' A' ' 60' ' ' ARG . 36.8 m-85 -133.42 108.6 8.77 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.29 179.539 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.499 HD12 ' C ' ' A' ' 62' ' ' TYR . 8.8 mp -104.47 -90.11 0.4 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.165 179.436 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -70.12 177.23 32.45 Favored Glycine 0 CA--C 1.523 0.538 0 N-CA-C 109.166 -1.574 . . . . 0.0 109.166 178.304 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.75 ' H ' HD12 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -73.21 -32.61 64.88 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 119.824 -0.75 . . . . 0.0 110.219 -179.544 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -102.42 9.65 39.55 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 122.846 0.459 . . . . 0.0 111.251 -179.763 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.463 ' O ' HG12 ' A' ' 67' ' ' VAL . 34.3 t -106.03 96.51 4.67 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.378 0 CA-C-O 121.441 0.639 . . . . 0.0 111.997 -178.747 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.446 HD13 ' CE2' ' A' ' 62' ' ' TYR . 6.5 tp -113.22 117.61 32.36 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.078 -0.965 . . . . 0.0 108.421 178.514 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.472 HG23 ' CB ' ' A' ' 94' ' ' SER . 3.7 mt -114.16 145.19 20.31 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-O 120.933 0.397 . . . . 0.0 111.56 -178.707 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 6.9 ptm180 -128.01 135.47 49.93 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.801 179.018 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -146.33 149.54 34.0 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.426 -179.597 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -102.96 135.62 44.29 Favored 'General case' 0 N--CA 1.463 0.184 0 N-CA-C 108.01 -1.107 . . . . 0.0 108.01 178.166 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.583 HD12 ' CB ' ' A' ' 85' ' ' PHE . 1.9 pt -144.37 157.89 15.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 C-N-CA 119.467 -0.893 . . . . 0.0 113.163 -177.59 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 1.3 t -123.07 155.86 36.07 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.067 178.805 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.618 HD13 ' N ' ' A' ' 76' ' ' ALA . 0.2 OUTLIER -65.2 118.66 9.56 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.951 0.405 . . . . 0.0 110.338 -179.65 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . 0.618 ' N ' HD13 ' A' ' 75' ' ' LEU . . . -97.1 -40.83 8.63 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.047 177.658 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' TRP . . . . . 0.547 ' NE1' ' HA3' ' A' ' 84' ' ' GLY . 67.2 p-90 -171.04 169.23 6.66 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.316 -179.956 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -151.27 123.86 8.47 Favored 'General case' 0 N--CA 1.464 0.226 0 N-CA-C 109.97 -0.382 . . . . 0.0 109.97 178.778 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 2.7 ttm180 -152.27 134.08 14.78 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 119.827 -0.749 . . . . 0.0 113.016 179.651 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 40.6 m-20 56.56 47.34 18.78 Favored 'General case' 0 N--CA 1.463 0.219 0 N-CA-C 113.983 1.105 . . . . 0.0 113.983 176.485 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 84.36 -27.76 4.52 Favored Glycine 0 CA--C 1.523 0.581 0 C-N-CA 120.408 -0.901 . . . . 0.0 113.452 177.23 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 4.0 mt -89.58 155.76 19.05 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 117.847 0.824 . . . . 0.0 110.439 -179.008 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 44.1 mt -128.62 135.57 49.5 Favored 'General case' 0 CA--C 1.52 -0.208 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.456 -179.136 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . 0.547 ' HA3' ' NE1' ' A' ' 77' ' ' TRP . . . -98.98 151.51 19.5 Favored Glycine 0 N--CA 1.453 -0.199 0 N-CA-C 109.691 -1.363 . . . . 0.0 109.691 178.615 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . 0.583 ' CB ' HD12 ' A' ' 73' ' ' ILE . 46.5 m-85 -145.97 136.77 24.35 Favored 'General case' 0 C--N 1.32 -0.702 0 C-N-CA 120.655 -0.418 . . . . 0.0 110.46 -179.716 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -104.06 127.28 51.63 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.411 -0.588 . . . . 0.0 109.411 179.822 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 43.3 t -77.55 128.31 33.96 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.071 0.462 . . . . 0.0 111.21 -179.065 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -103.98 -27.37 12.19 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.191 179.962 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . 0.601 ' ND1' ' N ' ' A' ' 90' ' ' ILE . 0.0 OUTLIER -159.67 140.74 12.55 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.063 0.458 . . . . 0.0 110.281 179.484 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.601 ' N ' ' ND1' ' A' ' 89' ' ' HIS . 8.8 tt -146.06 141.15 21.52 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 115.741 -0.663 . . . . 0.0 109.817 -179.942 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -53.71 140.41 29.61 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.086 -0.961 . . . . 0.0 112.242 -178.004 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 6.4 tt -54.63 -42.22 70.97 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.148 -0.933 . . . . 0.0 109.847 179.822 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -68.27 -36.73 79.84 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 179.225 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . 0.472 ' CB ' HG23 ' A' ' 69' ' ' ILE . 4.1 m -67.59 -36.4 80.81 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.595 -0.729 . . . . 0.0 109.738 179.146 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . 0.441 HG12 HG23 ' A' ' 90' ' ' ILE . 1.0 OUTLIER -58.66 -38.55 72.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.757 -0.656 . . . . 0.0 109.936 179.284 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -70.9 -38.48 72.99 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.281 -0.568 . . . . 0.0 111.281 -178.735 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' HIS . . . . . 0.479 ' O ' HD22 ' A' ' 101' ' ' LEU . 60.4 m-70 -63.38 -43.03 98.76 Favored 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 118.929 -1.108 . . . . 0.0 108.821 179.456 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.438 ' O ' HG23 ' A' ' 102' ' ' VAL . 4.1 mp -59.93 -33.97 72.61 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 110.03 -0.359 . . . . 0.0 110.03 178.193 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 5.9 mtp85 -62.42 -36.9 83.84 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 120.181 -0.607 . . . . 0.0 109.731 178.966 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 15.5 mmm180 -59.17 -51.35 70.38 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.057 179.479 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.479 HD22 ' O ' ' A' ' 97' ' ' HIS . 0.2 OUTLIER -59.38 -34.65 72.68 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.494 -179.843 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . 0.438 HG23 ' O ' ' A' ' 98' ' ' LEU . 69.8 t -68.78 -44.84 81.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.698 179.224 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -63.14 -47.38 82.95 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.55 -179.081 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 6.6 mp -63.98 -40.05 95.51 Favored 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 120.545 -0.462 . . . . 0.0 110.675 -179.558 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -57.41 -47.71 81.04 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.887 -0.325 . . . . 0.0 110.504 -179.683 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 90.0 mt -66.78 -27.41 67.56 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.47 179.956 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 101.38 -72.43 0.37 Allowed Glycine 0 CA--C 1.526 0.737 0 N-CA-C 110.99 -0.844 . . . . 0.0 110.99 179.749 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 51.1 m-20 -159.8 69.49 0.42 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.803 0.335 . . . . 0.0 110.577 -179.892 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -121.48 -174.62 2.9 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.362 179.843 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 19.7 mt-10 -77.05 -133.41 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.475 179.969 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -130.1 -174.92 3.46 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.923 0.392 . . . . 0.0 110.443 -179.804 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 2.5 tp 64.53 1.96 1.47 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.031 -0.532 . . . . 0.0 110.831 179.87 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . 0.555 ' O ' ' C ' ' A' ' 114' ' ' ARG . 4.2 mp0 41.75 -129.21 0.55 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.408 -179.877 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . 0.555 ' C ' ' O ' ' A' ' 113' ' ' GLU . 63.3 mtm-85 14.69 103.66 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.486 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.752 179.691 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . 0.592 ' H ' HD12 ' A' ' 118' ' ' LEU . 10.4 tt0 -164.61 142.7 6.71 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.228 0.537 . . . . 0.0 111.274 179.921 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 4.5 tt -54.02 -34.85 61.05 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.475 -0.784 . . . . 0.0 111.013 179.617 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 117' ' ' ALA . . . . . 0.61 ' O ' HG23 ' A' ' 120' ' ' VAL . . . -68.82 -23.25 64.24 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.015 -0.539 . . . . 0.0 112.217 179.839 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.592 HD12 ' H ' ' A' ' 115' ' ' GLU . 37.8 mt -54.22 -43.1 70.52 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 119.783 -0.767 . . . . 0.0 110.723 -177.672 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . 0.528 ' C ' ' H ' ' A' ' 121' ' ' SER . 7.2 mp -55.6 -16.69 4.32 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.085 -0.646 . . . . 0.0 110.23 -178.304 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . 0.626 ' O ' HG12 ' A' ' 120' ' ' VAL . 76.1 t -57.14 -2.55 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-O 120.908 0.385 . . . . 0.0 110.64 179.584 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 121' ' ' SER . . . . . 0.528 ' H ' ' C ' ' A' ' 119' ' ' LEU . 32.5 p -101.43 -35.3 9.24 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.739 -178.969 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . 0.809 ' O ' ' O ' ' A' ' 123' ' ' HIS . . . -123.29 -83.58 0.65 Allowed 'General case' 0 N--CA 1.464 0.258 0 C-N-CA 120.953 -0.299 . . . . 0.0 111.794 -179.027 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . 0.809 ' O ' ' O ' ' A' ' 122' ' ' ALA . 0.0 OUTLIER 36.36 167.27 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.516 0.674 . . . . 0.0 111.882 -179.885 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . 0.588 ' N ' ' CG ' ' A' ' 123' ' ' HIS . 2.7 p30 -162.77 -35.61 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.342 179.948 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 125' ' ' ASP . . . . . 0.516 ' C ' ' O ' ' A' ' 124' ' ' ASP . 34.6 t70 . . . . . 0 C--O 1.22 -0.465 0 CA-C-O 117.916 -1.04 . . . . 0.0 111.437 179.627 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 501' ' ' C2E . . . . . 0.931 ' O21' " H4'" ' A' ' 501' ' ' C2E . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 502' ' ' C2E . . . . . 0.672 ' C61' ' H ' ' A' ' 8' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 60.4 mtp . . . . . 0 N--CA 1.489 1.495 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 45.8 t -162.87 -37.83 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.671 -180.0 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 35.5 p-10 -95.22 62.32 2.49 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.682 -179.911 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.787 ' H ' ' NE2' ' A' ' 4' ' ' GLN . 0.0 OUTLIER -69.83 -35.35 74.7 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.764 0.792 . . . . 0.0 111.13 -178.079 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . 0.627 ' CG ' ' O ' ' A' ' 4' ' ' GLN . 0.4 OUTLIER 148.68 19.42 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 113.879 -1.51 . . . . 0.0 107.699 -178.263 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . 0.647 ' O ' ' CZ ' ' A' ' 8' ' ' ARG . 10.2 m-20 56.82 65.07 1.48 Allowed 'General case' 0 N--CA 1.454 -0.226 0 CA-C-N 115.246 -0.888 . . . . 0.0 108.71 -178.257 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -81.94 132.45 35.27 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.55 -0.75 . . . . 0.0 111.112 -178.754 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.656 ' NH2' ' N11' ' A' ' 501' ' ' C2E . 0.0 OUTLIER -122.73 -8.31 8.46 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-N 115.509 -0.768 . . . . 0.0 110.956 -179.797 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.593 ' O ' ' N ' ' A' ' 11' ' ' PHE . 1.3 ptt85 -102.56 105.49 16.01 Favored 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 120.856 -0.338 . . . . 0.0 110.131 179.752 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.745 HH21 ' P11' ' A' ' 501' ' ' C2E . 0.0 OUTLIER -1.66 -65.96 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 115.367 -0.833 . . . . 0.0 111.995 -179.591 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . 0.593 ' N ' ' O ' ' A' ' 9' ' ' ARG . 0.1 OUTLIER -141.85 170.03 16.49 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-O 120.847 0.356 . . . . 0.0 110.494 -179.581 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . 0.865 ' H ' ' CD2' ' A' ' 12' ' ' HIS . 0.0 OUTLIER -58.08 162.72 3.24 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.352 -179.99 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.588 HH21 ' CG ' ' A' ' 35' ' ' ASP . 0.9 OUTLIER -114.59 161.45 18.05 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 120.889 0.376 . . . . 0.0 110.691 -179.836 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.612 HG23 ' OD1' ' A' ' 105' ' ' ASN . 20.5 mm -72.87 93.64 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.152 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.53 179.73 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -95.25 119.72 34.24 Favored 'General case' 0 C--N 1.331 -0.225 0 C-N-CA 120.157 -0.617 . . . . 0.0 111.694 -179.744 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 6.2 p90 -150.36 159.03 44.75 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 114.876 -1.057 . . . . 0.0 108.201 177.206 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -94.99 146.47 24.23 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 119.935 -0.706 . . . . 0.0 111.176 -178.503 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -178.23 175.86 1.16 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.867 -0.606 . . . . 0.0 109.964 179.646 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -96.22 134.79 38.89 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.083 -179.615 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.58 ' O ' ' O ' ' A' ' 31' ' ' VAL . 11.4 p -134.87 154.07 51.8 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.035 0.445 . . . . 0.0 110.428 178.861 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -133.94 142.61 47.77 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 108.904 -0.776 . . . . 0.0 108.904 179.419 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 53.3 mt -122.61 136.8 58.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-O 121.429 0.633 . . . . 0.0 111.108 -179.541 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.676 ' H ' HD12 ' A' ' 23' ' ' LEU . 0.0 OUTLIER -121.94 123.81 42.56 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.133 -0.94 . . . . 0.0 110.949 -179.158 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.557 ' OE1' ' CE2' ' A' ' 57' ' ' PHE . 5.9 tt0 -126.77 131.2 51.35 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 107.876 -1.157 . . . . 0.0 107.876 178.339 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 47.47 -120.5 5.75 Favored Glycine 0 CA--C 1.528 0.876 0 N-CA-C 110.451 -1.06 . . . . 0.0 110.451 -179.234 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -105.08 13.21 31.18 Favored 'General case' 0 N--CA 1.463 0.225 0 N-CA-C 111.637 0.236 . . . . 0.0 111.637 -179.503 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.618 ' HB3' ' CZ2' ' A' ' 29' ' ' TRP . 2.6 mpt_? -111.95 133.1 54.35 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 -179.023 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.473 ' HG3' ' N ' ' A' ' 29' ' ' TRP . 0.0 OUTLIER -125.18 145.04 50.15 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.02 -0.536 . . . . 0.0 109.799 179.261 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.618 ' CZ2' ' HB3' ' A' ' 27' ' ' ARG . 6.3 m-90 -145.52 156.53 43.77 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.364 -0.835 . . . . 0.0 110.705 -179.03 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 16.4 mt-10 -100.6 137.94 38.34 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 178.773 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.58 ' O ' ' O ' ' A' ' 20' ' ' SER . 26.3 m -147.74 159.05 8.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-O 121.199 0.523 . . . . 0.0 111.287 -179.548 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.872 ' H ' HD23 ' A' ' 32' ' ' LEU . 1.4 pt? -98.38 130.04 45.03 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 108.79 -0.818 . . . . 0.0 108.79 178.652 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -93.31 126.58 38.5 Favored 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 120.179 -0.608 . . . . 0.0 109.661 -179.762 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 76.1 m-70 -91.82 -26.14 18.66 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.366 -0.834 . . . . 0.0 111.959 -178.31 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.588 ' CG ' HH21 ' A' ' 13' ' ' ARG . 2.9 p30 -174.01 161.03 3.6 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 119.38 -0.928 . . . . 0.0 111.354 177.443 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.526 HG22 ' H ' ' A' ' 37' ' ' SER . 3.4 p -144.22 168.74 10.39 Favored 'Isoleucine or valine' 0 C--O 1.232 0.135 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.987 -179.128 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.526 ' H ' HG22 ' A' ' 36' ' ' VAL . 6.3 t -142.2 168.42 19.79 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 107.621 -1.251 . . . . 0.0 107.621 178.659 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.586 ' CD1' ' ND1' ' A' ' 39' ' ' HIS . 0.3 OUTLIER -63.81 1.02 0.69 Allowed 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 119.216 -0.994 . . . . 0.0 110.549 -179.625 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . 0.586 ' ND1' ' CD1' ' A' ' 38' ' ' LEU . 21.9 p-80 -166.53 44.51 0.06 Allowed 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 120.718 -0.393 . . . . 0.0 111.226 179.35 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -176.97 152.04 11.81 Favored Glycine 0 CA--C 1.526 0.719 0 N-CA-C 111.012 -0.835 . . . . 0.0 111.012 179.68 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -148.01 149.01 15.69 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.259 0 CA-C-O 121.545 0.688 . . . . 0.0 111.581 -179.337 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -121.34 135.04 55.14 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 114.873 -1.058 . . . . 0.0 108.191 178.488 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 20.2 m -140.61 174.71 7.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 C-N-CA 120.261 -0.576 . . . . 0.0 111.826 -178.887 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -97.41 143.99 17.05 Favored Glycine 0 CA--C 1.526 0.746 0 N-CA-C 109.497 -1.441 . . . . 0.0 109.497 178.305 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . 0.54 ' CD ' ' O ' ' A' ' 45' ' ' GLN . 0.0 OUTLIER -86.58 115.91 64.02 Favored Pre-proline 0 CA--C 1.533 0.327 0 CA-C-N 117.74 0.77 . . . . 0.0 111.729 -178.569 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 89.7 Cg_endo -84.62 161.14 12.49 Favored 'Trans proline' 0 C--N 1.308 -1.557 0 C-N-CA 121.42 1.414 . . . . 0.0 111.262 179.003 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.2 pt20 -65.3 -38.34 89.9 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 112.437 0.532 . . . . 0.0 112.437 -178.745 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.594 ' O ' ' NE1' ' A' ' 29' ' ' TRP . 1.3 m-20 -74.66 8.36 2.42 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 111.87 0.322 . . . . 0.0 111.87 -178.647 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' TRP . . . . . 0.463 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 65.4 t-105 -58.57 67.98 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 112.03 0.382 . . . . 0.0 112.03 -179.534 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.561 ' N ' ' O ' ' A' ' 48' ' ' ASP . 0.2 OUTLIER -93.22 78.73 4.51 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 120.086 -0.646 . . . . 0.0 109.585 178.484 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -146.15 143.75 11.98 Favored Glycine 0 CA--C 1.526 0.733 0 N-CA-C 111.242 -0.743 . . . . 0.0 111.242 -179.492 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -77.46 122.22 85.62 Favored Pre-proline 0 CA--C 1.536 0.43 0 CA-C-N 115.77 -0.215 . . . . 0.0 110.939 -179.813 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 12.7 Cg_endo -58.35 -22.69 59.43 Favored 'Trans proline' 0 N--CA 1.496 1.654 0 C-N-CA 122.698 2.266 . . . . 0.0 112.362 -179.441 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 22.2 mp0 -78.77 -23.86 45.04 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.337 -0.545 . . . . 0.0 111.69 -179.183 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.522 ' O ' ' CE1' ' A' ' 57' ' ' PHE . 42.2 mtt180 -91.1 155.41 44.77 Favored Pre-proline 0 N--CA 1.463 0.201 0 C-N-CA 120.471 -0.492 . . . . 0.0 109.921 179.772 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 44.6 Cg_endo -67.81 160.59 47.63 Favored 'Trans proline' 0 C--N 1.308 -1.601 0 C-N-CA 122.762 2.308 . . . . 0.0 113.243 -178.846 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.557 ' CE2' ' OE1' ' A' ' 24' ' ' GLN . 51.5 m-85 -130.64 156.54 44.72 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 114.935 -1.029 . . . . 0.0 108.953 179.433 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.532 ' O ' HD12 ' A' ' 23' ' ' LEU . 19.5 mt-10 -121.95 135.07 54.84 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 108.852 -0.796 . . . . 0.0 108.852 178.466 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . 0.636 ' HB2' HD13 ' A' ' 73' ' ' ILE . . . -116.49 136.92 52.58 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.088 0.47 . . . . 0.0 111.56 -178.431 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 7.0 mtt180 -123.65 127.77 48.7 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 108.538 -0.912 . . . . 0.0 108.538 177.848 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 6.6 mt -107.07 144.82 33.19 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.593 -0.443 . . . . 0.0 110.54 -179.184 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' TYR . . . . . 0.517 ' CD1' ' N ' ' A' ' 62' ' ' TYR . 6.5 m-85 -128.58 110.3 12.13 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.719 179.899 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.506 HD21 HD11 ' A' ' 101' ' ' LEU . 9.1 mp -105.57 -91.15 0.4 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.257 179.294 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -68.84 178.8 24.35 Favored Glycine 0 CA--C 1.521 0.461 0 N-CA-C 109.484 -1.446 . . . . 0.0 109.484 178.689 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.627 HD12 ' C ' ' A' ' 65' ' ' LEU . 0.9 OUTLIER -74.0 -31.4 62.94 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.015 -0.674 . . . . 0.0 110.122 -179.893 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.416 ' OD1' ' O ' ' A' ' 66' ' ' ASP . 37.5 t0 -103.39 9.23 37.94 Favored 'General case' 0 C--N 1.333 -0.141 0 C-N-CA 122.663 0.385 . . . . 0.0 111.272 -179.802 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.549 ' O ' HG12 ' A' ' 67' ' ' VAL . 16.4 t -104.08 95.26 3.68 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.3 0 CA-C-O 121.4 0.619 . . . . 0.0 111.761 -178.876 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.491 HD12 ' N ' ' A' ' 69' ' ' ILE . 3.7 tp -111.51 117.19 32.32 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 107.859 -1.163 . . . . 0.0 107.859 178.128 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.609 HG23 ' OG ' ' A' ' 94' ' ' SER . 5.1 mt -114.37 144.12 22.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-O 120.959 0.409 . . . . 0.0 111.086 -178.812 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.416 HH11 ' HD3' ' A' ' 70' ' ' ARG . 4.1 ptt180 -128.28 130.6 48.1 Favored 'General case' 0 C--O 1.238 0.48 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.828 179.189 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . 0.784 ' SD ' HD12 ' A' ' 90' ' ' ILE . 1.2 mtm -140.01 147.47 40.44 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.66 -0.7 . . . . 0.0 109.622 179.583 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -99.68 132.59 44.92 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 107.627 -1.249 . . . . 0.0 107.627 178.529 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.636 HD13 ' HB2' ' A' ' 59' ' ' ALA . 13.1 pt -142.0 157.21 20.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 C-N-CA 119.109 -1.036 . . . . 0.0 113.132 -177.467 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 2.7 p -123.65 155.48 37.67 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 114.983 -1.008 . . . . 0.0 110.021 179.219 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.49 HD12 ' CE1' ' A' ' 85' ' ' PHE . 5.6 tp -66.01 119.45 11.38 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.0 0.429 . . . . 0.0 110.802 -179.699 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -97.22 -41.05 8.48 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.342 177.796 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' TRP . . . . . 0.576 ' NE1' ' HA3' ' A' ' 84' ' ' GLY . 67.8 p-90 -171.0 170.73 6.13 Favored 'General case' 0 N--CA 1.466 0.375 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.051 -179.782 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -151.28 124.11 8.58 Favored 'General case' 0 N--CA 1.465 0.289 0 N-CA-C 110.197 -0.298 . . . . 0.0 110.197 178.89 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 1.2 ttp180 -152.37 134.07 14.69 Favored 'General case' 0 CA--C 1.533 0.326 0 N-CA-C 113.148 0.796 . . . . 0.0 113.148 179.795 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 57.11 47.41 17.34 Favored 'General case' 0 N--CA 1.463 0.225 0 N-CA-C 114.124 1.157 . . . . 0.0 114.124 176.434 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 84.55 -28.64 4.28 Favored Glycine 0 CA--C 1.523 0.571 0 C-N-CA 120.382 -0.913 . . . . 0.0 113.157 177.184 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 6.4 mt -89.5 157.81 17.94 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 117.574 0.687 . . . . 0.0 110.57 -178.927 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.442 HD11 ' CB ' ' A' ' 45' ' ' GLN . 38.0 mt -128.74 135.25 48.94 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.833 -0.622 . . . . 0.0 111.016 -179.397 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . 0.576 ' HA3' ' NE1' ' A' ' 77' ' ' TRP . . . -95.04 152.1 20.32 Favored Glycine 0 N--CA 1.45 -0.392 0 N-CA-C 109.471 -1.451 . . . . 0.0 109.471 178.544 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . 0.49 ' CE1' HD12 ' A' ' 75' ' ' LEU . 22.5 m-85 -145.74 132.44 19.96 Favored 'General case' 0 C--N 1.32 -0.716 0 C-N-CA 120.641 -0.424 . . . . 0.0 110.675 -179.247 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.412 ' O ' ' CG ' ' A' ' 86' ' ' GLU . 7.4 pt-20 -104.02 127.45 51.58 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 179.67 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 1.8 t -74.8 125.69 29.33 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.16 0.505 . . . . 0.0 111.824 -178.685 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -100.79 -29.22 12.38 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.162 179.327 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . 0.622 ' ND1' ' N ' ' A' ' 90' ' ' ILE . 0.0 OUTLIER -160.39 141.18 11.9 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.958 0.409 . . . . 0.0 110.143 179.512 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.784 HD12 ' SD ' ' A' ' 71' ' ' MET . 6.5 tt -145.65 140.71 22.02 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.096 -179.23 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -56.33 139.64 47.77 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 115.21 -0.905 . . . . 0.0 112.373 -178.079 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 5.5 tp -54.29 -42.29 69.88 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 115.145 -0.934 . . . . 0.0 110.431 -180.0 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 25.6 t0 -69.06 -37.76 78.69 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 179.277 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . 0.609 ' OG ' HG23 ' A' ' 69' ' ' ILE . 1.2 t -68.54 -35.19 77.1 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.639 179.183 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . 0.445 ' CG1' HG23 ' A' ' 90' ' ' ILE . 20.3 mt -58.64 -37.27 64.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.771 179.233 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -70.33 -40.71 73.97 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 120.278 -0.569 . . . . 0.0 110.669 -178.999 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 61.6 m-70 -61.81 -36.08 80.07 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 119.499 -0.88 . . . . 0.0 109.149 179.454 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -67.62 -34.21 76.52 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.16 -0.473 . . . . 0.0 109.775 178.012 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -66.31 -37.92 86.52 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 109.5 -0.556 . . . . 0.0 109.5 178.846 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 71.7 mtt180 -56.43 -37.92 70.89 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.277 178.389 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.506 HD11 HD21 ' A' ' 63' ' ' LEU . 4.4 mt -69.99 -47.27 62.9 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.237 -179.547 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 51.6 t -60.67 -41.2 87.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.729 -179.831 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -63.44 -48.48 77.58 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.969 -179.756 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 39.1 mt -65.48 -41.79 92.92 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.389 -0.368 . . . . 0.0 110.814 -179.578 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . 0.612 ' OD1' HG23 ' A' ' 14' ' ' ILE . 0.5 OUTLIER -60.83 -31.77 71.18 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 120.703 -0.399 . . . . 0.0 110.184 -179.903 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -55.96 -18.78 10.07 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.29 -0.413 . . . . 0.0 109.994 179.72 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . 0.47 ' O ' ' O ' ' A' ' 108' ' ' ASP . . . -113.37 -41.58 0.95 Allowed Glycine 0 CA--C 1.526 0.745 0 N-CA-C 111.056 -0.817 . . . . 0.0 111.056 179.971 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . 0.47 ' O ' ' O ' ' A' ' 107' ' ' GLY . 2.2 m-20 -58.63 -142.36 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.821 0.343 . . . . 0.0 110.575 -179.893 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . 0.487 ' O ' ' CD1' ' A' ' 112' ' ' LEU . 48.8 tt0 56.01 105.08 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.355 -179.932 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -87.98 43.32 1.11 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.861 -179.751 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 4.5 mp -141.66 30.79 1.67 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.512 179.777 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.487 ' CD1' ' O ' ' A' ' 109' ' ' GLU . 11.1 mp -48.34 101.2 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.87 0.367 . . . . 0.0 110.369 -179.942 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 52.0 mm-40 -140.47 -45.61 0.41 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.383 -179.975 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . 0.405 ' HD2' ' N ' ' A' ' 114' ' ' ARG . 1.0 OUTLIER -42.27 143.17 0.65 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.028 179.896 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . 0.615 ' H ' HD12 ' A' ' 118' ' ' LEU . 0.4 OUTLIER -78.02 148.11 34.52 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.245 0.545 . . . . 0.0 111.182 -179.393 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.774 HD22 ' N ' ' A' ' 116' ' ' LEU . 2.6 mm? -67.04 -38.89 86.69 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.241 -0.89 . . . . 0.0 111.035 179.605 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 117' ' ' ALA . . . . . 0.63 ' O ' HG23 ' A' ' 120' ' ' VAL . . . -68.34 -22.12 64.71 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.119 -0.491 . . . . 0.0 112.004 -179.206 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.615 HD12 ' H ' ' A' ' 115' ' ' GLU . 37.0 mt -53.06 -31.58 42.39 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 120.641 -0.423 . . . . 0.0 110.883 -178.362 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 15.0 mt -58.14 -27.7 64.01 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 178.832 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . 0.63 HG23 ' O ' ' A' ' 117' ' ' ALA . 43.7 t -58.67 -45.83 90.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 115.326 -0.852 . . . . 0.0 111.909 179.732 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 3.0 t -72.94 -12.11 60.83 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 112.991 0.737 . . . . 0.0 112.991 -177.817 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -104.74 -4.74 22.0 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 120.179 -0.609 . . . . 0.0 111.958 -179.016 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . 0.651 ' ND1' ' O ' ' A' ' 123' ' ' HIS . 5.8 p80 -173.37 28.6 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.534 -0.466 . . . . 0.0 111.051 179.651 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . 0.502 ' C ' ' O ' ' A' ' 123' ' ' HIS . 35.2 t0 -24.91 82.77 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.348 0 N-CA-C 111.967 0.358 . . . . 0.0 111.967 -178.878 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 125' ' ' ASP . . . . . 0.623 ' N ' ' O ' ' A' ' 123' ' ' HIS . 0.9 OUTLIER . . . . . 0 C--O 1.22 -0.483 0 CA-C-O 118.04 -0.981 . . . . 0.0 110.389 179.675 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 501' ' ' C2E . . . . . 0.745 ' P11' HH21 ' A' ' 10' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 502' ' ' C2E . . . . . 0.546 ' C21' ' NH1' ' A' ' 9' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.524 ' C ' HE21 ' A' ' 4' ' ' GLN . 66.6 mmm . . . . . 0 N--CA 1.491 1.575 0 N-CA-C 109.449 -0.575 . . . . 0.0 109.449 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.555 ' O ' ' NE2' ' A' ' 4' ' ' GLN . 1.9 t 75.66 -132.65 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.81 -179.972 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -100.75 63.22 1.04 Allowed 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 121.179 0.514 . . . . 0.0 109.935 177.766 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.819 ' CD ' ' H ' ' A' ' 4' ' ' GLN . 0.0 OUTLIER -81.25 11.91 3.94 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.274 -0.875 . . . . 0.0 111.916 -179.189 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . 0.522 ' HB2' ' O ' ' A' ' 4' ' ' GLN . 10.2 m170 79.01 15.17 1.07 Allowed 'General case' 0 C--N 1.33 -0.279 0 O-C-N 123.285 0.366 . . . . 0.0 111.771 179.345 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . 0.489 ' O ' ' CZ ' ' A' ' 8' ' ' ARG . 75.4 m-20 -49.57 138.77 13.37 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 108.852 -0.796 . . . . 0.0 108.852 179.388 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.455 ' C ' ' CD ' ' A' ' 7' ' ' GLU . 0.4 OUTLIER -79.53 133.08 36.47 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 120.122 -0.631 . . . . 0.0 111.157 -178.841 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.648 HH21 ' C21' ' A' ' 501' ' ' C2E . 0.0 OUTLIER -123.46 -6.3 8.16 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-N 115.747 -0.66 . . . . 0.0 111.079 -179.502 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.536 ' O ' ' C ' ' A' ' 10' ' ' ARG . 1.0 OUTLIER -110.81 94.87 5.22 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 120.944 0.402 . . . . 0.0 110.068 179.532 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.536 ' C ' ' O ' ' A' ' 9' ' ' ARG . 0.0 OUTLIER 18.27 -84.72 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.475 0 CA-C-N 115.399 -0.819 . . . . 0.0 111.346 -179.649 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . 0.534 ' N ' ' O ' ' A' ' 9' ' ' ARG . 0.1 OUTLIER -138.49 160.76 38.75 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 110.124 -0.324 . . . . 0.0 110.124 179.914 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 5.9 p80 -39.04 153.68 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.955 0.407 . . . . 0.0 110.829 -179.734 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.569 ' NH1' ' N1 ' ' A' ' 501' ' ' C2E . 0.4 OUTLIER -108.65 149.04 29.5 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.224 -179.911 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.635 ' N ' HD12 ' A' ' 14' ' ' ILE . 1.8 mp -54.56 96.27 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-O 121.008 0.432 . . . . 0.0 110.21 179.862 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -94.91 120.57 35.35 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.954 -179.834 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.453 ' HE2' HD23 ' A' ' 63' ' ' LEU . 0.4 OUTLIER -149.48 153.43 37.23 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.058 -0.974 . . . . 0.0 108.453 178.399 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -95.36 149.64 21.15 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 120.299 -0.56 . . . . 0.0 111.149 -178.503 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . 178.39 178.78 0.38 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.802 -0.635 . . . . 0.0 109.99 179.626 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -96.36 134.71 39.16 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.892 -179.941 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.67 ' O ' ' O ' ' A' ' 31' ' ' VAL . 5.8 p -136.5 159.03 43.02 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.34 179.169 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.414 ' C ' ' OE1' ' A' ' 21' ' ' GLU . 0.5 OUTLIER -146.71 146.23 30.26 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 178.674 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.516 ' CD1' HD11 ' A' ' 73' ' ' ILE . 1.1 mm -120.37 136.47 57.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-O 121.208 0.528 . . . . 0.0 111.645 -178.091 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.51 ' H ' HD12 ' A' ' 23' ' ' LEU . 0.2 OUTLIER -121.25 123.11 41.42 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.836 -179.902 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.575 ' OE1' ' CE2' ' A' ' 57' ' ' PHE . 22.9 tt0 -130.39 102.27 6.11 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.303 -0.862 . . . . 0.0 109.775 179.028 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 79.89 -126.51 7.48 Favored Glycine 0 CA--C 1.525 0.657 0 N-CA-C 110.053 -1.219 . . . . 0.0 110.053 -179.022 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.4 pm0 -100.61 10.89 40.58 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.816 0.341 . . . . 0.0 110.213 179.444 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.576 ' HB3' ' CZ2' ' A' ' 29' ' ' TRP . 6.5 mtt180 -112.56 133.82 54.4 Favored 'General case' 0 CA--C 1.52 -0.175 0 N-CA-C 112.228 0.455 . . . . 0.0 112.228 -178.758 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 74.7 ttt180 -128.02 149.2 50.47 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.182 179.417 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.576 ' CZ2' ' HB3' ' A' ' 27' ' ' ARG . 6.7 m-90 -147.15 155.54 42.22 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.246 -179.079 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.559 ' CD ' ' H ' ' A' ' 30' ' ' GLU . 3.0 mp0 -101.5 137.89 39.23 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 179.566 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.67 ' O ' ' O ' ' A' ' 20' ' ' SER . 19.2 m -146.71 157.45 10.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 121.261 0.553 . . . . 0.0 111.16 -179.768 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 1.014 ' H ' HD23 ' A' ' 32' ' ' LEU . 1.6 pt? -96.17 130.27 43.27 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 108.614 -0.884 . . . . 0.0 108.614 178.363 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.518 HD13 HD21 ' A' ' 61' ' ' LEU . 1.7 tt -91.47 125.97 36.39 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.241 0.543 . . . . 0.0 110.088 -179.329 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 75.2 m-70 -91.85 -28.57 17.24 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.225 -0.898 . . . . 0.0 111.86 -178.5 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 2.0 p30 -173.39 162.99 4.42 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 119.412 -0.915 . . . . 0.0 111.461 177.632 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.521 HG22 ' N ' ' A' ' 37' ' ' SER . 7.3 p -145.48 168.01 8.65 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.084 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.777 -179.193 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.521 ' N ' HG22 ' A' ' 36' ' ' VAL . 6.5 t -141.78 170.39 15.81 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 107.907 -1.145 . . . . 0.0 107.907 179.042 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -66.11 -0.62 2.55 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 119.488 -0.885 . . . . 0.0 110.832 -178.909 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . 0.43 ' NE2' ' O ' ' A' ' 87' ' ' CYS . 3.0 t60 -163.09 40.03 0.1 Allowed 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 120.682 -0.407 . . . . 0.0 111.128 179.713 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -175.05 155.38 20.46 Favored Glycine 0 CA--C 1.526 0.749 0 N-CA-C 111.144 -0.782 . . . . 0.0 111.144 179.849 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -148.2 148.94 15.69 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.204 0 CA-C-O 121.359 0.599 . . . . 0.0 111.375 -179.17 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -122.09 137.33 54.85 Favored 'General case' 0 N--CA 1.462 0.134 0 CA-C-N 115.133 -0.94 . . . . 0.0 108.642 178.932 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 19.8 m -141.39 174.88 6.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 C-N-CA 120.27 -0.572 . . . . 0.0 111.788 -179.181 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -96.58 145.25 17.75 Favored Glycine 0 CA--C 1.529 0.968 0 N-CA-C 109.572 -1.411 . . . . 0.0 109.572 178.257 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.4 tm0? -87.34 114.18 57.45 Favored Pre-proline 0 N--CA 1.465 0.283 0 CA-C-N 117.877 0.839 . . . . 0.0 111.947 -178.518 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 94.3 Cg_endo -85.26 161.42 11.34 Favored 'Trans proline' 0 C--N 1.309 -1.524 0 C-N-CA 121.714 1.609 . . . . 0.0 111.723 179.082 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.403 ' HG2' ' H ' ' A' ' 48' ' ' ASP . 0.5 OUTLIER -65.57 -40.32 92.63 Favored 'General case' 0 CA--C 1.532 0.277 0 N-CA-C 112.439 0.533 . . . . 0.0 112.439 -179.081 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.531 ' O ' ' NE1' ' A' ' 29' ' ' TRP . 37.7 m-20 -72.85 8.06 1.7 Allowed 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 111.839 0.311 . . . . 0.0 111.839 -178.565 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' TRP . . . . . 0.448 ' O ' ' CD1' ' A' ' 49' ' ' TRP . 60.3 t-105 -60.67 68.28 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.712 -179.58 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.531 ' N ' ' O ' ' A' ' 48' ' ' ASP . 0.6 OUTLIER -93.22 78.78 4.51 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 120.207 -0.597 . . . . 0.0 109.572 178.643 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -141.45 159.54 26.77 Favored Glycine 0 CA--C 1.524 0.638 0 N-CA-C 111.31 -0.716 . . . . 0.0 111.31 -179.381 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 22.4 t0 -94.47 110.34 48.29 Favored Pre-proline 0 CA--C 1.533 0.291 0 CA-C-N 115.823 -0.189 . . . . 0.0 110.546 -179.98 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_exo -46.39 -22.72 1.76 Allowed 'Trans proline' 0 N--CA 1.495 1.579 0 C-N-CA 122.647 2.232 . . . . 0.0 112.393 -179.919 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.647 HE21 ' NH1' ' A' ' 55' ' ' ARG . 16.0 mt-30 -79.61 -24.05 42.24 Favored 'General case' 0 C--N 1.326 -0.444 0 C-N-CA 120.648 -0.421 . . . . 0.0 111.815 -178.751 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.647 ' NH1' HE21 ' A' ' 54' ' ' GLN . 0.0 OUTLIER -93.55 150.72 39.32 Favored Pre-proline 0 C--N 1.329 -0.283 0 C-N-CA 120.531 -0.468 . . . . 0.0 110.166 179.941 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . 0.453 ' O ' ' OE1' ' A' ' 24' ' ' GLN . 35.9 Cg_endo -64.43 160.68 38.18 Favored 'Trans proline' 0 N--CA 1.495 1.582 0 C-N-CA 122.841 2.361 . . . . 0.0 113.421 -178.655 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.578 ' CE1' ' O ' ' A' ' 55' ' ' ARG . 50.4 m-85 -131.22 157.02 44.34 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 114.845 -1.07 . . . . 0.0 109.134 179.594 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.411 ' O ' HD12 ' A' ' 23' ' ' LEU . 83.5 mt-10 -122.72 137.18 54.99 Favored 'General case' 0 N--CA 1.468 0.444 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 178.535 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -116.29 135.41 53.91 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.026 0.441 . . . . 0.0 111.894 -178.44 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.609 ' C ' HD12 ' A' ' 61' ' ' LEU . 39.2 mmt-85 -122.05 127.22 49.96 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 107.757 -1.201 . . . . 0.0 107.757 177.141 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.609 HD12 ' C ' ' A' ' 60' ' ' ARG . 9.0 mp -112.07 151.23 29.63 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.945 0.402 . . . . 0.0 111.21 -178.447 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 9.4 m-85 -131.32 108.45 9.66 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.447 179.471 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.543 ' C ' HD13 ' A' ' 63' ' ' LEU . 2.1 tm? -103.93 -84.58 0.47 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.65 -0.704 . . . . 0.0 109.232 179.521 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.434 ' H ' ' HB ' ' A' ' 67' ' ' VAL . . . -76.09 175.96 51.94 Favored Glycine 0 CA--C 1.521 0.438 0 N-CA-C 108.76 -1.736 . . . . 0.0 108.76 178.065 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 9.8 mt -72.5 -32.64 66.33 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 119.537 -0.865 . . . . 0.0 110.103 -179.557 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -102.84 9.53 38.88 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 122.912 0.485 . . . . 0.0 111.034 -179.842 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.55 ' O ' HG12 ' A' ' 67' ' ' VAL . 9.1 t -106.71 96.61 4.76 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.343 0 CA-C-O 121.4 0.619 . . . . 0.0 111.738 -179.108 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 6.4 tp -112.24 117.35 32.29 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 108.032 -1.099 . . . . 0.0 108.032 178.168 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.405 HG23 ' HB2' ' A' ' 94' ' ' SER . 5.7 mt -112.55 143.43 22.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.86 0.362 . . . . 0.0 111.222 -178.648 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.412 HH11 ' HD2' ' A' ' 70' ' ' ARG . 11.1 mtm180 -128.05 130.65 48.6 Favored 'General case' 0 C--O 1.238 0.463 0 CA-C-O 121.224 0.535 . . . . 0.0 111.346 179.715 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 2.4 mtp -140.28 148.56 41.62 Favored 'General case' 0 C--N 1.334 -0.1 0 CA-C-N 115.535 -0.757 . . . . 0.0 109.881 179.666 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 27.8 tt0 -106.51 125.54 51.12 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 107.793 -1.188 . . . . 0.0 107.793 177.997 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.592 HD12 ' CB ' ' A' ' 85' ' ' PHE . 9.9 pt -133.09 160.26 42.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 N-CA-C 113.279 0.844 . . . . 0.0 113.279 -176.945 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 37.6 m -121.67 151.87 39.98 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 114.564 -1.198 . . . . 0.0 109.357 178.763 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.588 HD12 ' CE1' ' A' ' 85' ' ' PHE . 6.3 tp -67.09 123.02 19.08 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.297 0.57 . . . . 0.0 110.5 -179.679 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -97.81 -41.84 7.86 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 115.146 -0.934 . . . . 0.0 110.667 178.241 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' TRP . . . . . 0.587 ' NE1' ' HA3' ' A' ' 84' ' ' GLY . 67.5 p-90 -170.51 168.64 7.66 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.356 -179.349 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -147.46 123.87 10.98 Favored 'General case' 0 N--CA 1.465 0.299 0 N-CA-C 109.95 -0.389 . . . . 0.0 109.95 178.67 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 38.6 ttt180 -152.3 133.76 14.52 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 119.944 -0.703 . . . . 0.0 112.826 179.931 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . 0.452 ' O ' ' OD1' ' A' ' 80' ' ' ASP . 33.4 t0 56.98 47.22 18.04 Favored 'General case' 0 N--CA 1.463 0.181 0 N-CA-C 113.951 1.093 . . . . 0.0 113.951 176.585 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 82.29 -27.42 3.62 Favored Glycine 0 CA--C 1.524 0.597 0 C-N-CA 120.397 -0.906 . . . . 0.0 113.162 177.28 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 6.9 mt -89.5 156.73 18.45 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 117.672 0.736 . . . . 0.0 110.447 -179.084 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 36.2 mt -128.88 135.51 49.17 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.202 -179.282 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . 0.587 ' HA3' ' NE1' ' A' ' 77' ' ' TRP . . . -96.18 153.19 20.46 Favored Glycine 0 N--CA 1.45 -0.424 0 N-CA-C 109.576 -1.409 . . . . 0.0 109.576 178.692 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . 0.592 ' CB ' HD12 ' A' ' 73' ' ' ILE . 26.6 m-85 -145.62 132.36 20.0 Favored 'General case' 0 C--N 1.317 -0.808 0 C-N-CA 120.792 -0.363 . . . . 0.0 110.733 -179.298 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.489 ' CG ' HE21 ' A' ' 88' ' ' GLN . 6.5 pt-20 -103.66 126.21 50.66 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 108.632 -0.877 . . . . 0.0 108.632 179.059 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . 0.455 ' HA ' HG22 ' A' ' 73' ' ' ILE . 7.8 t -64.55 119.6 10.77 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 112.278 0.473 . . . . 0.0 112.278 -177.984 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . 0.489 HE21 ' CG ' ' A' ' 86' ' ' GLU . 46.8 mm-40 -89.32 -37.82 14.62 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.693 179.323 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . 0.412 ' ND1' ' N ' ' A' ' 90' ' ' ILE . 0.0 OUTLIER -164.66 144.85 7.55 Favored 'General case' 0 C--O 1.222 -0.375 0 CA-C-N 115.716 -0.674 . . . . 0.0 109.82 179.928 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.535 HG23 ' CG1' ' A' ' 95' ' ' ILE . 7.2 tt -143.81 140.45 25.47 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-O 121.407 0.623 . . . . 0.0 110.063 -179.814 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . 0.503 ' CB ' ' OG ' ' A' ' 94' ' ' SER . 0.2 OUTLIER -57.38 141.08 48.46 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 115.001 -1.0 . . . . 0.0 112.084 -178.001 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.48 ' HA ' HD12 ' A' ' 95' ' ' ILE . 3.2 tp -54.36 -42.06 69.85 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.254 -0.885 . . . . 0.0 110.403 -179.84 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -65.1 -42.94 93.55 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 179.295 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . 0.503 ' OG ' ' CB ' ' A' ' 91' ' ' ASP . 1.1 p -66.86 -35.45 80.07 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.718 179.184 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . 0.535 ' CG1' HG23 ' A' ' 90' ' ' ILE . 31.3 mt -58.73 -38.33 71.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.248 179.769 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -69.79 -37.7 76.41 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 119.876 -0.73 . . . . 0.0 111.422 -177.945 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 60.3 m-70 -61.89 -35.67 79.03 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 119.567 -0.853 . . . . 0.0 109.578 179.767 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.653 ' O ' HG23 ' A' ' 102' ' ' VAL . 6.9 mp -62.11 -35.63 79.29 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 178.08 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.453 HH11 ' HD2' ' A' ' 99' ' ' ARG . 1.7 mmm180 -66.31 -39.75 89.49 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 119.847 -0.741 . . . . 0.0 109.008 178.177 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -61.8 -47.65 84.16 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.968 179.502 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.442 ' O ' ' OD1' ' A' ' 105' ' ' ASN . 4.1 mm? -61.91 -40.7 96.35 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.136 0.494 . . . . 0.0 110.124 -179.913 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . 0.653 HG23 ' O ' ' A' ' 98' ' ' LEU . 96.3 t -68.06 -47.41 78.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 115.618 -0.719 . . . . 0.0 111.594 -179.341 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 18.2 mm-40 -64.25 -43.06 96.06 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.436 -179.125 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 69.2 mt -66.16 -27.53 68.09 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.219 -178.981 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . 0.442 ' OD1' ' O ' ' A' ' 101' ' ' LEU . 13.1 m120 -59.46 -31.42 69.3 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 120.779 -0.368 . . . . 0.0 110.771 -179.766 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.499 HD22 ' N ' ' A' ' 106' ' ' LEU . 3.6 mm? -60.09 -18.7 48.89 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.492 179.888 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -70.12 1.11 19.64 Favored Glycine 0 CA--C 1.524 0.647 0 N-CA-C 110.429 -1.068 . . . . 0.0 110.429 179.899 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . 0.497 ' C ' ' H ' ' A' ' 110' ' ' GLU . 41.4 p30 -82.34 11.89 5.01 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.816 0.341 . . . . 0.0 110.582 -179.93 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 25.3 mm-40 -73.94 23.31 0.08 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.546 179.981 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . 0.497 ' H ' ' C ' ' A' ' 108' ' ' ASP . 66.4 mt-10 -67.14 -98.88 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.437 179.788 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 78.0 mt -140.86 78.39 1.65 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.303 179.903 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 21.2 tp -172.43 -85.55 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.721 -179.791 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 16.9 tt0 -50.79 152.01 2.24 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.912 -179.506 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 28.1 ptt180 -166.78 -176.55 3.51 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.445 179.729 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -79.32 -30.56 42.87 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.748 -179.842 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.495 ' O ' HG23 ' A' ' 120' ' ' VAL . 9.5 mp -54.51 -47.7 72.77 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.564 179.971 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -67.56 -51.94 44.71 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.477 179.676 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 95.0 mt -57.88 -49.35 77.01 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 112.802 0.668 . . . . 0.0 112.802 -177.53 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . 0.467 ' O ' ' N ' ' A' ' 123' ' ' HIS . 1.1 mt -72.9 -49.25 30.86 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 119.9 -0.72 . . . . 0.0 111.66 -178.709 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . 0.548 ' C ' ' H ' ' A' ' 122' ' ' ALA . 99.1 t -57.92 -15.8 5.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 C-N-CA 120.204 -0.598 . . . . 0.0 111.047 -177.467 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 121' ' ' SER . . . . . 0.702 ' O ' ' HB2' ' A' ' 122' ' ' ALA . 0.3 OUTLIER -70.79 21.27 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.42 179.051 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . 0.764 ' O ' ' O ' ' A' ' 123' ' ' HIS . . . 154.25 4.64 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.351 179.301 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . 0.764 ' O ' ' O ' ' A' ' 122' ' ' ALA . 0.5 OUTLIER -41.38 -131.72 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 121.148 0.499 . . . . 0.0 111.891 -179.19 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . 0.581 ' N ' ' CG ' ' A' ' 123' ' ' HIS . 42.0 t0 61.89 -26.78 0.05 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.881 -179.439 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 125' ' ' ASP . . . . . 0.666 ' H ' ' C ' ' A' ' 123' ' ' HIS . 15.5 m-20 . . . . . 0 C--O 1.22 -0.465 0 CA-C-O 118.019 -0.991 . . . . 0.0 110.87 -179.811 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 501' ' ' C2E . . . . . 0.648 ' C21' HH21 ' A' ' 8' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 502' ' ' C2E . . . . . 0.515 ' C4 ' ' CE2' ' A' ' 77' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 stop_ save_