data_1bf0_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 1bf0 _Structure_validation_residue.Date_analyzed 2016-10-06 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 ' 1' ' ' TRP . . . . . . . . . . . . . 84.8 t90 . . . . . 0 N--CA 1.436 -1.166 0 CA-C-O 122.141 0.972 . . . . 0.0 108.496 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 18.6 mm-40 -143.92 149.73 47.08 Favored Pre-proline 0 N--CA 1.442 -0.844 1 N-CA-C 98.596 -4.594 . . . . 0.0 98.596 170.486 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 23.7 Cg_endo -71.88 123.27 9.2 Favored 'Trans proline' 0 CA--C 1.559 1.761 0 C-N-CA 123.655 2.903 . . . . 0.0 114.747 -170.092 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . 0.433 ' HG2' ' CD2' ' A' ' 6' ' ' TYR . 43.7 Cg_endo -92.07 -113.93 0.0 OUTLIER 'Trans proline' 0 CA--C 1.543 0.931 1 C-N-CA 127.263 5.309 . . . . 0.0 110.196 -178.006 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' TRP . . . . . 0.443 ' CE3' ' CD1' ' A' ' 6' ' ' TYR . 4.6 p-90 -85.55 -70.46 0.59 Allowed 'General case' 0 C--N 1.38 1.911 0 C-N-CA 126.817 2.047 . . . . 0.0 114.48 177.029 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.475 ' CD1' ' HD2' ' A' ' 56' ' ' LYS . 0.1 OUTLIER -31.18 -52.27 0.19 Allowed 'General case' 0 C--N 1.365 1.24 1 C-N-CA 132.992 4.517 . . . . 0.0 118.411 -170.811 . . . . . . . . 4 4 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 2.3 m -58.75 -40.31 83.49 Favored 'General case' 0 C--N 1.35 0.613 0 C-N-CA 127.567 2.347 . . . . 0.0 114.633 -177.334 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 27.8 mtpp -98.24 15.21 25.17 Favored 'General case' 0 C--N 1.359 0.993 0 C-N-CA 125.9 1.68 . . . . 0.0 111.533 177.616 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 16.9 tt0 -92.27 125.42 56.45 Favored Pre-proline 0 C--N 1.364 1.199 0 O-C-N 119.176 -2.202 . . . . 0.0 110.735 -173.518 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_exo -62.21 145.36 96.22 Favored 'Trans proline' 0 CA--C 1.547 1.126 0 C-N-CA 124.28 3.32 . . . . 0.0 117.508 -169.525 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 7.8 p -79.74 130.88 35.37 Favored 'Isoleucine or valine' 0 C--N 1.369 1.417 0 C-N-CA 123.48 0.712 . . . . 0.0 110.673 174.086 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 22.8 mmt85 -128.91 133.4 47.87 Favored 'General case' 0 C--N 1.35 0.617 0 N-CA-C 104.736 -2.32 . . . . 0.0 104.736 -173.543 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.315 19.4 tt -99.02 -45.04 12.18 Favored 'Isoleucine or valine' 0 C--N 1.369 1.414 0 CA-C-N 122.769 2.531 . . . . 0.0 111.355 175.577 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.358 1.761 0 C-N-CA 124.438 1.018 . . . . 0.0 111.348 -170.353 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 25.6 tttp . . . . . 0 N--CA 1.447 -0.589 0 N-CA-C 103.381 -2.822 . . . . 0.0 103.381 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -126.19 134.08 51.36 Favored 'General case' 0 C--N 1.357 0.917 0 CA-C-N 121.746 2.066 . . . . 0.0 107.766 178.386 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 25.8 m-85 -107.29 146.03 32.01 Favored 'General case' 0 C--N 1.356 0.851 0 C-N-CA 128.094 2.558 . . . . 0.0 109.215 177.093 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.8 t -70.4 136.73 49.85 Favored 'General case' 0 C--N 1.371 1.532 0 N-CA-C 117.902 2.556 . . . . 0.0 117.902 -175.717 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 33.9 p -145.63 161.36 40.01 Favored 'General case' 0 C--N 1.359 1.009 0 C-N-CA 124.79 1.236 . . . . 0.0 113.787 -176.577 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . 0.445 ' HB2' ' HB2' ' A' ' 47' ' ' PHE . 94.3 m-85 -132.49 134.65 45.29 Favored 'General case' 0 C--N 1.343 0.303 0 C-N-CA 126.121 1.768 . . . . 0.0 107.479 177.048 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 29.2 p90 -114.95 144.18 43.99 Favored 'General case' 0 C--N 1.366 1.294 0 N-CA-C 106.772 -1.566 . . . . 0.0 106.772 175.725 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . 0.414 ' HA ' ' HA ' ' A' ' 32' ' ' CYS . 11.9 t80 -89.55 119.12 29.7 Favored 'General case' 0 C--N 1.374 1.646 0 CA-C-N 122.274 2.306 . . . . 0.0 105.692 -179.467 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.59 ' HZ1' ' H ' ' A' ' 28' ' ' THR . 0.5 OUTLIER -89.03 116.41 27.29 Favored 'General case' 0 N--CA 1.429 -1.5 0 C-N-CA 125.303 1.441 . . . . 0.0 109.577 -176.71 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -64.99 -39.63 93.75 Favored 'General case' 0 C--N 1.343 0.317 0 N-CA-C 118.332 2.716 . . . . 0.0 118.332 -172.84 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' THR . . . . . 0.59 ' H ' ' HZ1' ' A' ' 26' ' ' LYS . 17.4 p -89.89 -2.86 58.28 Favored 'General case' 0 C--N 1.359 0.98 0 O-C-N 120.523 -1.36 . . . . 0.0 111.496 176.498 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -96.64 -46.88 6.14 Favored 'General case' 0 C--N 1.364 1.22 0 C-N-CA 125.196 1.398 . . . . 0.0 114.183 175.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . 0.296 18.8 tptt 89.3 19.42 0.04 OUTLIER 'General case' 0 C--N 1.368 1.385 0 C-N-CA 126.778 2.031 . . . . 0.0 113.333 -178.242 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 8.1 ptpp? -147.86 169.4 19.9 Favored 'General case' 0 C--N 1.352 0.698 0 C-N-CA 126.486 1.914 . . . . 0.0 108.237 176.728 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.414 ' HA ' ' HA ' ' A' ' 25' ' ' PHE . 74.0 m -90.86 141.33 28.93 Favored 'General case' 0 C--N 1.367 1.357 0 O-C-N 120.513 -1.367 . . . . 0.0 111.668 175.941 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.2 mt -110.93 146.03 33.63 Favored Pre-proline 0 C--N 1.347 0.48 0 N-CA-C 107.77 -1.196 . . . . 0.0 107.77 178.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 69.3 Cg_endo -86.58 149.52 8.76 Favored 'Trans proline' 0 N--CA 1.458 -0.606 0 C-N-CA 123.882 3.055 . . . . 0.0 112.797 -179.758 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 5.9 p90 -146.0 -161.52 1.33 Allowed 'General case' 0 N--CA 1.444 -0.774 0 N-CA-C 104.462 -2.422 . . . . 0.0 104.462 171.713 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 84.9 mt -141.96 148.23 38.27 Favored 'General case' 0 N--CA 1.433 -1.321 0 N-CA-C 101.048 -3.686 . . . . 0.0 101.048 173.815 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.443 ' CZ ' ' HA2' ' A' ' 39' ' ' GLY . 2.9 t80 -109.77 138.09 46.63 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 127.497 2.319 . . . . 0.0 106.44 176.925 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 51.8 m -78.62 -43.05 27.26 Favored 'General case' 0 C--N 1.373 1.601 0 CA-C-O 122.935 1.35 . . . . 0.0 111.899 178.615 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . 0.443 ' HA2' ' CZ ' ' A' ' 37' ' ' PHE . . . 125.12 -51.8 0.82 Allowed Glycine 0 C--N 1.349 1.265 0 C-N-CA 125.953 1.74 . . . . 0.0 109.772 -175.43 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 8.0 m -80.27 65.61 5.49 Favored 'General case' 0 C--N 1.357 0.903 0 N-CA-C 116.758 2.133 . . . . 0.0 116.758 -175.156 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 128.82 57.79 0.11 Allowed Glycine 0 C--N 1.37 2.425 0 N-CA-C 118.812 2.285 . . . . 0.0 118.812 173.325 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -103.2 -159.87 25.26 Favored Glycine 0 C--N 1.37 2.434 0 CA-C-N 119.992 1.896 . . . . 0.0 114.423 174.585 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . 0.538 ' H ' ' NH1' ' A' ' 46' ' ' ARG 0.304 46.9 p30 -136.93 -106.6 0.2 Allowed 'General case' 0 C--N 1.356 0.854 0 O-C-N 121.303 -1.116 . . . . 0.0 111.351 -179.809 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -167.75 29.32 0.03 OUTLIER 'General case' 0 C--N 1.355 0.805 0 C-N-CA 124.49 1.116 . . . . 0.0 111.888 -177.734 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 51.9 t-20 -105.94 34.26 3.4 Favored 'General case' 0 C--N 1.37 1.482 0 N-CA-C 105.442 -2.058 . . . . 0.0 105.442 173.523 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.538 ' NH1' ' H ' ' A' ' 43' ' ' ASN . 0.8 OUTLIER -121.91 110.6 16.06 Favored 'General case' 0 C--N 1.358 0.949 0 CA-C-O 125.172 2.415 . . . . 0.0 111.272 -172.554 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . 0.445 ' HB2' ' HB2' ' A' ' 23' ' ' PHE . 84.6 m-85 -92.59 127.23 38.01 Favored 'General case' 0 N--CA 1.445 -0.71 0 C-N-CA 129.569 3.148 . . . . 0.0 106.622 179.729 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.92 -17.35 59.79 Favored 'General case' 0 C--N 1.37 1.49 0 N-CA-C 117.025 2.232 . . . . 0.0 117.025 -173.982 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 31.2 p -142.74 171.49 13.98 Favored 'General case' 0 C--N 1.357 0.917 0 N-CA-C 102.649 -3.093 . . . . 0.0 102.649 175.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 6.7 tt -85.67 7.43 2.09 Favored 'Isoleucine or valine' 0 C--N 1.363 1.163 0 O-C-N 119.648 -1.907 . . . . 0.0 113.407 176.297 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -97.75 -13.82 42.46 Favored Glycine 0 C--N 1.362 2.012 0 O-C-N 119.596 -1.94 . . . . 0.0 113.498 178.024 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -85.87 -29.8 23.41 Favored 'General case' 0 C--N 1.359 0.99 0 C-N-CA 126.533 1.933 . . . . 0.0 110.114 175.363 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 6.8 t -37.75 -58.4 0.91 Allowed 'General case' 0 C--N 1.372 1.584 1 C-N-CA 133.302 4.641 . . . . 0.0 116.362 179.654 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.69 -12.11 60.9 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 130.399 3.479 . . . . 0.0 116.836 -178.778 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -86.26 -12.04 50.69 Favored 'General case' 0 C--N 1.368 1.392 0 O-C-N 119.8 -1.813 . . . . 0.0 114.458 -176.863 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.475 ' HD2' ' CD1' ' A' ' 6' ' ' TYR . 18.7 mtmt -105.02 -34.13 8.09 Favored 'General case' 0 C--N 1.352 0.68 0 C-N-CA 125.525 1.53 . . . . 0.0 110.53 177.572 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 17.8 m -124.17 15.49 9.12 Favored 'General case' 0 C--N 1.358 0.956 0 N-CA-C 117.236 2.31 . . . . 0.0 117.236 -169.073 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 15.0 mt -137.37 -26.55 0.99 Allowed 'General case' 0 N--CA 1.472 0.656 0 O-C-N 119.349 -2.095 . . . . 0.0 112.981 175.507 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 85.4 55.06 2.67 Favored Glycine 0 C--N 1.363 2.052 0 C-N-CA 127.911 2.672 . . . . 0.0 112.86 -171.922 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 8.6 ptpt . . . . . 0 C--O 1.263 1.774 0 CA-C-O 116.26 -1.828 . . . . 0.0 106.539 -178.229 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 1' ' ' TRP . . . . . 0.416 ' CZ2' ' HA ' ' A' ' 3' ' ' PRO . 20.8 t90 . . . . . 0 N--CA 1.432 -1.35 0 N-CA-C 106.224 -1.769 . . . . 0.0 106.224 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 37.1 mt-30 -143.42 143.25 23.36 Favored Pre-proline 0 C--N 1.351 0.648 1 N-CA-C 99.034 -4.432 . . . . 0.0 99.034 175.128 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . 0.416 ' HA ' ' CZ2' ' A' ' 1' ' ' TRP . 28.8 Cg_endo -72.37 114.86 4.12 Favored 'Trans proline' 0 CA--C 1.555 1.528 0 C-N-CA 124.776 3.65 . . . . 0.0 117.846 -165.623 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 33.3 Cg_exo -77.76 -115.88 0.01 OUTLIER 'Trans proline' 0 C--N 1.371 1.722 1 C-N-CA 127.201 5.267 . . . . 0.0 114.428 177.318 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' TRP . . . . . 0.467 ' CE2' ' CE2' ' A' ' 6' ' ' TYR . 5.0 p-90 -85.44 -68.87 0.7 Allowed 'General case' 0 C--N 1.38 1.902 0 C-N-CA 128.129 2.572 . . . . 0.0 114.874 -178.164 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.502 ' CD2' ' HD2' ' A' ' 56' ' ' LYS . 0.1 OUTLIER -31.67 -56.98 0.28 Allowed 'General case' 0 CA--C 1.492 -1.288 1 C-N-CA 133.717 4.807 . . . . 0.0 116.989 -172.222 . . . . . . . . 4 4 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -56.53 -44.52 80.91 Favored 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 129.158 2.983 . . . . 0.0 115.239 -178.109 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 45.8 mttm -93.18 -13.94 27.77 Favored 'General case' 0 C--N 1.358 0.943 0 C-N-CA 128.921 2.889 . . . . 0.0 113.638 -177.662 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -71.41 135.6 84.14 Favored Pre-proline 0 C--N 1.361 1.074 0 C-N-CA 127.581 2.352 . . . . 0.0 113.25 -175.06 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_exo -65.63 131.01 26.41 Favored 'Trans proline' 0 C--N 1.358 1.077 0 C-N-CA 124.232 3.288 . . . . 0.0 118.959 -167.119 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 8.2 p -77.33 124.39 35.65 Favored 'Isoleucine or valine' 0 C--N 1.368 1.395 0 C-N-CA 127.825 2.45 . . . . 0.0 113.912 175.535 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.409 ' HB2' HH22 ' A' ' 46' ' ' ARG . 1.0 OUTLIER -147.37 133.12 18.94 Favored 'General case' 0 C--N 1.367 1.344 0 C-N-CA 126.951 2.1 . . . . 0.0 112.906 -174.228 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.287 7.2 tt -88.26 -48.4 15.0 Favored 'Isoleucine or valine' 0 C--N 1.372 1.562 0 N-CA-C 117.619 2.451 . . . . 0.0 117.619 179.795 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.364 2.122 0 N-CA-C 117.411 1.724 . . . . 0.0 117.411 -170.231 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 12.0 ptmm? . . . . . 0 CA--C 1.503 -0.843 0 N-CA-C 102.328 -3.212 . . . . 0.0 102.328 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 5.1 mm100 -126.04 112.35 15.77 Favored 'General case' 0 N--CA 1.438 -1.058 0 N-CA-C 100.475 -3.898 . . . . 0.0 100.475 170.333 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 50.0 m-85 -94.4 144.23 25.73 Favored 'General case' 0 C--N 1.364 1.224 0 C-N-CA 126.385 1.874 . . . . 0.0 108.804 -179.654 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 4.9 t -67.54 112.74 4.87 Favored 'General case' 0 C--N 1.367 1.333 0 C-N-CA 126.723 2.009 . . . . 0.0 115.918 -175.764 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 4.6 p -120.26 -167.11 1.4 Allowed 'General case' 0 C--N 1.365 1.248 0 CA-C-O 123.263 1.506 . . . . 0.0 112.924 177.611 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 14.8 m-85 -148.99 136.82 20.58 Favored 'General case' 0 N--CA 1.446 -0.667 0 C-N-CA 129.236 3.014 . . . . 0.0 103.706 170.846 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 9.9 p90 -119.57 152.06 37.63 Favored 'General case' 0 C--N 1.364 1.216 0 CA-C-N 123.074 2.67 . . . . 0.0 109.684 173.102 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 19.6 t80 -94.01 121.66 35.71 Favored 'General case' 0 C--N 1.363 1.158 0 N-CA-C 106.45 -1.685 . . . . 0.0 106.45 -179.157 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 4.9 ttpp -90.9 108.59 19.94 Favored 'General case' 0 C--N 1.367 1.35 0 C-N-CA 123.48 0.712 . . . . 0.0 109.109 176.235 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 11.1 t-105 -52.09 -38.95 58.96 Favored 'General case' 0 C--N 1.355 0.823 0 C-N-CA 128.68 2.792 . . . . 0.0 117.1 -177.925 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 2.1 p -79.42 -30.09 42.17 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 129.686 3.194 . . . . 0.0 113.486 -179.397 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -86.1 -37.31 18.95 Favored 'General case' 0 C--N 1.365 1.273 0 C-N-CA 124.72 1.208 . . . . 0.0 111.473 177.748 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . 0.326 1.5 tptp 80.01 26.39 0.34 Allowed 'General case' 0 C--N 1.361 1.082 0 C-N-CA 127.693 2.397 . . . . 0.0 112.801 -178.621 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.47 ' HZ2' ' HD3' ' A' ' 54' ' ' ARG . 4.5 tmtt? -147.52 177.27 9.39 Favored 'General case' 0 C--N 1.363 1.171 0 C-N-CA 125.827 1.651 . . . . 0.0 110.87 175.476 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 61.8 m -93.17 122.53 35.65 Favored 'General case' 0 C--N 1.363 1.161 0 C-N-CA 129.043 2.937 . . . . 0.0 114.394 -175.731 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 19.2 mt -104.42 142.44 24.63 Favored Pre-proline 0 C--N 1.358 0.96 0 CA-C-O 117.83 -1.081 . . . . 0.0 109.971 177.536 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 96.9 Cg_endo -82.12 127.62 5.39 Favored 'Trans proline' 0 CA--C 1.531 0.334 0 C-N-CA 123.878 3.052 . . . . 0.0 112.273 175.541 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . 0.261 0.2 OUTLIER -141.39 177.45 8.1 Favored 'General case' 0 C--N 1.35 0.621 0 N-CA-C 102.325 -3.213 . . . . 0.0 102.325 169.512 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 1.1 mp -117.88 165.56 13.53 Favored 'General case' 0 N--CA 1.44 -0.96 0 C-N-CA 125.27 1.428 . . . . 0.0 107.263 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.439 ' CE2' ' HA2' ' A' ' 39' ' ' GLY . 30.3 t80 -123.01 136.52 54.88 Favored 'General case' 0 CA--C 1.551 1.011 0 C-N-CA 125.578 1.551 . . . . 0.0 112.071 178.882 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.9 t -88.08 -24.6 23.38 Favored 'General case' 0 C--N 1.38 1.9 0 CA-C-N 122.073 2.215 . . . . 0.0 114.315 173.422 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . 0.439 ' HA2' ' CE2' ' A' ' 37' ' ' PHE . . . 118.23 -58.66 0.51 Allowed Glycine 0 C--N 1.361 1.93 0 C-N-CA 125.78 1.657 . . . . 0.0 114.166 175.411 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -102.81 115.91 31.52 Favored 'General case' 0 C--N 1.351 0.635 0 C-N-CA 126.307 1.843 . . . . 0.0 106.654 178.721 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 134.46 -45.86 1.09 Allowed Glycine 0 CA--C 1.49 -1.528 0 N-CA-C 109.861 -1.296 . . . . 0.0 109.861 -174.435 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -93.45 -165.93 37.71 Favored Glycine 0 C--N 1.36 1.907 0 O-C-N 121.13 -1.217 . . . . 0.0 113.932 173.263 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . 0.392 3.9 p30 -134.37 -99.81 0.25 Allowed 'General case' 0 C--N 1.353 0.734 0 O-C-N 121.177 -1.19 . . . . 0.0 113.466 179.916 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -150.79 24.4 0.76 Allowed 'General case' 0 C--N 1.374 1.635 0 N-CA-C 117.022 2.23 . . . . 0.0 117.022 -171.059 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . 0.423 ' H ' ' NH1' ' A' ' 46' ' ' ARG . 40.2 t30 -101.7 48.2 0.89 Allowed 'General case' 0 N--CA 1.491 1.587 0 N-CA-C 105.106 -2.183 . . . . 0.0 105.106 171.458 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.423 ' NH1' ' H ' ' A' ' 45' ' ' ASN . 0.0 OUTLIER -146.3 118.42 8.3 Favored 'General case' 0 CA--C 1.492 -1.276 0 N-CA-C 104.275 -2.491 . . . . 0.0 104.275 -176.131 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . 0.431 ' CD2' ' HA ' ' A' ' 53' ' ' CYS . 21.8 m-85 -107.23 129.41 54.87 Favored 'General case' 0 N--CA 1.429 -1.49 0 C-N-CA 127.681 2.392 . . . . 0.0 107.524 -165.261 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 23.4 mp0 -70.06 -30.45 67.71 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 126.249 1.82 . . . . 0.0 115.558 -169.107 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 1.4 p -146.21 168.3 21.37 Favored 'General case' 0 C--N 1.352 0.696 0 N-CA-C 104.272 -2.492 . . . . 0.0 104.272 176.268 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 2.3 tt -84.23 138.31 19.4 Favored 'Isoleucine or valine' 0 C--N 1.37 1.484 0 C-N-CA 125.576 1.55 . . . . 0.0 108.246 176.288 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 117.17 -50.06 0.82 Allowed Glycine 0 C--N 1.364 2.105 0 N-CA-C 107.49 -2.244 . . . . 0.0 107.49 -157.367 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 16.2 tp10 -77.71 -20.03 54.24 Favored 'General case' 0 C--N 1.366 1.324 0 N-CA-C 115.813 1.783 . . . . 0.0 115.813 -178.297 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . 0.431 ' HA ' ' CD2' ' A' ' 47' ' ' PHE . 52.7 t -77.57 -42.03 36.75 Favored 'General case' 0 C--N 1.361 1.094 0 C-N-CA 128.509 2.723 . . . . 0.0 112.882 177.923 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.47 ' HD3' ' HZ2' ' A' ' 31' ' ' LYS . 72.5 mtm180 -74.52 -45.73 43.85 Favored 'General case' 0 N--CA 1.447 -0.609 1 C-N-CA 133.732 4.813 . . . . 0.0 112.466 179.96 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 69.8 tttt -82.63 55.03 2.83 Favored 'General case' 0 C--N 1.373 1.609 0 CA-C-O 123.616 1.674 . . . . 0.0 111.852 174.198 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.502 ' HD2' ' CD2' ' A' ' 6' ' ' TYR . 22.1 mtmt -167.77 -47.03 0.02 OUTLIER 'General case' 0 N--CA 1.444 -0.763 0 C-N-CA 129.977 3.311 . . . . 0.0 105.171 -178.547 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . 0.45 ' SG ' ' HB2' ' A' ' 6' ' ' TYR . 56.3 m -121.65 7.87 10.03 Favored 'General case' 0 C--N 1.357 0.914 0 N-CA-C 119.579 3.178 . . . . 0.0 119.579 -172.942 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 18.7 mt -133.83 -8.6 2.75 Favored 'General case' 0 N--CA 1.481 1.115 0 CA-C-N 125.646 3.839 . . . . 0.0 114.066 175.288 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 67.82 59.35 6.61 Favored Glycine 0 C--N 1.359 1.832 0 C-N-CA 128.262 2.839 . . . . 0.0 113.863 -171.449 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 2.5 ptpp? . . . . . 0 C--O 1.264 1.824 0 N-CA-C 102.366 -3.198 . . . . 0.0 102.366 -175.396 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 1' ' ' TRP . . . . . 0.54 ' CZ2' ' HB3' ' A' ' 3' ' ' PRO . 9.6 t90 . . . . . 0 N--CA 1.433 -1.32 0 N-CA-C 108.076 -1.083 . . . . 0.0 108.076 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 16.6 mm-40 -142.02 150.09 54.78 Favored Pre-proline 0 C--N 1.353 0.758 1 N-CA-C 98.382 -4.673 . . . . 0.0 98.382 171.07 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . 0.54 ' HB3' ' CZ2' ' A' ' 1' ' ' TRP . 87.5 Cg_endo -80.76 132.79 8.91 Favored 'Trans proline' 0 CA--C 1.563 1.933 0 CA-C-N 124.291 2.568 . . . . 0.0 113.455 -166.8 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . 0.41 ' HG2' ' CD2' ' A' ' 6' ' ' TYR . 44.7 Cg_endo -94.46 -113.22 0.0 OUTLIER 'Trans proline' 0 CA--C 1.546 1.119 1 C-N-CA 127.114 5.209 . . . . 0.0 110.784 -178.053 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' TRP . . . . . 0.433 ' CE3' ' CD1' ' A' ' 6' ' ' TYR 0.265 52.7 p-90 -86.98 -69.71 0.66 Allowed 'General case' 0 C--N 1.384 2.103 0 C-N-CA 128.097 2.559 . . . . 0.0 114.926 178.902 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.501 ' CD1' ' HD2' ' A' ' 56' ' ' LYS . 0.0 OUTLIER -32.8 -51.59 0.3 Allowed 'General case' 0 C--N 1.368 1.386 1 C-N-CA 132.472 4.309 . . . . 0.0 117.575 -174.168 . . . . . . . . 4 4 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 3.0 m -60.75 -28.7 68.9 Favored 'General case' 0 CA--C 1.507 -0.708 0 C-N-CA 129.275 3.03 . . . . 0.0 118.127 -175.305 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . 0.25 61.2 tttm -118.41 17.72 13.74 Favored 'General case' 0 C--N 1.355 0.81 0 C-N-CA 128.276 2.63 . . . . 0.0 108.487 -178.218 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 22.9 tp10 -94.86 127.78 41.9 Favored Pre-proline 0 C--N 1.36 1.041 0 O-C-N 119.263 -2.148 . . . . 0.0 112.722 -173.428 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_exo -72.99 140.9 32.22 Favored 'Trans proline' 0 C--N 1.352 0.746 0 C-N-CA 123.903 3.069 . . . . 0.0 113.45 -169.814 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -81.41 153.07 4.18 Favored 'Isoleucine or valine' 0 C--N 1.362 1.109 0 N-CA-C 115.426 1.639 . . . . 0.0 115.426 178.871 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -147.0 119.8 8.65 Favored 'General case' 0 N--CA 1.438 -1.034 0 C-N-CA 125.369 1.468 . . . . 0.0 111.14 -178.281 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.285 11.7 tt -74.02 -40.7 52.25 Favored 'Isoleucine or valine' 0 C--N 1.357 0.894 0 N-CA-C 115.413 1.634 . . . . 0.0 115.413 175.829 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.352 1.419 0 N-CA-C 109.617 -1.393 . . . . 0.0 109.617 -178.933 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 38.3 ttmt . . . . . 0 CA--C 1.504 -0.823 1 N-CA-C 99.545 -4.243 . . . . 0.0 99.545 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -130.31 128.04 40.71 Favored 'General case' 0 C--N 1.354 0.768 0 C-N-CA 123.873 0.869 . . . . 0.0 112.339 -170.071 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 26.8 m-85 -112.04 135.33 52.82 Favored 'General case' 0 C--N 1.358 0.966 0 C-N-CA 127.294 2.238 . . . . 0.0 107.7 177.184 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' SER . . . . . 0.448 ' HA ' ' HG ' ' A' ' 36' ' ' LEU 0.277 4.0 t -69.26 132.31 46.27 Favored 'General case' 0 C--N 1.375 1.684 0 N-CA-C 116.492 2.034 . . . . 0.0 116.492 -177.133 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 3.2 p -146.06 -172.08 3.85 Favored 'General case' 0 N--CA 1.448 -0.538 0 C-N-CA 127.633 2.373 . . . . 0.0 110.312 -173.029 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 48.6 m-85 -145.27 153.37 41.22 Favored 'General case' 0 C--N 1.35 0.628 0 C-N-CA 128.631 2.772 . . . . 0.0 110.733 177.083 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . 0.251 12.5 p90 -131.98 154.93 48.83 Favored 'General case' 0 C--N 1.373 1.624 0 C-N-CA 125.292 1.437 . . . . 0.0 108.671 168.106 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 16.2 t80 -94.97 111.88 23.63 Favored 'General case' 0 C--N 1.365 1.268 0 O-C-N 119.716 -1.865 . . . . 0.0 107.966 -179.477 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -83.38 107.03 15.62 Favored 'General case' 0 C--N 1.363 1.195 0 O-C-N 120.366 -1.459 . . . . 0.0 111.83 -176.51 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 41.1 t-105 -46.05 -53.59 9.95 Favored 'General case' 0 C--N 1.357 0.931 1 C-N-CA 132.155 4.182 . . . . 0.0 117.746 -171.546 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.5 p -81.27 -15.74 54.63 Favored 'General case' 0 C--N 1.353 0.723 0 C-N-CA 126.657 1.983 . . . . 0.0 113.084 179.686 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -88.79 -37.63 15.27 Favored 'General case' 0 C--N 1.366 1.299 0 C-N-CA 124.175 0.99 . . . . 0.0 112.044 174.304 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . 0.301 12.0 mmmm 77.25 27.03 0.68 Allowed 'General case' 0 C--N 1.366 1.309 0 C-N-CA 129.562 3.145 . . . . 0.0 113.327 -178.519 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 52.1 pttt -146.45 163.97 33.97 Favored 'General case' 0 C--N 1.355 0.811 0 C-N-CA 125.807 1.643 . . . . 0.0 110.502 -179.572 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 89.4 m -80.48 126.34 31.09 Favored 'General case' 0 C--N 1.359 0.991 0 C-N-CA 128.308 2.643 . . . . 0.0 115.222 -177.247 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 13.2 mt -112.19 147.58 37.26 Favored Pre-proline 0 C--N 1.36 1.039 0 O-C-N 120.461 -1.4 . . . . 0.0 108.725 176.298 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -86.57 142.54 7.02 Favored 'Trans proline' 0 C--N 1.344 0.311 1 C-N-CA 125.542 4.161 . . . . 0.0 111.444 170.976 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -145.7 165.12 29.68 Favored 'General case' 0 N--CA 1.439 -0.993 1 N-CA-C 98.313 -4.699 . . . . 0.0 98.313 169.691 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.448 ' HG ' ' HA ' ' A' ' 21' ' ' SER . 7.8 mp -109.72 149.93 29.04 Favored 'General case' 0 N--CA 1.44 -0.942 0 N-CA-C 104.428 -2.434 . . . . 0.0 104.428 174.922 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -100.51 138.15 37.96 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 126.953 2.101 . . . . 0.0 109.129 176.598 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 9.2 t -107.66 119.0 38.21 Favored 'General case' 0 C--N 1.363 1.179 0 N-CA-C 104.585 -2.376 . . . . 0.0 104.585 171.521 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -68.93 19.58 0.43 Allowed Glycine 0 N--CA 1.479 1.515 0 C-N-CA 127.681 2.563 . . . . 0.0 119.134 -178.397 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 78.7 m -114.12 56.22 0.72 Allowed 'General case' 0 C--N 1.354 0.791 0 C-N-CA 128.943 2.897 . . . . 0.0 108.825 172.355 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 118.29 54.77 0.28 Allowed Glycine 0 C--N 1.359 1.842 0 N-CA-C 120.367 2.907 . . . . 0.0 120.367 171.107 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -86.47 -176.72 49.62 Favored Glycine 0 C--N 1.37 2.466 0 CA-C-N 121.48 2.64 . . . . 0.0 116.412 175.12 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . 0.498 ' H ' ' CZ ' ' A' ' 46' ' ' ARG 0.355 30.2 p30 -113.07 -112.88 0.34 Allowed 'General case' 0 C--N 1.362 1.136 0 O-C-N 119.923 -1.927 . . . . 0.0 114.435 179.887 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -141.64 -9.31 0.94 Allowed 'General case' 0 C--N 1.354 0.761 0 O-C-N 120.406 -1.434 . . . . 0.0 112.894 -174.814 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 61.7 t30 -101.53 57.2 0.84 Allowed 'General case' 0 C--N 1.365 1.261 0 O-C-N 120.19 -1.568 . . . . 0.0 109.969 -179.409 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.498 ' CZ ' ' H ' ' A' ' 43' ' ' ASN 0.37 0.0 OUTLIER -131.06 130.53 43.35 Favored 'General case' 0 CA--C 1.498 -1.033 0 CA-C-O 124.415 2.055 . . . . 0.0 110.197 178.292 . . . . . . . . 4 4 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 10.5 m-85 -114.75 131.42 56.78 Favored 'General case' 0 C--N 1.35 0.593 0 C-N-CA 128.388 2.675 . . . . 0.0 106.894 -177.258 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -85.99 -27.08 25.07 Favored 'General case' 0 C--N 1.371 1.523 0 CA-C-N 121.62 2.009 . . . . 0.0 115.579 -177.311 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 23.9 p -125.19 155.72 39.57 Favored 'General case' 0 C--N 1.351 0.667 0 N-CA-C 104.8 -2.296 . . . . 0.0 104.8 177.497 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 16.4 tt -58.87 -32.17 46.59 Favored 'Isoleucine or valine' 0 C--N 1.36 1.046 0 N-CA-C 117.347 2.351 . . . . 0.0 117.347 -177.621 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -91.37 1.68 76.84 Favored Glycine 0 C--N 1.358 1.782 0 O-C-N 120.187 -1.571 . . . . 0.0 115.795 178.222 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 15.6 tp10 -82.28 -20.23 37.93 Favored 'General case' 0 C--N 1.365 1.248 0 O-C-N 120.896 -1.355 . . . . 0.0 110.67 170.774 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 19.7 t -72.12 -30.19 64.82 Favored 'General case' 0 C--N 1.363 1.162 0 C-N-CA 129.07 2.948 . . . . 0.0 112.86 175.573 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 43.8 mtp180 -76.16 -48.56 20.12 Favored 'General case' 0 C--N 1.355 0.81 0 C-N-CA 127.697 2.399 . . . . 0.0 114.875 176.461 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 30.8 ttmt -82.15 59.92 4.67 Favored 'General case' 0 C--N 1.361 1.075 0 C-N-CA 127.809 2.444 . . . . 0.0 111.841 -174.266 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.501 ' HD2' ' CD1' ' A' ' 6' ' ' TYR . 23.9 mtmt -179.62 -39.81 0.01 OUTLIER 'General case' 0 N--CA 1.439 -0.993 0 C-N-CA 130.854 3.662 . . . . 0.0 106.09 -176.11 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . 0.409 ' O ' ' CZ2' ' A' ' 1' ' ' TRP . 67.7 m -125.01 7.38 7.98 Favored 'General case' 0 C--N 1.364 1.238 0 N-CA-C 119.862 3.282 . . . . 0.0 119.862 -170.503 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 14.7 mt -140.58 -8.97 1.09 Allowed 'General case' 0 N--CA 1.476 0.834 0 CA-C-N 124.124 3.147 . . . . 0.0 114.466 169.713 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 71.41 51.32 17.42 Favored Glycine 0 C--N 1.356 1.654 0 C-N-CA 128.107 2.765 . . . . 0.0 113.395 -171.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 12.3 ptpt . . . . . 0 C--O 1.26 1.629 0 N-CA-C 103.707 -2.701 . . . . 0.0 103.707 -174.195 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 1' ' ' TRP . . . . . 0.418 ' CZ2' ' HA ' ' A' ' 3' ' ' PRO . 23.3 t90 . . . . . 0 N--CA 1.433 -1.297 0 N-CA-C 108.254 -1.017 . . . . 0.0 108.254 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 23.5 mm-40 -144.14 144.06 24.7 Favored Pre-proline 0 C--N 1.353 0.726 0 N-CA-C 100.482 -3.895 . . . . 0.0 100.482 174.927 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . 0.418 ' HA ' ' CZ2' ' A' ' 1' ' ' TRP . 19.9 Cg_endo -72.69 122.59 8.34 Favored 'Trans proline' 0 CA--C 1.557 1.631 0 CA-C-N 124.782 2.744 . . . . 0.0 116.441 -169.257 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -91.78 -123.15 0.01 OUTLIER 'Trans proline' 0 CA--C 1.555 1.533 1 C-N-CA 127.034 5.156 . . . . 0.0 111.81 178.694 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' TRP . . . . . 0.469 ' CE3' ' CD1' ' A' ' 6' ' ' TYR 0.336 54.7 p-90 -73.09 -74.14 0.18 Allowed 'General case' 0 C--N 1.384 2.076 0 C-N-CA 126.521 1.928 . . . . 0.0 114.44 178.538 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.531 ' CD1' ' HD2' ' A' ' 56' ' ' LYS . 0.1 OUTLIER -32.04 -51.46 0.24 Allowed 'General case' 0 C--N 1.363 1.169 1 C-N-CA 132.183 4.193 . . . . 0.0 117.469 -175.619 . . . . . . . . 4 4 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.1 m -71.5 -8.01 51.19 Favored 'General case' 0 CA--C 1.51 -0.587 0 C-N-CA 129.885 3.274 . . . . 0.0 115.747 -176.902 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 47.8 mttp -134.81 11.63 3.67 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 128.118 2.567 . . . . 0.0 107.242 -179.604 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.408 ' HA ' ' HD3' ' A' ' 10' ' ' PRO . 34.9 tp10 -96.85 134.42 23.08 Favored Pre-proline 0 C--N 1.364 1.228 0 N-CA-C 115.092 1.515 . . . . 0.0 115.092 -167.849 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . 0.408 ' HD3' ' HA ' ' A' ' 9' ' ' GLU . 72.0 Cg_exo -66.35 121.1 8.32 Favored 'Trans proline' 0 C--N 1.365 1.433 0 C-N-CA 124.707 3.604 . . . . 0.0 116.182 -169.495 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 14.3 p -69.39 136.46 26.2 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.908 0 C-N-CA 127.642 2.377 . . . . 0.0 112.885 177.584 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 61.6 mtp180 -146.33 126.09 13.46 Favored 'General case' 0 C--N 1.359 1.02 0 C-N-CA 125.237 1.415 . . . . 0.0 111.869 -172.274 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 12.9 tt -103.65 -37.27 4.49 Favored 'Isoleucine or valine' 0 C--N 1.37 1.482 0 C-N-CA 126.334 1.854 . . . . 0.0 112.452 175.593 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.366 2.195 0 C-N-CA 127.171 2.319 . . . . 0.0 116.95 176.722 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 15.0 tppt? . . . . . 0 CA--C 1.5 -0.951 0 N-CA-C 106.547 -1.649 . . . . 0.0 106.547 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . 0.337 4.1 mp0 -93.5 121.15 34.61 Favored 'General case' 0 C--N 1.358 0.946 0 CA-C-O 122.955 1.359 . . . . 0.0 112.075 178.736 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 30.0 m-85 -108.21 150.13 27.66 Favored 'General case' 0 C--N 1.356 0.874 0 C-N-CA 128.148 2.579 . . . . 0.0 106.069 -179.176 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 4.1 t -72.0 143.95 49.01 Favored 'General case' 0 C--N 1.368 1.404 0 N-CA-C 117.127 2.269 . . . . 0.0 117.127 -173.536 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 27.7 p -145.87 -173.28 4.11 Favored 'General case' 0 C--N 1.36 1.062 0 C-N-CA 127.934 2.494 . . . . 0.0 112.458 -177.856 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . 0.431 ' HA ' ' HA ' ' A' ' 34' ' ' PRO . 43.0 m-85 -139.69 153.21 47.19 Favored 'General case' 0 C--N 1.361 1.089 0 C-N-CA 129.454 3.102 . . . . 0.0 111.66 174.876 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . 0.282 10.7 p90 -147.93 161.42 41.36 Favored 'General case' 0 C--N 1.367 1.355 0 C-N-CA 126.437 1.895 . . . . 0.0 110.158 172.134 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . 0.409 ' CD2' ' HB2' ' A' ' 57' ' ' CYS . 27.5 t80 -100.53 127.44 46.9 Favored 'General case' 0 C--N 1.368 1.387 0 O-C-N 120.54 -1.35 . . . . 0.0 108.274 178.438 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 1.7 ttpp -85.77 103.17 14.3 Favored 'General case' 0 C--N 1.364 1.21 0 C-N-CA 124.334 1.054 . . . . 0.0 112.04 177.873 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 35.3 t-105 -50.69 -44.43 57.92 Favored 'General case' 0 C--N 1.35 0.612 0 C-N-CA 129.301 3.04 . . . . 0.0 116.116 179.361 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 3.7 p -87.31 -6.56 58.47 Favored 'General case' 0 C--N 1.36 1.064 0 C-N-CA 125.193 1.397 . . . . 0.0 113.326 178.478 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -99.51 -38.48 8.76 Favored 'General case' 0 C--N 1.368 1.376 0 CA-C-N 120.561 1.528 . . . . 0.0 112.095 173.701 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . 0.273 30.4 tptt 84.36 23.59 0.11 Allowed 'General case' 0 C--N 1.367 1.351 0 C-N-CA 127.623 2.369 . . . . 0.0 111.616 -176.258 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 55.2 mtmt -145.54 166.43 25.75 Favored 'General case' 0 C--N 1.357 0.92 0 C-N-CA 126.636 1.974 . . . . 0.0 109.55 -177.61 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 75.0 m -89.39 145.8 25.1 Favored 'General case' 0 C--N 1.358 0.938 0 C-N-CA 127.646 2.379 . . . . 0.0 113.293 -178.791 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 44.6 mt -129.09 148.93 71.08 Favored Pre-proline 0 C--N 1.357 0.934 0 C-N-CA 125.296 1.438 . . . . 0.0 109.182 176.298 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . 0.431 ' HA ' ' HA ' ' A' ' 23' ' ' PHE . 18.6 Cg_endo -86.64 162.31 9.34 Favored 'Trans proline' 0 N--CA 1.46 -0.445 0 C-N-CA 123.267 2.645 . . . . 0.0 110.868 165.933 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . 0.352 2.9 p90 -149.55 -159.24 1.01 Allowed 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 113.269 -1.787 . . . . 0.0 108.332 174.775 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 18.8 mt -139.65 144.94 37.88 Favored 'General case' 0 N--CA 1.439 -1.016 0 N-CA-C 103.323 -2.843 . . . . 0.0 103.323 -178.598 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.43 ' CE2' ' HA2' ' A' ' 39' ' ' GLY . 12.3 t80 -121.2 128.97 52.97 Favored 'General case' 0 CA--C 1.551 0.982 0 C-N-CA 128.852 2.861 . . . . 0.0 109.338 -179.792 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 37.7 m -76.52 2.57 13.48 Favored 'General case' 0 C--N 1.388 2.252 0 N-CA-C 115.976 1.843 . . . . 0.0 115.976 -178.318 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . 0.43 ' HA2' ' CE2' ' A' ' 37' ' ' PHE . . . 83.85 -39.45 2.85 Favored Glycine 0 C--N 1.358 1.776 0 N-CA-C 118.374 2.11 . . . . 0.0 118.374 176.3 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -125.51 38.06 4.25 Favored 'General case' 0 C--N 1.35 0.595 0 C-N-CA 124.514 1.125 . . . . 0.0 108.591 178.484 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -147.8 28.31 1.44 Allowed Glycine 0 C--N 1.356 1.655 0 N-CA-C 116.762 1.465 . . . . 0.0 116.762 -176.398 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -105.43 178.36 23.31 Favored Glycine 0 C--N 1.356 1.644 0 O-C-N 119.598 -2.119 . . . . 0.0 116.467 177.727 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . 0.449 ' CG ' ' H ' ' A' ' 44' ' ' ALA . 43.6 p-10 -127.31 -92.98 0.48 Allowed 'General case' 0 C--N 1.356 0.882 0 C-N-CA 124.615 1.166 . . . . 0.0 112.5 176.425 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . 0.449 ' H ' ' CG ' ' A' ' 43' ' ' ASN . . . -136.52 -30.0 0.93 Allowed 'General case' 0 C--N 1.358 0.972 0 N-CA-C 114.537 1.31 . . . . 0.0 114.537 -172.182 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 45.5 t30 -92.72 72.09 4.93 Favored 'General case' 0 C--N 1.372 1.547 0 O-C-N 119.743 -1.848 . . . . 0.0 111.918 -176.343 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . 0.377 0.0 OUTLIER -135.77 125.59 25.65 Favored 'General case' 0 C--N 1.351 0.673 0 CA-C-O 124.517 2.103 . . . . 0.0 110.238 174.606 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 20.2 m-30 -105.0 137.83 42.15 Favored 'General case' 0 N--CA 1.441 -0.905 0 C-N-CA 128.69 2.796 . . . . 0.0 107.795 -176.526 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 30.9 mt-30 -74.73 -45.65 42.61 Favored 'General case' 0 C--N 1.368 1.41 0 N-CA-C 114.734 1.383 . . . . 0.0 114.734 -177.413 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 30.1 p -129.56 172.23 11.78 Favored 'General case' 0 C--N 1.353 0.744 0 N-CA-C 105.529 -2.026 . . . . 0.0 105.529 175.747 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 18.6 tt -59.55 -28.07 39.08 Favored 'Isoleucine or valine' 0 C--N 1.365 1.281 0 C-N-CA 128.869 2.868 . . . . 0.0 117.05 178.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -84.75 -8.9 82.09 Favored Glycine 0 C--N 1.361 1.956 0 N-CA-C 115.961 1.144 . . . . 0.0 115.961 -177.226 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -88.49 -1.93 58.32 Favored 'General case' 0 C--N 1.362 1.123 0 C-N-CA 126.06 1.744 . . . . 0.0 111.248 176.274 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 33.9 t -85.05 -47.79 9.86 Favored 'General case' 0 C--N 1.355 0.821 0 C-N-CA 128.333 2.653 . . . . 0.0 112.983 -178.191 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.438 ' HB2' ' HD2' ' A' ' 60' ' ' LYS 0.338 0.0 OUTLIER -85.79 -25.27 26.45 Favored 'General case' 0 C--O 1.234 0.277 0 C-N-CA 128.64 2.776 . . . . 0.0 111.815 -179.916 . . . . . . . . 4 4 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.67 -25.39 63.88 Favored 'General case' 0 C--N 1.373 1.601 0 C-N-CA 125.857 1.663 . . . . 0.0 113.794 171.696 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.531 ' HD2' ' CD1' ' A' ' 6' ' ' TYR . 23.5 mtmt -98.49 -32.1 11.64 Favored 'General case' 0 C--N 1.362 1.116 0 C-N-CA 125.034 1.334 . . . . 0.0 111.636 172.695 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . 0.447 ' SG ' ' HB2' ' A' ' 6' ' ' TYR . 87.7 m -124.33 11.46 8.71 Favored 'General case' 0 C--N 1.362 1.132 0 N-CA-C 120.12 3.378 . . . . 0.0 120.12 -172.167 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 17.3 mt -132.15 -17.97 2.65 Favored 'General case' 0 N--CA 1.477 0.879 0 CA-C-N 124.579 3.354 . . . . 0.0 112.102 170.214 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 76.61 56.09 4.34 Favored Glycine 0 C--N 1.359 1.831 0 C-N-CA 128.034 2.73 . . . . 0.0 112.381 -171.601 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . 0.438 ' HD2' ' HB2' ' A' ' 54' ' ' ARG . 13.7 ptpt . . . . . 0 C--O 1.258 1.526 0 N-CA-C 102.892 -3.003 . . . . 0.0 102.892 -176.373 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 19.3 t90 . . . . . 0 N--CA 1.436 -1.171 0 CA-C-O 122.706 1.241 . . . . 0.0 109.753 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 35.3 mt-30 -138.75 147.6 55.09 Favored Pre-proline 0 C--N 1.359 1.016 1 N-CA-C 99.91 -4.107 . . . . 0.0 99.91 169.279 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 5.0 Cg_endo -73.76 123.57 8.61 Favored 'Trans proline' 0 CA--C 1.553 1.444 0 CA-C-N 125.556 3.02 . . . . 0.0 116.03 -169.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . 0.454 ' HG2' ' CD2' ' A' ' 6' ' ' TYR . 49.5 Cg_endo -94.11 -116.92 0.0 OUTLIER 'Trans proline' 0 CA--C 1.548 1.221 1 C-N-CA 126.392 4.728 . . . . 0.0 110.362 179.592 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' TRP . . . . . . . . . . . . 0.264 63.9 p-90 -87.06 -57.09 3.09 Favored 'General case' 0 C--N 1.384 2.093 0 C-N-CA 127.977 2.511 . . . . 0.0 115.234 176.249 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.454 ' CD2' ' HG2' ' A' ' 4' ' ' PRO . 0.1 OUTLIER -48.44 -7.77 0.02 OUTLIER 'General case' 0 C--N 1.363 1.162 1 C-N-CA 132.255 4.222 . . . . 0.0 120.663 -174.683 . . . . . . . . 4 4 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 4.1 m -103.09 -31.67 10.06 Favored 'General case' 0 N--CA 1.442 -0.868 0 N-CA-C 106.829 -1.545 . . . . 0.0 106.829 -177.331 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 26.0 mtmt -98.27 20.77 11.95 Favored 'General case' 0 C--N 1.364 1.231 0 C-N-CA 128.904 2.881 . . . . 0.0 113.206 -175.181 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.406 ' HA ' ' HD3' ' A' ' 10' ' ' PRO . 0.1 OUTLIER -104.94 126.36 31.31 Favored Pre-proline 0 C--N 1.362 1.131 0 CA-C-O 115.645 -2.121 . . . . 0.0 108.558 -176.763 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . 0.406 ' HD3' ' HA ' ' A' ' 9' ' ' GLU . 30.5 Cg_exo -77.19 156.02 33.35 Favored 'Trans proline' 0 C--N 1.374 1.872 0 C-N-CA 125.23 3.954 . . . . 0.0 113.689 -167.22 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 9.4 p -72.52 134.12 30.44 Favored 'Isoleucine or valine' 0 C--N 1.37 1.483 0 N-CA-C 117.966 2.58 . . . . 0.0 117.966 178.379 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.697 ' NE ' HH21 ' A' ' 46' ' ' ARG . 0.0 OUTLIER -106.08 -176.72 3.16 Favored 'General case' 0 C--N 1.355 0.846 0 C-N-CA 129.109 2.964 . . . . 0.0 109.741 179.069 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.451 0.6 OUTLIER -155.49 -55.42 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.355 0.812 0 C-N-CA 126.133 1.773 . . . . 0.0 112.95 162.996 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.366 2.232 0 CA-C-N 119.506 1.048 . . . . 0.0 114.245 -174.152 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 13.6 tptp . . . . . 0 N--CA 1.439 -1.0 1 N-CA-C 99.094 -4.41 . . . . 0.0 99.094 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 3.2 mm100 -93.07 120.22 33.13 Favored 'General case' 0 C--N 1.356 0.866 0 N-CA-C 107.24 -1.392 . . . . 0.0 107.24 178.13 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 29.5 m-85 -109.49 131.27 55.22 Favored 'General case' 0 C--N 1.355 0.806 0 O-C-N 121.033 -1.042 . . . . 0.0 108.271 -179.002 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' SER . . . . . 0.406 ' HA ' ' HG ' ' A' ' 36' ' ' LEU . 8.2 t -68.08 127.43 32.85 Favored 'General case' 0 C--N 1.375 1.701 0 CA-C-N 120.708 1.594 . . . . 0.0 115.121 -176.863 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 90.5 p -125.5 -159.62 0.91 Allowed 'General case' 0 C--N 1.348 0.501 0 C-N-CA 126.188 1.795 . . . . 0.0 112.451 -176.544 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 95.4 m-85 -146.94 132.35 18.59 Favored 'General case' 0 C--N 1.366 1.298 0 C-N-CA 129.646 3.178 . . . . 0.0 108.302 176.663 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 7.7 p90 -130.02 154.63 47.22 Favored 'General case' 0 C--N 1.363 1.183 0 CA-C-N 120.692 1.587 . . . . 0.0 107.746 169.757 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 7.8 t80 -102.94 127.47 50.14 Favored 'General case' 0 C--N 1.36 1.04 0 N-CA-C 105.652 -1.981 . . . . 0.0 105.652 -179.768 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 16.8 tptp -109.12 111.35 22.92 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 120.875 -1.14 . . . . 0.0 110.153 -178.058 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 33.7 t-105 -33.98 -58.08 0.45 Allowed 'General case' 0 C--N 1.369 1.453 0 N-CA-C 120.494 3.516 . . . . 0.0 120.494 176.551 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 2.0 p -80.27 -5.92 57.05 Favored 'General case' 0 C--N 1.363 1.173 0 C-N-CA 126.524 1.93 . . . . 0.0 113.868 -179.564 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -94.88 -39.67 10.11 Favored 'General case' 0 C--N 1.363 1.194 0 C-N-CA 124.663 1.185 . . . . 0.0 109.94 173.924 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 11.7 tptm 78.09 17.95 1.19 Allowed 'General case' 0 C--N 1.373 1.619 0 C-N-CA 128.44 2.696 . . . . 0.0 112.241 179.079 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 56.8 mtmt -138.0 167.27 22.12 Favored 'General case' 0 C--N 1.354 0.789 0 C-N-CA 128.469 2.707 . . . . 0.0 110.637 -175.567 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 87.9 m -93.17 119.29 32.2 Favored 'General case' 0 C--N 1.365 1.249 0 C-N-CA 129.528 3.131 . . . . 0.0 111.291 179.434 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 58.3 mt -110.48 139.31 21.42 Favored Pre-proline 0 C--N 1.35 0.591 0 O-C-N 119.949 -1.72 . . . . 0.0 109.788 -179.882 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -87.89 104.62 0.53 Allowed 'Trans proline' 0 N--CA 1.462 -0.346 0 C-N-CA 124.163 3.242 . . . . 0.0 112.12 -178.92 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 1.1 p90 -98.8 -177.95 3.81 Favored 'General case' 0 C--N 1.359 0.982 0 N-CA-C 107.218 -1.401 . . . . 0.0 107.218 173.782 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.406 ' HG ' ' HA ' ' A' ' 21' ' ' SER . 6.8 mp -118.65 145.04 45.77 Favored 'General case' 0 CA--C 1.507 -0.684 0 O-C-N 119.251 -2.156 . . . . 0.0 105.896 176.092 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 25.9 t80 -106.86 138.67 42.59 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 126.408 1.883 . . . . 0.0 110.164 177.851 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 2.7 m -92.85 -5.33 51.21 Favored 'General case' 0 C--N 1.376 1.724 0 N-CA-C 116.475 2.028 . . . . 0.0 116.475 178.073 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 105.82 -58.18 0.46 Allowed Glycine 0 C--N 1.366 2.245 0 CA-C-N 120.415 1.461 . . . . 0.0 115.71 -176.764 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 3.3 m -116.02 134.64 54.74 Favored 'General case' 0 C--N 1.354 0.781 0 N-CA-C 104.323 -2.473 . . . . 0.0 104.323 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 113.35 -10.61 24.2 Favored Glycine 0 C--N 1.362 2.002 0 CA-C-N 120.591 1.541 . . . . 0.0 112.562 -174.599 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -87.43 126.76 8.14 Favored Glycine 0 C--N 1.361 1.932 0 C-N-CA 125.883 1.706 . . . . 0.0 110.206 168.587 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 42.0 p30 -88.48 -78.49 0.33 Allowed 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 127.272 2.229 . . . . 0.0 115.307 -179.52 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -136.84 -27.11 1.02 Allowed 'General case' 0 C--N 1.362 1.151 0 N-CA-C 117.53 2.419 . . . . 0.0 117.53 -176.165 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 55.8 t30 -109.45 78.49 1.14 Allowed 'General case' 0 CA--C 1.55 0.958 0 N-CA-C 117.962 2.578 . . . . 0.0 117.962 -170.635 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.697 HH21 ' NE ' ' A' ' 12' ' ' ARG 0.445 0.2 OUTLIER -146.34 147.96 31.88 Favored 'General case' 0 C--N 1.366 1.312 0 CA-C-N 123.902 3.046 . . . . 0.0 112.67 168.007 . . . . . . . . 4 4 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 7.2 m-85 -108.05 139.08 43.21 Favored 'General case' 0 C--N 1.368 1.409 0 C-N-CA 127.428 2.291 . . . . 0.0 112.416 -168.458 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -81.96 -24.63 35.42 Favored 'General case' 0 C--N 1.374 1.642 0 C-N-CA 126.311 1.844 . . . . 0.0 115.367 -179.61 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 57.3 p -139.54 163.94 31.22 Favored 'General case' 0 C--N 1.36 1.037 0 N-CA-C 105.599 -2.0 . . . . 0.0 105.599 176.519 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 14.1 tt -64.61 -21.52 29.4 Favored 'Isoleucine or valine' 0 C--N 1.367 1.354 0 C-N-CA 126.817 2.047 . . . . 0.0 116.191 179.489 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -84.43 -13.37 73.58 Favored Glycine 0 C--N 1.365 2.148 0 C-N-CA 126.05 1.786 . . . . 0.0 114.618 -179.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -82.76 -12.69 57.33 Favored 'General case' 0 C--N 1.366 1.319 0 O-C-N 120.823 -1.398 . . . . 0.0 111.61 174.577 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 14.9 t -72.71 -48.1 41.54 Favored 'General case' 0 C--N 1.361 1.107 0 C-N-CA 127.628 2.371 . . . . 0.0 112.755 178.045 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 11.0 mtp180 -69.99 -33.16 71.68 Favored 'General case' 0 C--N 1.346 0.424 1 C-N-CA 132.778 4.431 . . . . 0.0 112.994 173.699 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 31.5 ttmt -69.84 -36.94 75.99 Favored 'General case' 0 C--N 1.369 1.421 0 C-N-CA 126.825 2.05 . . . . 0.0 113.213 178.83 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.414 ' HD2' ' CD1' ' A' ' 6' ' ' TYR . 6.0 mtmm -89.09 -31.64 17.92 Favored 'General case' 0 C--N 1.367 1.366 0 C-N-CA 124.918 1.287 . . . . 0.0 111.91 172.88 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 56.4 m -127.33 8.85 6.59 Favored 'General case' 0 C--N 1.365 1.247 0 N-CA-C 121.558 3.91 . . . . 0.0 121.558 -173.557 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 14.1 mt -136.54 -32.41 0.83 Allowed 'General case' 0 C--N 1.359 1.018 1 CA-C-N 126.984 4.447 . . . . 0.0 115.228 169.392 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 86.46 55.31 2.48 Favored Glycine 0 C--N 1.359 1.827 0 CA-C-N 119.577 1.08 . . . . 0.0 112.279 -169.634 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 1.3 ptpp? . . . . . 0 C--O 1.258 1.527 0 N-CA-C 103.264 -2.865 . . . . 0.0 103.264 -176.594 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 1' ' ' TRP . . . . . 0.463 ' CZ2' ' HB3' ' A' ' 3' ' ' PRO . 3.4 t90 . . . . . 0 N--CA 1.433 -1.299 0 N-CA-C 105.996 -1.853 . . . . 0.0 105.996 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 30.4 mt-30 -136.38 144.86 49.35 Favored Pre-proline 0 N--CA 1.443 -0.789 0 N-CA-C 100.322 -3.955 . . . . 0.0 100.322 173.585 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . 0.463 ' HB3' ' CZ2' ' A' ' 1' ' ' TRP . 47.1 Cg_endo -76.0 125.83 8.92 Favored 'Trans proline' 0 CA--C 1.558 1.701 0 C-N-CA 123.369 2.712 . . . . 0.0 114.5 -168.461 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_endo -96.59 -114.38 0.0 OUTLIER 'Trans proline' 0 CA--C 1.547 1.168 1 C-N-CA 126.886 5.058 . . . . 0.0 111.345 -176.395 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' TRP . . . . . 0.506 ' CE3' ' CD1' ' A' ' 6' ' ' TYR 0.29 45.9 p-90 -86.74 -69.71 0.66 Allowed 'General case' 0 C--N 1.382 1.998 0 C-N-CA 127.623 2.369 . . . . 0.0 114.867 178.469 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.547 ' CD1' ' HD2' ' A' ' 56' ' ' LYS . 0.1 OUTLIER -33.14 -45.09 0.13 Allowed 'General case' 0 C--N 1.36 1.046 1 C-N-CA 132.995 4.518 . . . . 0.0 119.137 -173.397 . . . . . . . . 4 4 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.6 m -65.84 -41.79 91.31 Favored 'General case' 0 N--CA 1.448 -0.57 0 C-N-CA 128.235 2.614 . . . . 0.0 112.148 -179.827 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 44.2 mtpt -93.95 -7.97 41.42 Favored 'General case' 0 C--N 1.363 1.154 0 C-N-CA 129.073 2.949 . . . . 0.0 112.368 -179.278 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.417 ' HA ' ' HD3' ' A' ' 10' ' ' PRO . 0.6 OUTLIER -80.89 123.44 82.23 Favored Pre-proline 0 C--N 1.363 1.183 0 CA-C-O 116.326 -1.797 . . . . 0.0 112.738 -172.676 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . 0.417 ' HD3' ' HA ' ' A' ' 9' ' ' GLU . 50.7 Cg_exo -70.86 147.78 56.5 Favored 'Trans proline' 0 CA--C 1.54 0.779 0 C-N-CA 123.525 2.817 . . . . 0.0 115.479 -163.801 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 3.5 p -78.8 131.99 33.21 Favored 'Isoleucine or valine' 0 C--N 1.363 1.177 0 C-N-CA 125.375 1.47 . . . . 0.0 110.659 176.236 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 38.3 mtt-85 -136.23 152.03 50.31 Favored 'General case' 0 C--N 1.359 0.995 0 N-CA-C 106.408 -1.701 . . . . 0.0 106.408 -173.812 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.385 14.5 tt -125.18 -54.03 2.14 Favored 'Isoleucine or valine' 0 C--N 1.375 1.706 0 CA-C-N 120.988 1.722 . . . . 0.0 112.733 179.209 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.357 1.716 0 CA-C-N 119.564 1.074 . . . . 0.0 112.168 173.84 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.644 ' HZ1' ' H ' ' A' ' 19' ' ' GLN . 4.8 tptp . . . . . 0 N--CA 1.45 -0.458 0 N-CA-C 104.898 -2.26 . . . . 0.0 104.898 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . 0.644 ' H ' ' HZ1' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -145.82 102.22 3.64 Favored 'General case' 0 C--N 1.358 0.949 0 O-C-N 119.433 -2.042 . . . . 0.0 109.721 174.261 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 58.4 m-85 -93.71 147.21 23.25 Favored 'General case' 0 C--N 1.358 0.962 0 C-N-CA 127.644 2.378 . . . . 0.0 108.168 175.304 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 3.8 t -72.88 114.01 10.55 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 126.324 1.85 . . . . 0.0 115.175 -176.703 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 88.0 p -129.96 161.71 30.3 Favored 'General case' 0 C--N 1.367 1.327 0 N-CA-C 114.679 1.363 . . . . 0.0 114.679 -178.952 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . 0.404 ' HB2' ' HB2' ' A' ' 47' ' ' PHE . 91.8 m-85 -135.97 148.16 48.34 Favored 'General case' 0 CA--C 1.51 -0.594 0 N-CA-C 107.392 -1.336 . . . . 0.0 107.392 176.224 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 2.6 p90 -137.72 153.8 49.72 Favored 'General case' 0 C--N 1.358 0.945 0 C-N-CA 125.751 1.62 . . . . 0.0 108.996 176.183 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 15.7 t80 -96.32 135.81 37.66 Favored 'General case' 0 C--N 1.362 1.137 0 O-C-N 120.727 -1.233 . . . . 0.0 108.353 178.429 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.63 102.97 14.86 Favored 'General case' 0 N--CA 1.441 -0.914 0 O-C-N 121.799 -0.563 . . . . 0.0 110.813 178.882 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 10.6 t-105 -39.68 -47.02 1.95 Allowed 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 130.061 3.345 . . . . 0.0 118.196 169.484 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . 0.278 4.0 p -86.48 -23.23 26.04 Favored 'General case' 0 C--N 1.363 1.169 0 CA-C-O 118.147 -0.93 . . . . 0.0 112.774 176.875 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -82.07 -37.09 26.92 Favored 'General case' 0 C--N 1.376 1.753 0 CA-C-N 121.884 2.129 . . . . 0.0 114.854 173.705 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . 0.292 0.8 OUTLIER 81.96 22.28 0.27 Allowed 'General case' 0 C--N 1.371 1.503 0 C-N-CA 127.876 2.471 . . . . 0.0 111.8 -177.153 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 53.5 mtmt -143.94 169.68 17.34 Favored 'General case' 0 C--N 1.357 0.897 0 C-N-CA 127.174 2.189 . . . . 0.0 108.712 -177.182 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 80.0 m -91.52 145.24 24.78 Favored 'General case' 0 C--N 1.357 0.899 0 C-N-CA 127.108 2.163 . . . . 0.0 112.414 -179.452 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 31.2 mt -123.65 145.01 45.95 Favored Pre-proline 0 C--N 1.36 1.035 0 C-N-CA 125.374 1.47 . . . . 0.0 111.013 176.667 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -86.55 145.12 7.97 Favored 'Trans proline' 0 C--N 1.348 0.513 0 C-N-CA 124.492 3.462 . . . . 0.0 111.842 169.603 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . 0.273 13.5 p90 -141.27 -160.03 1.03 Allowed 'General case' 0 C--N 1.344 0.332 0 N-CA-C 105.787 -1.931 . . . . 0.0 105.787 170.896 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 58.5 mt -141.56 154.5 45.5 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 104.756 -2.313 . . . . 0.0 104.756 175.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 3.3 t80 -115.46 129.11 56.45 Favored 'General case' 0 CA--C 1.567 1.628 0 C-N-CA 125.457 1.503 . . . . 0.0 110.767 177.833 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 49.1 m -98.73 16.06 23.34 Favored 'General case' 0 C--N 1.382 2.01 0 N-CA-C 115.262 1.579 . . . . 0.0 115.262 -178.766 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 76.53 -56.47 3.36 Favored Glycine 0 C--N 1.352 1.469 0 O-C-N 120.133 -1.604 . . . . 0.0 116.257 178.936 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 14.4 m -79.45 34.23 0.26 Allowed 'General case' 0 C--N 1.358 0.954 0 C-N-CA 127.574 2.35 . . . . 0.0 115.666 179.744 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 173.17 49.67 0.05 OUTLIER Glycine 0 CA--C 1.482 -1.976 0 O-C-N 120.556 -1.34 . . . . 0.0 114.078 174.607 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -104.53 128.06 9.32 Favored Glycine 0 C--N 1.354 1.572 0 N-CA-C 109.432 -1.467 . . . . 0.0 109.432 169.797 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 45.6 p30 -77.33 -57.5 3.8 Favored 'General case' 0 C--N 1.361 1.099 0 N-CA-C 116.331 1.974 . . . . 0.0 116.331 -178.668 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -177.35 -21.95 0.01 OUTLIER 'General case' 0 C--N 1.354 0.778 0 C-N-CA 126.886 2.074 . . . . 0.0 111.926 -178.286 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 39.3 t30 -96.96 89.24 4.77 Favored 'General case' 0 CA--C 1.555 1.146 0 O-C-N 119.283 -2.136 . . . . 0.0 116.416 -174.247 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . 0.355 0.0 OUTLIER -150.42 129.64 12.78 Favored 'General case' 0 C--N 1.355 0.833 0 O-C-N 120.689 -1.257 . . . . 0.0 110.42 168.033 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . 0.404 ' HB2' ' HB2' ' A' ' 23' ' ' PHE . 27.0 m-85 -99.89 150.98 21.83 Favored 'General case' 0 N--CA 1.447 -0.587 0 C-N-CA 126.46 1.904 . . . . 0.0 106.683 175.807 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -78.33 -38.33 42.46 Favored 'General case' 0 C--N 1.363 1.162 0 C-N-CA 125.718 1.607 . . . . 0.0 113.163 -178.299 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 75.5 p -129.95 165.31 22.36 Favored 'General case' 0 C--N 1.357 0.923 0 C-N-CA 125.189 1.395 . . . . 0.0 107.324 175.518 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 13.0 tt -71.98 -10.16 13.66 Favored 'Isoleucine or valine' 0 C--N 1.363 1.185 0 C-N-CA 126.501 1.92 . . . . 0.0 114.673 175.088 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -91.25 -10.62 62.11 Favored Glycine 0 C--N 1.365 2.181 0 O-C-N 120.178 -1.576 . . . . 0.0 114.101 176.664 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 -86.13 -41.16 14.96 Favored 'General case' 0 C--N 1.364 1.228 0 C-N-CA 125.81 1.644 . . . . 0.0 110.887 174.326 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . 0.258 4.1 t -42.51 -47.45 5.1 Favored 'General case' 0 C--N 1.365 1.267 0 C-N-CA 128.952 2.901 . . . . 0.0 116.306 -175.908 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 10.0 ptt180 -69.42 -19.79 63.79 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 129.646 3.178 . . . . 0.0 117.37 174.671 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 8.6 mptt -79.84 -6.12 56.76 Favored 'General case' 0 C--N 1.375 1.694 0 O-C-N 119.493 -2.005 . . . . 0.0 113.495 178.193 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.547 ' HD2' ' CD1' ' A' ' 6' ' ' TYR . 5.6 mtmm -111.16 -21.78 11.76 Favored 'General case' 0 C--N 1.354 0.773 0 O-C-N 120.32 -1.487 . . . . 0.0 110.38 176.816 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . 0.401 ' SG ' ' HB2' ' A' ' 6' ' ' TYR . 57.4 m -131.3 8.38 4.66 Favored 'General case' 0 C--N 1.364 1.224 0 N-CA-C 116.736 2.125 . . . . 0.0 116.736 -171.0 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 11.6 mt -130.91 -13.51 3.6 Favored 'General case' 0 N--CA 1.476 0.85 0 CA-C-N 123.64 2.927 . . . . 0.0 111.675 172.528 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 73.52 59.68 4.04 Favored Glycine 0 C--N 1.359 1.828 0 C-N-CA 127.999 2.714 . . . . 0.0 112.863 -169.601 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 19.2 mtpt . . . . . 0 C--O 1.262 1.762 0 C-N-CA 124.721 1.208 . . . . 0.0 107.767 -178.83 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 1' ' ' TRP . . . . . 0.435 ' CZ2' ' HB3' ' A' ' 3' ' ' PRO . 4.4 t90 . . . . . 0 N--CA 1.433 -1.298 0 N-CA-C 107.456 -1.313 . . . . 0.0 107.456 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 25.0 mm-40 -147.57 150.66 37.54 Favored Pre-proline 0 C--N 1.351 0.669 1 N-CA-C 98.281 -4.711 . . . . 0.0 98.281 173.674 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . 0.435 ' HB3' ' CZ2' ' A' ' 1' ' ' TRP . 66.2 Cg_endo -82.65 123.08 3.65 Favored 'Trans proline' 0 CA--C 1.558 1.717 0 CA-C-N 124.168 2.524 . . . . 0.0 114.906 -165.194 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 27.7 Cg_exo -73.79 -110.31 0.01 OUTLIER 'Trans proline' 0 C--N 1.365 1.416 1 C-N-CA 126.96 5.107 . . . . 0.0 112.827 173.088 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' TRP . . . . . 0.55 ' CE3' ' CD2' ' A' ' 6' ' ' TYR 0.298 17.5 p-90 -88.91 -76.52 0.4 Allowed 'General case' 0 C--N 1.375 1.687 0 N-CA-C 116.419 2.007 . . . . 0.0 116.419 178.968 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.565 ' CD2' ' HD2' ' A' ' 56' ' ' LYS . 0.0 OUTLIER -29.65 -51.88 0.12 Allowed 'General case' 0 C--N 1.36 1.062 1 C-N-CA 135.173 5.389 . . . . 0.0 118.404 -171.391 . . . . . . . . 4 4 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -53.12 -41.65 65.25 Favored 'General case' 0 N--CA 1.443 -0.795 1 C-N-CA 131.732 4.013 . . . . 0.0 112.503 178.739 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.82 17.56 21.7 Favored 'General case' 0 C--N 1.367 1.362 0 C-N-CA 127.366 2.266 . . . . 0.0 111.702 -178.451 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -93.61 133.11 28.61 Favored Pre-proline 0 C--N 1.361 1.108 0 CA-C-O 116.488 -1.72 . . . . 0.0 112.041 -173.172 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -70.24 125.95 12.45 Favored 'Trans proline' 0 CA--C 1.54 0.797 0 CA-C-N 125.276 2.92 . . . . 0.0 116.23 -164.73 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 10.1 p -68.9 139.73 20.04 Favored 'Isoleucine or valine' 0 C--N 1.367 1.339 0 C-N-CA 127.453 2.301 . . . . 0.0 114.041 178.582 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 61.8 mtt180 -145.73 120.61 9.97 Favored 'General case' 0 C--N 1.368 1.408 0 C-N-CA 126.297 1.839 . . . . 0.0 111.643 -173.487 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 14.4 tt -88.84 -32.33 5.8 Favored 'Isoleucine or valine' 0 C--N 1.371 1.532 0 CA-C-N 121.245 1.839 . . . . 0.0 113.783 179.691 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.351 1.393 0 C-N-CA 126.139 1.828 . . . . 0.0 115.279 179.902 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 53.8 tptt . . . . . 0 CA--C 1.519 -0.23 0 N-CA-C 101.682 -3.451 . . . . 0.0 101.682 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -118.54 105.52 11.73 Favored 'General case' 0 C--N 1.353 0.734 0 N-CA-C 106.488 -1.671 . . . . 0.0 106.488 173.181 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 22.5 m-85 -96.56 144.35 26.71 Favored 'General case' 0 C--N 1.362 1.116 0 C-N-CA 126.564 1.946 . . . . 0.0 109.77 -177.698 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 7.0 t -69.76 113.31 6.89 Favored 'General case' 0 C--N 1.369 1.441 0 N-CA-C 115.488 1.662 . . . . 0.0 115.488 -178.288 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 78.3 p -120.7 -166.25 1.31 Allowed 'General case' 0 C--N 1.359 0.988 0 C-N-CA 126.321 1.849 . . . . 0.0 113.431 -179.396 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 29.6 m-85 -148.35 149.58 32.05 Favored 'General case' 0 C--N 1.359 0.986 1 C-N-CA 131.877 4.071 . . . . 0.0 109.008 174.487 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 10.5 p90 -144.11 150.8 38.69 Favored 'General case' 0 C--N 1.362 1.113 0 C-N-CA 127.96 2.504 . . . . 0.0 110.986 175.685 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 9.2 t80 -98.24 119.1 36.32 Favored 'General case' 0 C--N 1.381 1.951 0 N-CA-C 106.916 -1.512 . . . . 0.0 106.916 177.071 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 9.4 tptt -103.74 110.44 22.54 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 125.538 1.535 . . . . 0.0 109.124 -179.256 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 33.2 t-105 -44.99 -49.88 10.98 Favored 'General case' 0 C--N 1.362 1.142 0 C-N-CA 131.14 3.776 . . . . 0.0 117.695 176.502 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 10.8 p -82.46 3.75 26.99 Favored 'General case' 0 C--N 1.36 1.059 0 C-N-CA 125.973 1.709 . . . . 0.0 113.617 -179.565 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -107.25 -46.49 3.87 Favored 'General case' 0 C--N 1.357 0.929 0 C-N-CA 125.604 1.562 . . . . 0.0 108.49 173.114 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . 0.309 0.2 OUTLIER 81.11 24.6 0.27 Allowed 'General case' 0 C--N 1.367 1.346 0 C-N-CA 128.845 2.858 . . . . 0.0 112.352 179.098 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 83.0 tttt -149.82 163.83 36.97 Favored 'General case' 0 N--CA 1.441 -0.902 0 N-CA-C 106.178 -1.786 . . . . 0.0 106.178 179.573 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 89.6 m -79.27 130.07 35.09 Favored 'General case' 0 C--N 1.358 0.957 0 C-N-CA 128.169 2.588 . . . . 0.0 113.927 175.805 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 80.8 mt -120.87 147.9 47.25 Favored Pre-proline 0 C--N 1.355 0.807 0 C-N-CA 124.591 1.157 . . . . 0.0 110.172 179.883 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -85.87 125.14 2.7 Favored 'Trans proline' 0 C--N 1.351 0.666 0 C-N-CA 124.454 3.436 . . . . 0.0 111.587 173.248 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -114.87 -168.86 1.44 Allowed 'General case' 0 C--N 1.354 0.764 0 N-CA-C 103.962 -2.607 . . . . 0.0 103.962 167.34 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 19.6 mt -119.25 155.82 31.05 Favored 'General case' 0 N--CA 1.441 -0.922 0 O-C-N 119.324 -2.11 . . . . 0.0 106.493 175.248 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 22.0 t80 -117.69 137.36 52.72 Favored 'General case' 0 N--CA 1.471 0.611 0 O-C-N 121.055 -1.028 . . . . 0.0 110.187 175.295 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 2.8 t -111.78 37.13 3.03 Favored 'General case' 0 C--N 1.375 1.715 0 N-CA-C 114.758 1.392 . . . . 0.0 114.758 175.721 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 72.29 -45.25 0.96 Allowed Glycine 0 C--N 1.36 1.897 0 N-CA-C 121.329 3.292 . . . . 0.0 121.329 161.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -116.43 165.94 12.64 Favored 'General case' 0 C--N 1.347 0.487 0 C-N-CA 126.694 1.998 . . . . 0.0 105.654 173.869 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 90.26 -33.63 4.45 Favored Glycine 0 N--CA 1.484 1.89 0 O-C-N 119.565 -1.959 . . . . 0.0 116.027 177.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -60.59 -174.51 1.11 Allowed Glycine 0 C--N 1.37 2.43 0 N-CA-C 120.696 3.039 . . . . 0.0 120.696 179.76 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . 0.516 ' H ' ' NH1' ' A' ' 46' ' ' ARG 0.272 26.2 p30 -136.39 -103.78 0.21 Allowed 'General case' 0 C--N 1.355 0.813 0 O-C-N 120.779 -1.424 . . . . 0.0 112.818 -179.648 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -155.33 5.03 0.21 Allowed 'General case' 0 C--N 1.35 0.627 0 O-C-N 120.873 -1.142 . . . . 0.0 113.271 -173.672 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 49.3 t30 -95.88 53.55 1.42 Allowed 'General case' 0 C--N 1.365 1.241 0 O-C-N 118.766 -2.459 . . . . 0.0 108.172 175.109 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.516 ' NH1' ' H ' ' A' ' 43' ' ' ASN . 0.0 OUTLIER -139.94 144.25 37.0 Favored 'General case' 0 N--CA 1.443 -0.798 0 N-CA-C 107.862 -1.162 . . . . 0.0 107.862 -177.463 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 52.8 m-85 -131.1 134.01 46.19 Favored 'General case' 0 N--CA 1.449 -0.494 0 C-N-CA 127.705 2.402 . . . . 0.0 107.358 -169.856 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.69 -16.93 61.67 Favored 'General case' 0 C--N 1.373 1.625 0 N-CA-C 116.699 2.111 . . . . 0.0 116.699 -177.35 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 40.9 p -146.29 -176.97 5.38 Favored 'General case' 0 C--N 1.352 0.685 0 N-CA-C 103.752 -2.684 . . . . 0.0 103.752 177.267 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 15.0 tt -76.59 -27.07 16.89 Favored 'Isoleucine or valine' 0 C--N 1.367 1.343 0 O-C-N 120.081 -1.637 . . . . 0.0 114.072 175.794 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -90.4 20.57 36.91 Favored Glycine 0 C--N 1.365 2.185 0 O-C-N 120.598 -1.314 . . . . 0.0 115.486 -171.688 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -112.87 -14.77 13.02 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 126.82 2.048 . . . . 0.0 108.587 171.51 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 15.9 t -87.07 -43.29 12.42 Favored 'General case' 0 C--N 1.361 1.067 0 C-N-CA 126.989 2.116 . . . . 0.0 115.748 -174.775 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.403 ' HB2' ' HD3' ' A' ' 60' ' ' LYS 0.301 0.0 OUTLIER -82.51 -24.75 33.98 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 126.623 1.969 . . . . 0.0 115.07 -175.546 . . . . . . . . 4 4 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 28.2 ttmt -71.88 -15.98 62.12 Favored 'General case' 0 C--N 1.357 0.925 0 C-N-CA 127.497 2.319 . . . . 0.0 115.564 176.61 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.565 ' HD2' ' CD2' ' A' ' 6' ' ' TYR . 9.3 mtmm -100.81 -24.9 14.29 Favored 'General case' 0 C--N 1.36 1.058 0 C-N-CA 126.31 1.844 . . . . 0.0 112.357 175.458 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 43.6 m -137.54 26.68 2.82 Favored 'General case' 0 C--N 1.355 0.825 0 N-CA-C 116.935 2.198 . . . . 0.0 116.935 -167.305 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 16.7 mt -146.0 -23.73 0.45 Allowed 'General case' 0 N--CA 1.471 0.625 0 CA-C-N 120.546 1.521 . . . . 0.0 112.396 170.924 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 82.43 63.26 1.79 Allowed Glycine 0 C--N 1.36 1.904 0 C-N-CA 128.561 2.981 . . . . 0.0 112.576 -168.323 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . 0.403 ' HD3' ' HB2' ' A' ' 54' ' ' ARG . 14.0 ptmt . . . . . 0 C--O 1.258 1.55 0 CA-C-O 116.284 -1.817 . . . . 0.0 106.723 -176.088 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 70.0 t90 . . . . . 0 N--CA 1.433 -1.281 0 N-CA-C 106.541 -1.651 . . . . 0.0 106.541 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 68.1 mt-30 -144.11 152.32 54.34 Favored Pre-proline 0 CA--C 1.512 -0.489 1 N-CA-C 97.996 -4.816 . . . . 0.0 97.996 172.352 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . 0.417 ' HA ' ' HD3' ' A' ' 4' ' ' PRO . 1.5 Cg_endo -79.83 122.16 4.8 Favored 'Trans proline' 0 N--CA 1.452 -0.956 0 CA-C-N 124.207 2.538 . . . . 0.0 112.618 -170.351 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . 0.417 ' HD3' ' HA ' ' A' ' 3' ' ' PRO . 16.2 Cg_exo -85.25 -116.08 0.01 OUTLIER 'Trans proline' 0 C--N 1.359 1.103 0 C-N-CA 124.913 3.742 . . . . 0.0 111.185 179.677 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' TRP . . . . . 0.501 ' CE2' ' CE2' ' A' ' 6' ' ' TYR . 42.6 p-90 -81.72 -72.53 0.43 Allowed 'General case' 0 C--N 1.375 1.68 0 C-N-CA 124.941 1.296 . . . . 0.0 114.021 -179.746 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.501 ' CE2' ' CE2' ' A' ' 5' ' ' TRP . 0.0 OUTLIER -33.35 -43.89 0.12 Allowed 'General case' 0 C--N 1.361 1.09 1 C-N-CA 134.273 5.029 . . . . 0.0 117.206 -179.853 . . . . . . . . 4 4 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.5 m -83.19 -15.72 49.39 Favored 'General case' 0 N--CA 1.44 -0.956 0 C-N-CA 127.636 2.374 . . . . 0.0 114.173 -173.728 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 67.8 mttm -125.52 32.23 5.37 Favored 'General case' 0 C--N 1.357 0.928 0 C-N-CA 126.892 2.077 . . . . 0.0 105.904 178.537 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 5.9 tm-20 -94.15 141.38 23.54 Favored Pre-proline 0 C--N 1.366 1.3 0 C-N-CA 125.106 1.362 . . . . 0.0 109.862 -176.299 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -89.84 142.37 3.97 Favored 'Trans proline' 0 N--CA 1.448 -1.16 0 C-N-CA 124.858 3.706 . . . . 0.0 108.074 177.609 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . 0.397 3.0 p -77.05 122.32 31.33 Favored 'Isoleucine or valine' 0 C--N 1.362 1.141 0 O-C-N 119.21 -2.182 . . . . 0.0 116.559 -173.659 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.474 ' CZ ' HD21 ' A' ' 43' ' ' ASN . 11.0 mtm-85 -102.78 117.73 35.29 Favored 'General case' 0 N--CA 1.443 -0.809 0 C-N-CA 129.855 3.262 . . . . 0.0 109.778 -179.454 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 10.2 tt -90.52 -31.82 5.25 Favored 'Isoleucine or valine' 0 C--N 1.366 1.294 0 CA-C-N 121.103 1.774 . . . . 0.0 111.09 171.535 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.358 1.773 0 C-N-CA 123.933 0.778 . . . . 0.0 114.087 -177.621 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.503 -0.852 0 N-CA-C 100.831 -3.766 . . . . 0.0 100.831 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 7.1 mm-40 -92.82 113.25 25.47 Favored 'General case' 0 C--N 1.356 0.873 0 N-CA-C 106.699 -1.593 . . . . 0.0 106.699 -178.21 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 67.2 m-85 -106.98 141.85 37.53 Favored 'General case' 0 C--N 1.355 0.845 0 C-N-CA 125.147 1.379 . . . . 0.0 110.674 -174.435 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 24.6 t -70.5 104.62 2.81 Favored 'General case' 0 C--N 1.368 1.389 0 C-N-CA 125.704 1.602 . . . . 0.0 112.686 177.826 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 64.7 p -99.75 -161.17 0.85 Allowed 'General case' 0 C--N 1.349 0.544 0 C-N-CA 125.802 1.641 . . . . 0.0 112.151 177.866 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . 0.438 ' HB2' ' HB2' ' A' ' 47' ' ' PHE . 98.8 m-85 -148.2 132.99 17.96 Favored 'General case' 0 C--N 1.355 0.818 0 C-N-CA 127.237 2.215 . . . . 0.0 105.633 169.69 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 13.2 p90 -125.73 150.36 47.77 Favored 'General case' 0 CA--C 1.516 -0.327 0 C-N-CA 125.676 1.59 . . . . 0.0 109.638 177.414 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 10.8 t80 -91.01 118.97 30.81 Favored 'General case' 0 C--N 1.367 1.369 0 N-CA-C 103.447 -2.797 . . . . 0.0 103.447 176.921 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.94 115.86 27.98 Favored 'General case' 0 N--CA 1.431 -1.413 0 C-N-CA 123.236 0.615 . . . . 0.0 109.727 -176.895 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 48.1 t-105 -51.46 -45.75 62.83 Favored 'General case' 0 C--N 1.366 1.284 0 C-N-CA 128.628 2.771 . . . . 0.0 117.788 -178.324 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 17.3 p -84.75 -3.66 58.69 Favored 'General case' 0 C--N 1.352 0.676 0 C-N-CA 124.64 1.176 . . . . 0.0 113.778 179.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -100.79 -45.97 5.3 Favored 'General case' 0 C--N 1.361 1.085 0 C-N-CA 124.641 1.176 . . . . 0.0 113.631 176.675 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . 0.316 67.2 mmtt 85.15 20.55 0.11 Allowed 'General case' 0 C--N 1.368 1.383 0 C-N-CA 128.757 2.823 . . . . 0.0 112.161 -176.312 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.495 ' NZ ' ' H ' ' A' ' 32' ' ' CYS . 2.4 mmmp? -145.64 179.33 7.5 Favored 'General case' 0 C--N 1.355 0.812 0 C-N-CA 128.197 2.599 . . . . 0.0 109.979 -179.771 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.495 ' H ' ' NZ ' ' A' ' 31' ' ' LYS . 73.9 m -105.93 129.51 54.06 Favored 'General case' 0 C--N 1.358 0.977 0 C-N-CA 127.991 2.516 . . . . 0.0 115.085 -171.602 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 59.2 mt -120.37 144.55 38.45 Favored Pre-proline 0 C--N 1.357 0.916 0 O-C-N 119.707 -1.871 . . . . 0.0 110.505 -179.899 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_endo -81.39 110.19 2.19 Favored 'Trans proline' 0 C--N 1.351 0.677 0 C-N-CA 124.879 3.719 . . . . 0.0 113.797 176.414 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . 0.293 2.8 p90 -102.71 168.59 9.15 Favored 'General case' 0 C--N 1.363 1.175 0 CA-C-O 122.115 0.959 . . . . 0.0 109.751 174.644 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 61.0 mt -94.78 125.3 39.34 Favored 'General case' 0 C--N 1.351 0.634 0 N-CA-C 107.357 -1.349 . . . . 0.0 107.357 174.021 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 5.4 t80 -112.74 137.11 51.54 Favored 'General case' 0 C--N 1.35 0.603 0 C-N-CA 125.333 1.453 . . . . 0.0 109.055 179.31 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -90.77 9.97 27.92 Favored 'General case' 0 C--N 1.371 1.503 0 N-CA-C 116.758 2.132 . . . . 0.0 116.758 -177.318 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 93.4 -44.05 2.47 Favored Glycine 0 C--N 1.361 1.922 0 N-CA-C 119.056 2.383 . . . . 0.0 119.056 168.46 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -124.15 145.7 49.13 Favored 'General case' 0 C--N 1.35 0.603 0 N-CA-C 106.242 -1.762 . . . . 0.0 106.242 175.348 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 117.54 -41.06 2.16 Favored Glycine 0 C--N 1.361 1.932 0 C-N-CA 124.462 1.029 . . . . 0.0 113.744 -179.541 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -67.18 -171.23 4.9 Favored Glycine 0 C--N 1.36 1.878 0 N-CA-C 122.305 3.682 . . . . 0.0 122.305 -176.292 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . 0.474 HD21 ' CZ ' ' A' ' 12' ' ' ARG . 6.8 p30 -124.87 -115.75 0.29 Allowed 'General case' 0 C--N 1.359 1.002 0 C-N-CA 125.201 1.4 . . . . 0.0 111.214 -178.921 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -141.49 19.61 2.21 Favored 'General case' 0 C--N 1.364 1.232 0 O-C-N 119.952 -1.717 . . . . 0.0 112.483 178.271 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 49.9 t30 -91.25 36.59 0.93 Allowed 'General case' 0 CA--C 1.564 1.515 0 O-C-N 119.919 -1.738 . . . . 0.0 108.892 172.318 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.408 HH22 ' HB2' ' A' ' 12' ' ' ARG . 0.0 OUTLIER -137.91 97.81 3.5 Favored 'General case' 0 C--N 1.361 1.091 0 C-N-CA 127.839 2.456 . . . . 0.0 105.982 -178.341 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . 0.438 ' HB2' ' HB2' ' A' ' 23' ' ' PHE . 24.7 m-85 -94.24 153.22 18.16 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 111.679 -2.51 . . . . 0.0 111.895 -169.47 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . 0.262 0.0 OUTLIER -68.86 -43.56 75.14 Favored 'General case' 0 C--N 1.376 1.736 0 C-N-CA 125.786 1.635 . . . . 0.0 114.762 -179.806 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 72.2 p -137.88 162.28 34.42 Favored 'General case' 0 C--N 1.351 0.632 0 C-N-CA 127.996 2.518 . . . . 0.0 105.396 177.382 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 15.0 tt -66.45 -11.13 12.64 Favored 'Isoleucine or valine' 0 C--N 1.36 1.054 0 C-N-CA 127.577 2.351 . . . . 0.0 116.324 178.269 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -90.56 -9.09 65.07 Favored Glycine 0 C--N 1.367 2.295 0 C-N-CA 125.532 1.539 . . . . 0.0 114.259 174.385 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 12.8 tt0 -92.72 -14.09 28.45 Favored 'General case' 0 C--N 1.358 0.948 0 C-N-CA 125.304 1.442 . . . . 0.0 112.414 176.875 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . 0.426 ' HA ' ' CD2' ' A' ' 47' ' ' PHE . 40.6 t -64.97 -41.28 95.58 Favored 'General case' 0 C--N 1.361 1.1 0 C-N-CA 129.137 2.975 . . . . 0.0 114.911 179.791 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 12.0 mtp180 -71.15 -21.41 62.18 Favored 'General case' 0 CA--C 1.532 0.282 1 C-N-CA 134.323 5.049 . . . . 0.0 115.767 178.595 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 49.1 mtmt -82.89 -19.79 36.69 Favored 'General case' 0 C--N 1.36 1.025 0 O-C-N 120.235 -1.541 . . . . 0.0 114.004 -178.796 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.477 ' HD2' ' CD2' ' A' ' 6' ' ' TYR . 10.6 mtmm -100.4 -30.18 11.98 Favored 'General case' 0 C--N 1.361 1.097 0 C-N-CA 126.711 2.005 . . . . 0.0 109.553 174.241 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . 0.485 ' SG ' ' HB2' ' A' ' 6' ' ' TYR . 96.3 m -124.32 10.08 8.6 Favored 'General case' 0 C--N 1.359 0.989 0 N-CA-C 119.737 3.236 . . . . 0.0 119.737 -172.654 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . 0.259 15.6 mt -131.86 -11.13 3.43 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-N 125.081 3.582 . . . . 0.0 113.065 169.233 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 70.61 52.17 17.2 Favored Glycine 0 C--N 1.365 2.179 0 C-N-CA 128.606 3.003 . . . . 0.0 113.43 -172.869 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 13.6 ptpt . . . . . 0 C--O 1.262 1.725 0 N-CA-C 104.959 -2.238 . . . . 0.0 104.959 -175.064 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 1' ' ' TRP . . . . . 0.457 ' CZ2' ' HA ' ' A' ' 3' ' ' PRO . 83.4 t90 . . . . . 0 N--CA 1.435 -1.182 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 23.6 mm-40 -147.35 154.58 45.68 Favored Pre-proline 0 C--N 1.352 0.683 1 N-CA-C 98.905 -4.48 . . . . 0.0 98.905 171.45 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . 0.457 ' HA ' ' CZ2' ' A' ' 1' ' ' TRP . 3.2 Cg_exo -79.71 118.34 3.81 Favored 'Trans proline' 0 CA--C 1.541 0.844 0 CA-C-N 124.974 2.812 . . . . 0.0 114.335 -167.174 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . 0.405 ' HD3' ' HA ' ' A' ' 3' ' ' PRO . 14.0 Cg_exo -88.63 -109.42 0.0 OUTLIER 'Trans proline' 0 C--N 1.365 1.407 0 C-N-CA 125.045 3.83 . . . . 0.0 110.184 -175.953 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' TRP . . . . . 0.468 ' CE3' ' CD2' ' A' ' 6' ' ' TYR 0.272 45.1 p-90 -88.25 -72.26 0.54 Allowed 'General case' 0 C--N 1.372 1.558 0 N-CA-C 116.188 1.922 . . . . 0.0 116.188 -179.476 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.468 ' CD2' ' CE3' ' A' ' 5' ' ' TRP . 0.0 OUTLIER -30.85 -49.67 0.13 Allowed 'General case' 0 C--N 1.359 0.981 1 C-N-CA 135.672 5.589 . . . . 0.0 118.182 -175.667 . . . . . . . . 4 4 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.8 m -57.99 -40.96 82.0 Favored 'General case' 0 C--N 1.349 0.572 0 C-N-CA 127.657 2.383 . . . . 0.0 114.116 -176.811 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 24.4 mtpp -105.55 22.26 15.8 Favored 'General case' 0 C--N 1.363 1.163 0 C-N-CA 126.283 1.833 . . . . 0.0 110.255 177.049 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -93.91 123.1 60.49 Favored Pre-proline 0 C--N 1.369 1.439 0 O-C-N 119.685 -1.885 . . . . 0.0 110.295 -174.709 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 80.3 Cg_exo -59.1 124.48 15.74 Favored 'Trans proline' 0 C--N 1.36 1.155 0 C-N-CA 124.758 3.639 . . . . 0.0 116.766 -165.023 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 9.9 p -88.02 126.66 41.45 Favored 'Isoleucine or valine' 0 C--N 1.37 1.479 0 C-N-CA 124.997 1.319 . . . . 0.0 111.328 -179.818 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.54 ' HB2' HH21 ' A' ' 46' ' ' ARG . 32.6 mtt180 -134.76 135.61 42.01 Favored 'General case' 0 N--CA 1.438 -1.047 0 C-N-CA 128.423 2.689 . . . . 0.0 111.158 -175.436 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 11.9 tt -95.41 -39.25 9.62 Favored 'Isoleucine or valine' 0 C--N 1.37 1.487 0 C-N-CA 127.428 2.291 . . . . 0.0 112.58 175.598 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.364 2.085 0 C-N-CA 128.022 2.725 . . . . 0.0 116.983 -174.229 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 14.5 ptmm? . . . . . 0 CA--C 1.506 -0.745 0 N-CA-C 103.643 -2.725 . . . . 0.0 103.643 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.6 mm100 -93.27 108.81 20.37 Favored 'General case' 0 C--N 1.358 0.941 0 O-C-N 120.397 -1.439 . . . . 0.0 110.985 -176.577 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 83.1 m-85 -95.34 155.06 16.9 Favored 'General case' 0 C--N 1.354 0.803 0 C-N-CA 126.796 2.038 . . . . 0.0 109.638 -176.2 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 11.3 t -71.08 116.3 11.21 Favored 'General case' 0 C--N 1.369 1.416 0 C-N-CA 127.095 2.158 . . . . 0.0 114.35 -178.589 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 51.5 p -141.58 171.33 14.21 Favored 'General case' 0 C--N 1.353 0.749 0 N-CA-C 114.934 1.457 . . . . 0.0 114.934 -175.038 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 82.2 m-85 -135.88 158.11 45.19 Favored 'General case' 0 C--N 1.354 0.77 0 C-N-CA 128.839 2.856 . . . . 0.0 111.853 177.709 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 23.0 p90 -147.47 156.03 42.47 Favored 'General case' 0 C--N 1.368 1.406 0 C-N-CA 126.412 1.885 . . . . 0.0 110.771 176.029 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . 0.423 ' CD2' ' HB2' ' A' ' 57' ' ' CYS . 5.4 t80 -94.82 128.53 41.63 Favored 'General case' 0 C--N 1.376 1.728 0 N-CA-C 106.334 -1.728 . . . . 0.0 106.334 172.392 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -107.42 113.66 27.16 Favored 'General case' 0 N--CA 1.426 -1.638 0 C-N-CA 126.844 2.058 . . . . 0.0 108.135 -176.709 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 32.0 t-105 -49.46 -55.74 12.13 Favored 'General case' 0 C--N 1.359 0.998 0 C-N-CA 130.649 3.58 . . . . 0.0 117.942 -178.27 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.9 p -77.41 -14.72 59.64 Favored 'General case' 0 C--N 1.358 0.954 0 C-N-CA 126.327 1.851 . . . . 0.0 113.503 -178.347 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -88.35 -38.59 15.01 Favored 'General case' 0 C--N 1.363 1.17 0 C-N-CA 124.359 1.064 . . . . 0.0 111.732 174.317 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 60.2 mmtt 74.24 21.51 2.44 Favored 'General case' 0 C--N 1.372 1.548 0 C-N-CA 126.964 2.105 . . . . 0.0 112.682 -179.295 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 38.2 ttpt -147.76 166.92 26.06 Favored 'General case' 0 N--CA 1.437 -1.124 0 C-N-CA 126.852 2.061 . . . . 0.0 106.967 -174.433 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 74.9 m -90.94 144.84 25.26 Favored 'General case' 0 C--N 1.361 1.07 0 C-N-CA 126.044 1.738 . . . . 0.0 112.705 178.187 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 89.3 mt -131.87 148.88 71.66 Favored Pre-proline 0 C--N 1.36 1.052 0 C-N-CA 126.855 2.062 . . . . 0.0 109.559 179.238 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -83.98 152.01 12.7 Favored 'Trans proline' 0 C--N 1.352 0.735 0 C-N-CA 124.776 3.65 . . . . 0.0 111.591 166.532 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.459 ' CZ ' ' HD2' ' A' ' 46' ' ' ARG 0.317 0.8 OUTLIER -138.49 -156.22 0.67 Allowed 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 104.085 -2.561 . . . . 0.0 104.085 170.269 . . . . . . . . 4 4 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 48.1 mt -141.08 148.75 40.66 Favored 'General case' 0 CA--C 1.502 -0.901 1 N-CA-C 99.761 -4.163 . . . . 0.0 99.761 176.241 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -124.07 135.65 53.71 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 119.705 1.139 . . . . 0.0 109.759 -178.123 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.9 m -79.68 -10.76 59.84 Favored 'General case' 0 C--N 1.369 1.437 0 N-CA-C 119.433 3.124 . . . . 0.0 119.433 -176.592 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 128.79 -59.14 0.69 Allowed Glycine 0 C--N 1.358 1.795 0 CA-C-N 121.803 2.092 . . . . 0.0 114.464 -178.087 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 30.8 p -144.15 56.82 1.32 Allowed 'General case' 0 C--N 1.35 0.594 0 C-N-CA 125.794 1.638 . . . . 0.0 106.856 -179.364 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -121.16 -48.36 0.29 Allowed Glycine 0 C--N 1.356 1.641 0 C-N-CA 125.637 1.589 . . . . 0.0 110.002 -177.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -83.2 153.99 31.22 Favored Glycine 0 C--N 1.361 1.928 0 N-CA-C 116.048 1.179 . . . . 0.0 116.048 177.256 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . 0.507 ' H ' ' NH2' ' A' ' 46' ' ' ARG 0.422 10.2 p30 -95.3 -101.25 0.16 Allowed 'General case' 0 CA--C 1.55 0.947 0 N-CA-C 115.676 1.732 . . . . 0.0 115.676 179.696 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -129.39 9.08 5.55 Favored 'General case' 0 C--N 1.369 1.421 0 N-CA-C 117.476 2.399 . . . . 0.0 117.476 -170.341 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 33.7 t30 -109.65 30.29 6.79 Favored 'General case' 0 C--N 1.364 1.224 0 O-C-N 119.761 -1.837 . . . . 0.0 106.642 176.223 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.54 HH21 ' HB2' ' A' ' 12' ' ' ARG . 43.2 mmt-85 -111.42 123.2 49.74 Favored 'General case' 0 C--N 1.368 1.4 0 CA-C-O 124.821 2.248 . . . . 0.0 109.702 -177.59 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . 0.403 ' CE2' ' HA ' ' A' ' 53' ' ' CYS . 15.6 m-85 -113.55 148.28 36.41 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-N 112.207 -2.27 . . . . 0.0 112.167 -172.494 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -82.79 -27.64 30.82 Favored 'General case' 0 C--N 1.37 1.484 0 C-N-CA 125.931 1.692 . . . . 0.0 114.621 -179.85 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 61.9 p -137.65 173.54 11.54 Favored 'General case' 0 C--N 1.356 0.872 0 N-CA-C 106.588 -1.634 . . . . 0.0 106.588 177.827 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 14.0 tt -67.51 -27.96 40.37 Favored 'Isoleucine or valine' 0 C--N 1.365 1.26 0 C-N-CA 128.226 2.61 . . . . 0.0 114.764 179.003 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -94.35 5.3 70.91 Favored Glycine 0 C--N 1.361 1.947 0 O-C-N 121.251 -0.905 . . . . 0.0 114.464 -173.339 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -91.71 -21.96 20.46 Favored 'General case' 0 C--N 1.359 0.981 0 CA-C-O 122.227 1.013 . . . . 0.0 110.213 172.745 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . 0.403 ' HA ' ' CE2' ' A' ' 47' ' ' PHE . 40.0 t -64.41 -51.75 61.65 Favored 'General case' 0 C--N 1.359 1.012 0 C-N-CA 130.101 3.36 . . . . 0.0 116.593 -178.709 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 4.4 mtp180 -68.65 -29.7 68.24 Favored 'General case' 0 C--N 1.344 0.334 1 C-N-CA 132.051 4.14 . . . . 0.0 116.915 -175.883 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 56.9 tttm -78.72 -10.15 59.66 Favored 'General case' 0 C--N 1.357 0.934 0 C-N-CA 126.625 1.97 . . . . 0.0 113.937 -179.759 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.452 ' HB3' ' CG ' ' A' ' 6' ' ' TYR . 31.6 mttt -98.4 -36.42 9.97 Favored 'General case' 0 C--N 1.359 1.004 0 C-N-CA 127.217 2.207 . . . . 0.0 111.39 175.946 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . 0.423 ' HB2' ' CD2' ' A' ' 25' ' ' PHE . 27.8 m -126.52 15.43 7.64 Favored 'General case' 0 C--N 1.357 0.902 0 N-CA-C 118.147 2.647 . . . . 0.0 118.147 -168.763 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 18.3 mt -140.47 -20.07 0.85 Allowed 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 122.596 2.453 . . . . 0.0 113.631 174.915 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 82.69 56.58 2.75 Favored Glycine 0 C--N 1.363 2.081 0 C-N-CA 126.794 2.14 . . . . 0.0 112.279 -172.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 15.9 ptmt . . . . . 0 C--O 1.261 1.697 0 CA-C-O 116.62 -1.657 . . . . 0.0 107.394 -175.294 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 21.0 t90 . . . . . 0 N--CA 1.436 -1.165 0 CA-C-O 122.721 1.248 . . . . 0.0 110.397 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 80.7 mt-30 -140.23 151.99 65.94 Favored Pre-proline 0 C--N 1.357 0.896 1 N-CA-C 99.264 -4.347 . . . . 0.0 99.264 172.482 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 4.8 Cg_exo -81.2 117.69 3.2 Favored 'Trans proline' 0 CA--C 1.551 1.341 0 CA-C-N 126.14 3.228 . . . . 0.0 117.047 -164.275 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_exo -77.56 -117.01 0.01 OUTLIER 'Trans proline' 0 C--N 1.366 1.454 1 C-N-CA 126.003 4.469 . . . . 0.0 114.199 176.931 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' TRP . . . . . 0.483 ' CE2' ' CE1' ' A' ' 6' ' ' TYR . 52.0 p-90 -87.22 -68.01 0.78 Allowed 'General case' 0 C--N 1.374 1.657 0 C-N-CA 126.339 1.856 . . . . 0.0 115.011 -179.565 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.542 ' CD1' ' HD2' ' A' ' 56' ' ' LYS . 0.1 OUTLIER -31.73 -60.53 0.24 Allowed 'General case' 0 C--N 1.359 0.985 1 C-N-CA 134.296 5.038 . . . . 0.0 118.58 -173.818 . . . . . . . . 4 4 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 3.3 m -52.87 -40.24 63.27 Favored 'General case' 0 CA--C 1.497 -1.07 1 C-N-CA 131.987 4.115 . . . . 0.0 116.34 -176.129 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . 0.273 57.0 tttm -113.87 22.11 14.28 Favored 'General case' 0 N--CA 1.428 -1.569 0 C-N-CA 128.385 2.674 . . . . 0.0 108.166 -174.404 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 14.6 tp10 -95.36 138.74 21.85 Favored Pre-proline 0 C--N 1.374 1.64 0 O-C-N 120.325 -1.484 . . . . 0.0 112.148 -174.327 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_exo -70.05 110.18 2.55 Favored 'Trans proline' 0 C--N 1.363 1.333 0 C-N-CA 124.227 3.285 . . . . 0.0 112.555 -174.518 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 8.6 p -72.95 132.13 33.86 Favored 'Isoleucine or valine' 0 C--N 1.36 1.031 0 C-N-CA 128.057 2.543 . . . . 0.0 110.519 178.303 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . 0.252 41.1 mmt-85 -132.28 136.54 47.01 Favored 'General case' 0 CA--C 1.496 -1.123 0 C-N-CA 126.16 1.784 . . . . 0.0 106.645 -169.87 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.302 16.7 tt -97.67 -41.01 10.51 Favored 'Isoleucine or valine' 0 C--N 1.37 1.473 0 CA-C-N 119.924 1.238 . . . . 0.0 111.494 175.279 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.362 1.982 0 C-N-CA 124.351 0.977 . . . . 0.0 115.303 172.914 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 1.5 tpmt? . . . . . 0 N--CA 1.445 -0.711 0 CA-C-O 121.381 0.61 . . . . 0.0 109.809 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 13.8 mm-40 -147.06 112.43 5.56 Favored 'General case' 0 N--CA 1.441 -0.907 0 C-N-CA 128.767 2.827 . . . . 0.0 105.104 169.357 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 82.9 m-85 -104.63 133.02 50.18 Favored 'General case' 0 C--N 1.354 0.768 0 O-C-N 119.886 -1.759 . . . . 0.0 107.609 174.424 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' SER . . . . . 0.415 ' HA ' ' HG ' ' A' ' 36' ' ' LEU . 5.1 t -69.49 125.72 27.58 Favored 'General case' 0 C--N 1.377 1.777 0 CA-C-N 122.179 2.263 . . . . 0.0 115.337 179.831 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 4.5 p -138.49 -169.37 2.58 Favored 'General case' 0 C--N 1.352 0.691 0 C-N-CA 128.043 2.537 . . . . 0.0 111.805 -173.297 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 79.9 m-85 -140.3 153.03 46.32 Favored 'General case' 0 C--N 1.359 0.979 0 C-N-CA 129.569 3.148 . . . . 0.0 112.008 176.042 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . 0.288 4.1 p90 -144.18 163.48 33.48 Favored 'General case' 0 C--N 1.376 1.73 0 C-N-CA 127.038 2.135 . . . . 0.0 109.816 170.683 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 16.0 t80 -99.53 128.32 45.63 Favored 'General case' 0 C--N 1.369 1.418 0 C-N-CA 125.693 1.597 . . . . 0.0 108.918 -179.07 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.486 ' NZ ' ' H ' ' A' ' 28' ' ' THR . 0.0 OUTLIER -91.29 112.17 23.97 Favored 'General case' 0 C--N 1.372 1.569 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 175.25 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' TRP . . . . . 0.472 ' N ' ' HZ3' ' A' ' 26' ' ' LYS . 16.9 t-105 -61.29 -40.67 95.01 Favored 'General case' 0 C--N 1.349 0.552 0 C-N-CA 128.918 2.887 . . . . 0.0 115.057 177.813 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' THR . . . . . 0.486 ' H ' ' NZ ' ' A' ' 26' ' ' LYS 0.318 46.4 p -83.24 -25.54 31.59 Favored 'General case' 0 C--N 1.36 1.03 0 C-N-CA 123.626 0.771 . . . . 0.0 112.504 176.402 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -82.19 -39.76 22.69 Favored 'General case' 0 C--N 1.379 1.864 0 CA-C-N 120.826 1.648 . . . . 0.0 114.036 172.351 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . 0.274 24.3 tptt 84.09 25.77 0.1 Allowed 'General case' 0 C--N 1.365 1.269 0 C-N-CA 129.007 2.923 . . . . 0.0 113.417 178.841 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.418 ' HZ2' ' HB2' ' A' ' 32' ' ' CYS . 23.6 tptp -147.39 170.39 17.46 Favored 'General case' 0 C--N 1.357 0.895 0 C-N-CA 126.035 1.734 . . . . 0.0 106.786 179.822 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.418 ' HB2' ' HZ2' ' A' ' 31' ' ' LYS . 78.8 m -85.61 142.16 29.29 Favored 'General case' 0 C--N 1.355 0.824 0 C-N-CA 127.786 2.434 . . . . 0.0 113.458 179.991 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 13.8 mt -127.14 149.71 70.24 Favored Pre-proline 0 C--N 1.356 0.879 0 C-N-CA 125.566 1.547 . . . . 0.0 109.388 178.382 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 65.3 Cg_endo -82.36 154.28 16.26 Favored 'Trans proline' 0 C--N 1.348 0.55 0 C-N-CA 123.928 3.085 . . . . 0.0 111.066 164.07 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 1.4 p90 -152.35 171.76 17.52 Favored 'General case' 0 N--CA 1.448 -0.559 1 N-CA-C 99.659 -4.2 . . . . 0.0 99.659 170.899 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.415 ' HG ' ' HA ' ' A' ' 21' ' ' SER . 7.8 mp -110.65 156.98 20.23 Favored 'General case' 0 N--CA 1.44 -0.942 0 N-CA-C 105.436 -2.061 . . . . 0.0 105.436 174.001 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 3.1 t80 -119.5 130.32 55.15 Favored 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 126.609 1.964 . . . . 0.0 108.332 179.603 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 43.2 m -83.78 -33.22 25.04 Favored 'General case' 0 C--N 1.361 1.097 0 N-CA-C 115.842 1.794 . . . . 0.0 115.842 178.891 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 121.37 -67.13 0.45 Allowed Glycine 0 C--N 1.355 1.601 0 C-N-CA 125.286 1.422 . . . . 0.0 113.682 -176.57 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 18.3 p -93.78 124.23 37.64 Favored 'General case' 0 C--N 1.355 0.833 0 O-C-N 120.652 -1.499 . . . . 0.0 110.106 179.096 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 105.53 -16.11 44.95 Favored Glycine 0 C--N 1.361 1.935 0 O-C-N 121.564 -0.71 . . . . 0.0 112.616 -175.904 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -81.19 165.85 47.48 Favored Glycine 0 C--N 1.364 2.126 0 CA-C-N 118.671 1.236 . . . . 0.0 114.722 173.079 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -155.22 118.52 4.42 Favored 'General case' 0 C--N 1.36 1.058 0 N-CA-C 116.24 1.941 . . . . 0.0 116.24 -178.963 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . 41.77 -34.63 0.0 OUTLIER 'General case' 0 C--N 1.368 1.373 2 N-CA-C 124.213 4.894 . . . . 0.0 124.213 170.828 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 53.7 t30 -93.25 72.13 4.53 Favored 'General case' 0 C--N 1.36 1.047 0 C-N-CA 125.715 1.606 . . . . 0.0 109.87 -175.598 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 5.4 ptp180 -148.3 131.38 16.32 Favored 'General case' 0 CA--C 1.508 -0.671 0 CA-C-O 123.916 1.817 . . . . 0.0 108.734 176.636 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . 0.435 ' CD2' ' HA ' ' A' ' 53' ' ' CYS . 13.9 m-85 -106.34 142.24 36.33 Favored 'General case' 0 C--N 1.349 0.571 0 C-N-CA 126.696 1.998 . . . . 0.0 109.322 -174.02 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.43 -37.4 60.42 Favored 'General case' 0 C--N 1.372 1.572 0 N-CA-C 114.965 1.468 . . . . 0.0 114.965 -178.332 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 72.8 p -123.29 -179.63 4.38 Favored 'General case' 0 C--N 1.361 1.081 0 C-N-CA 127.079 2.151 . . . . 0.0 107.863 175.561 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 18.6 tt -76.77 -16.28 14.78 Favored 'Isoleucine or valine' 0 C--N 1.364 1.206 0 C-N-CA 127.91 2.484 . . . . 0.0 113.594 174.513 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -96.59 -8.28 57.39 Favored Glycine 0 C--N 1.366 2.241 0 O-C-N 120.454 -1.404 . . . . 0.0 115.252 -178.779 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 14.0 tp10 -85.87 -18.8 31.77 Favored 'General case' 0 C--N 1.362 1.147 0 C-N-CA 125.509 1.524 . . . . 0.0 111.603 175.078 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . 0.435 ' HA ' ' CD2' ' A' ' 47' ' ' PHE . 52.9 t -63.51 -61.47 2.31 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 128.312 2.645 . . . . 0.0 114.779 179.99 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.407 ' HB2' ' HD3' ' A' ' 60' ' ' LYS . 6.7 ptt180 -68.92 -13.41 62.41 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 129.953 3.301 . . . . 0.0 118.632 -177.844 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 17.6 mmtp -68.34 -52.78 29.46 Favored 'General case' 0 C--N 1.366 1.309 0 C-N-CA 126.452 1.901 . . . . 0.0 112.647 176.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.542 ' HD2' ' CD1' ' A' ' 6' ' ' TYR . 32.3 mtmt -68.7 -24.63 64.51 Favored 'General case' 0 C--N 1.356 0.858 0 C-N-CA 130.419 3.488 . . . . 0.0 113.623 176.971 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . 0.404 ' SG ' ' HB2' ' A' ' 6' ' ' TYR . 90.7 m -128.37 5.39 5.73 Favored 'General case' 0 C--N 1.359 0.981 0 N-CA-C 119.166 3.024 . . . . 0.0 119.166 -170.04 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 13.5 mt -134.99 -15.58 1.99 Allowed 'General case' 0 N--CA 1.473 0.696 0 CA-C-N 123.15 2.704 . . . . 0.0 111.267 172.441 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 75.9 63.65 2.39 Favored Glycine 0 C--N 1.363 2.03 0 C-N-CA 128.252 2.834 . . . . 0.0 112.47 -168.391 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . 0.407 ' HD3' ' HB2' ' A' ' 54' ' ' ARG . 14.2 ptmt . . . . . 0 C--O 1.262 1.724 0 CA-C-O 115.655 -2.117 . . . . 0.0 107.134 -176.442 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 1' ' ' TRP . . . . . 0.421 ' CZ2' ' HA ' ' A' ' 3' ' ' PRO . 5.5 t90 . . . . . 0 N--CA 1.433 -1.292 0 N-CA-C 106.014 -1.847 . . . . 0.0 106.014 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 32.4 mt-30 -139.45 148.55 56.87 Favored Pre-proline 0 C--N 1.355 0.825 1 N-CA-C 100.008 -4.071 . . . . 0.0 100.008 172.093 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . 0.421 ' HA ' ' CZ2' ' A' ' 1' ' ' TRP . 1.8 Cg_endo -74.23 124.23 8.85 Favored 'Trans proline' 0 CA--C 1.555 1.533 0 C-N-CA 123.491 2.794 . . . . 0.0 115.516 -169.562 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . 0.425 ' HG2' ' CD2' ' A' ' 6' ' ' TYR . 43.2 Cg_endo -93.3 -113.4 0.0 OUTLIER 'Trans proline' 0 CA--C 1.549 1.227 1 C-N-CA 126.569 4.846 . . . . 0.0 111.174 -179.446 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' TRP . . . . . 0.47 ' CE3' ' CD1' ' A' ' 6' ' ' TYR 0.272 47.7 p-90 -86.49 -70.62 0.59 Allowed 'General case' 0 C--N 1.383 2.023 0 C-N-CA 126.929 2.091 . . . . 0.0 114.483 178.591 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.541 ' CD1' ' HD2' ' A' ' 56' ' ' LYS . 0.1 OUTLIER -31.72 -55.66 0.28 Allowed 'General case' 0 C--N 1.36 1.061 1 C-N-CA 133.277 4.631 . . . . 0.0 118.887 -173.663 . . . . . . . . 4 4 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 3.2 m -59.52 -33.21 71.09 Favored 'General case' 0 CA--C 1.498 -1.038 0 C-N-CA 130.215 3.406 . . . . 0.0 117.638 -173.95 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . 0.303 65.3 tttm -117.14 18.31 14.59 Favored 'General case' 0 N--CA 1.436 -1.152 0 C-N-CA 128.978 2.911 . . . . 0.0 107.958 -176.232 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 23.3 tp10 -93.64 131.46 32.24 Favored Pre-proline 0 C--N 1.366 1.291 0 O-C-N 120.398 -1.439 . . . . 0.0 112.919 -173.419 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 77.9 Cg_exo -63.63 119.27 6.26 Favored 'Trans proline' 0 C--N 1.362 1.239 0 C-N-CA 124.368 3.379 . . . . 0.0 116.452 -167.348 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 11.1 p -69.11 141.14 17.74 Favored 'Isoleucine or valine' 0 C--N 1.359 0.989 0 C-N-CA 125.308 1.443 . . . . 0.0 114.256 178.815 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.436 ' NH2' ' H ' ' A' ' 14' ' ' GLY . 9.5 mmm180 -131.07 -160.56 1.05 Allowed 'General case' 0 N--CA 1.438 -1.045 0 C-N-CA 126.06 1.744 . . . . 0.0 110.969 -174.911 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 11.1 tt -159.07 -35.8 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.427 -1.576 0 C-N-CA 128.283 2.633 . . . . 0.0 109.454 171.663 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.436 ' H ' ' NH2' ' A' ' 12' ' ' ARG . . . . . . . . 0 C--N 1.356 1.682 0 N-CA-C 108.574 -1.811 . . . . 0.0 108.574 -173.054 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 76.0 tttt . . . . . 0 CA--C 1.509 -0.615 0 N-CA-C 108.159 -1.052 . . . . 0.0 108.159 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 10.0 mp0 -100.18 122.7 43.42 Favored 'General case' 0 C--N 1.355 0.809 0 C-N-CA 125.923 1.689 . . . . 0.0 108.218 179.376 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 7.1 m-85 -110.27 134.91 51.79 Favored 'General case' 0 C--N 1.359 0.997 0 N-CA-C 104.62 -2.363 . . . . 0.0 104.62 177.909 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 3.8 t -69.36 141.02 54.29 Favored 'General case' 0 C--N 1.365 1.282 0 CA-C-N 121.809 2.095 . . . . 0.0 116.172 -175.207 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 20.1 p -138.19 -171.15 2.96 Favored 'General case' 0 C--N 1.358 0.976 0 C-N-CA 126.849 2.06 . . . . 0.0 111.108 179.385 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 -139.91 147.06 40.03 Favored 'General case' 0 C--N 1.362 1.109 0 C-N-CA 127.37 2.268 . . . . 0.0 110.709 172.577 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 9.7 p90 -137.85 162.9 32.78 Favored 'General case' 0 C--N 1.373 1.607 0 C-N-CA 126.411 1.884 . . . . 0.0 109.558 172.723 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . 0.431 ' CZ ' ' HG ' ' A' ' 58' ' ' LEU . 11.7 t80 -100.19 127.05 46.53 Favored 'General case' 0 C--N 1.362 1.11 0 O-C-N 120.598 -1.314 . . . . 0.0 107.726 179.694 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 36.4 tttm -86.62 104.93 16.51 Favored 'General case' 0 C--N 1.371 1.528 0 O-C-N 121.335 -0.853 . . . . 0.0 111.102 178.126 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 43.3 t-105 -52.01 -46.49 64.96 Favored 'General case' 0 C--N 1.364 1.197 0 C-N-CA 128.863 2.865 . . . . 0.0 116.811 -176.279 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 2.2 p -88.32 1.25 55.0 Favored 'General case' 0 C--N 1.349 0.57 0 C-N-CA 125.53 1.532 . . . . 0.0 113.578 179.567 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -109.87 -40.27 4.83 Favored 'General case' 0 C--N 1.36 1.057 0 O-C-N 120.95 -1.094 . . . . 0.0 111.54 176.402 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . 0.253 26.9 tptt 86.39 27.16 0.05 OUTLIER 'General case' 0 C--N 1.363 1.187 0 C-N-CA 127.953 2.501 . . . . 0.0 113.54 179.523 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 61.4 tttp -146.48 159.55 43.26 Favored 'General case' 0 C--N 1.356 0.886 0 C-N-CA 125.422 1.489 . . . . 0.0 108.102 -178.321 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 76.5 m -79.72 140.77 36.85 Favored 'General case' 0 C--N 1.364 1.214 0 C-N-CA 127.717 2.407 . . . . 0.0 112.449 177.03 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 19.1 mt -128.32 157.38 74.68 Favored Pre-proline 0 C--N 1.355 0.807 0 C-N-CA 126.209 1.804 . . . . 0.0 109.183 177.274 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -88.11 167.77 6.67 Favored 'Trans proline' 0 N--CA 1.455 -0.745 0 C-N-CA 123.815 3.01 . . . . 0.0 111.412 167.976 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 5.4 p90 -163.32 -176.71 4.91 Favored 'General case' 0 N--CA 1.445 -0.683 0 N-CA-C 102.005 -3.331 . . . . 0.0 102.005 172.61 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -125.21 147.01 49.26 Favored 'General case' 0 N--CA 1.423 -1.808 0 N-CA-C 104.929 -2.249 . . . . 0.0 104.929 173.916 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.432 ' CZ ' ' HA2' ' A' ' 39' ' ' GLY . 36.8 t80 -111.1 137.69 48.45 Favored 'General case' 0 CA--C 1.533 0.302 0 N-CA-C 104.607 -2.368 . . . . 0.0 104.607 173.316 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 77.5 p -104.78 -2.3 25.01 Favored 'General case' 0 C--N 1.365 1.266 0 C-N-CA 125.521 1.528 . . . . 0.0 112.386 -178.665 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . 0.432 ' HA2' ' CZ ' ' A' ' 37' ' ' PHE . . . 94.11 -59.6 2.0 Favored Glycine 0 C--N 1.356 1.643 0 O-C-N 120.029 -1.669 . . . . 0.0 115.252 170.419 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.9 m -73.09 62.27 0.63 Allowed 'General case' 0 C--N 1.354 0.802 0 C-N-CA 127.876 2.471 . . . . 0.0 116.036 -176.432 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 127.77 34.79 0.54 Allowed Glycine 0 C--N 1.357 1.737 0 N-CA-C 119.344 2.497 . . . . 0.0 119.344 168.687 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -94.31 170.98 30.49 Favored Glycine 0 C--N 1.368 2.316 0 CA-C-N 121.793 2.796 . . . . 0.0 111.524 175.937 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . 0.312 27.2 p30 -88.9 -99.17 0.09 Allowed 'General case' 0 C--N 1.365 1.262 0 N-CA-C 117.297 2.332 . . . . 0.0 117.297 -178.087 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -144.78 -9.38 0.62 Allowed 'General case' 0 C--N 1.353 0.719 0 O-C-N 120.461 -1.399 . . . . 0.0 114.175 -171.989 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 61.3 t30 -94.93 77.44 3.59 Favored 'General case' 0 C--N 1.357 0.895 0 O-C-N 119.97 -1.706 . . . . 0.0 114.313 -177.781 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . 0.406 0.0 OUTLIER -145.17 145.03 31.19 Favored 'General case' 0 C--N 1.357 0.898 0 CA-C-O 124.542 2.115 . . . . 0.0 113.745 169.229 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 12.0 m-85 -111.32 133.68 53.47 Favored 'General case' 0 C--N 1.353 0.744 0 C-N-CA 128.025 2.53 . . . . 0.0 108.249 -177.386 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 4.2 mp0 -74.44 -55.04 6.41 Favored 'General case' 0 C--N 1.371 1.523 0 C-N-CA 126.492 1.917 . . . . 0.0 113.132 -178.095 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 9.8 p -111.69 160.79 16.93 Favored 'General case' 0 C--N 1.354 0.804 0 N-CA-C 104.958 -2.238 . . . . 0.0 104.958 174.939 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 16.4 tt -59.49 -30.13 43.81 Favored 'Isoleucine or valine' 0 C--N 1.361 1.095 0 N-CA-C 117.42 2.378 . . . . 0.0 117.42 -175.026 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -96.22 13.59 65.6 Favored Glycine 0 C--N 1.357 1.73 0 O-C-N 119.926 -1.734 . . . . 0.0 115.293 -179.168 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 16.1 tp10 -89.84 -4.58 57.52 Favored 'General case' 0 C--N 1.364 1.22 0 CA-C-O 122.899 1.333 . . . . 0.0 109.845 171.107 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 18.7 t -79.78 -39.03 31.8 Favored 'General case' 0 C--N 1.359 1.0 1 C-N-CA 132.687 4.395 . . . . 0.0 112.843 179.668 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.415 ' HB3' ' HG3' ' A' ' 60' ' ' LYS . 55.2 mtp180 -69.01 -47.31 65.8 Favored 'General case' 0 C--N 1.34 0.17 1 C-N-CA 133.925 4.89 . . . . 0.0 117.486 -178.532 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 87.3 tttt -66.94 -30.88 71.14 Favored 'General case' 0 C--N 1.362 1.13 0 C-N-CA 127.827 2.451 . . . . 0.0 113.727 -178.878 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.541 ' HD2' ' CD1' ' A' ' 6' ' ' TYR . 20.3 mtmm -87.88 -36.05 17.39 Favored 'General case' 0 C--N 1.359 1.02 0 C-N-CA 127.876 2.47 . . . . 0.0 112.192 174.636 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 97.6 m -127.04 2.82 6.52 Favored 'General case' 0 C--N 1.369 1.427 0 N-CA-C 120.725 3.602 . . . . 0.0 120.725 -171.725 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.431 ' HG ' ' CZ ' ' A' ' 25' ' ' PHE . 14.7 mt -130.4 -26.28 2.32 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 122.215 2.28 . . . . 0.0 110.756 170.365 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 88.9 52.64 2.73 Favored Glycine 0 C--N 1.361 1.963 0 C-N-CA 128.646 3.022 . . . . 0.0 111.327 -172.278 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . 0.415 ' HG3' ' HB3' ' A' ' 54' ' ' ARG . 19.3 ptmt . . . . . 0 C--O 1.259 1.59 0 CA-C-N 118.377 1.089 . . . . 0.0 111.033 -172.934 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 84.7 t90 . . . . . 0 N--CA 1.434 -1.229 0 CA-C-O 122.149 0.976 . . . . 0.0 108.681 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 24.2 mm-40 -144.32 148.48 41.1 Favored Pre-proline 0 C--N 1.349 0.584 1 N-CA-C 98.296 -4.705 . . . . 0.0 98.296 170.733 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_endo -74.47 120.33 6.17 Favored 'Trans proline' 0 CA--C 1.555 1.548 0 CA-C-N 124.701 2.715 . . . . 0.0 116.023 -168.511 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 24.1 Cg_exo -77.41 -120.22 0.01 OUTLIER 'Trans proline' 0 C--N 1.369 1.657 1 C-N-CA 126.968 5.112 . . . . 0.0 113.587 175.639 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' TRP . . . . . 0.482 ' CE3' ' CD1' ' A' ' 6' ' ' TYR . 0.4 OUTLIER -86.66 -68.16 0.76 Allowed 'General case' 0 C--N 1.379 1.885 0 C-N-CA 126.955 2.102 . . . . 0.0 113.432 177.557 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.58 ' CD1' ' HD2' ' A' ' 56' ' ' LYS . 0.1 OUTLIER -31.13 -51.46 0.17 Allowed 'General case' 0 C--N 1.363 1.191 1 C-N-CA 133.97 4.908 . . . . 0.0 117.591 -172.844 . . . . . . . . 4 4 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 2.9 m -57.87 -43.49 86.04 Favored 'General case' 0 CA--C 1.511 -0.519 0 C-N-CA 129.925 3.29 . . . . 0.0 116.007 -175.708 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 26.7 mtpp -103.8 17.38 24.23 Favored 'General case' 0 C--N 1.357 0.904 0 C-N-CA 127.231 2.212 . . . . 0.0 109.908 177.261 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 29.7 tp10 -90.22 127.06 54.76 Favored Pre-proline 0 C--N 1.361 1.072 0 O-C-N 120.468 -1.395 . . . . 0.0 112.234 -170.893 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -67.88 122.51 9.64 Favored 'Trans proline' 0 C--N 1.364 1.371 0 C-N-CA 124.08 3.186 . . . . 0.0 114.43 -165.977 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 7.8 p -69.78 134.06 30.78 Favored 'Isoleucine or valine' 0 C--N 1.357 0.918 0 C-N-CA 126.692 1.997 . . . . 0.0 112.674 -179.767 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 46.8 mtt180 -135.05 125.18 25.99 Favored 'General case' 0 C--N 1.359 0.981 0 CA-C-O 117.134 -1.412 . . . . 0.0 109.109 -175.486 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.267 17.3 tt -96.2 -38.73 8.63 Favored 'Isoleucine or valine' 0 C--N 1.37 1.486 0 CA-C-N 120.16 1.345 . . . . 0.0 112.106 175.398 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.357 1.7 0 C-N-CA 125.805 1.669 . . . . 0.0 113.846 177.348 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 16.6 tppt? . . . . . 0 N--CA 1.439 -1.024 0 N-CA-C 104.192 -2.521 . . . . 0.0 104.192 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 6.5 mp0 -147.94 118.83 7.61 Favored 'General case' 0 N--CA 1.433 -1.303 0 N-CA-C 105.054 -2.202 . . . . 0.0 105.054 171.843 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 73.5 m-85 -103.4 145.07 30.54 Favored 'General case' 0 C--N 1.353 0.723 0 N-CA-C 105.718 -1.956 . . . . 0.0 105.718 171.04 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 3.7 t -72.75 142.65 48.13 Favored 'General case' 0 C--N 1.371 1.534 0 CA-C-N 122.063 2.211 . . . . 0.0 115.146 -177.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 80.6 p -146.82 -169.38 3.28 Favored 'General case' 0 C--N 1.361 1.089 0 C-N-CA 125.553 1.541 . . . . 0.0 113.606 -175.948 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 62.0 m-85 -145.63 149.28 34.22 Favored 'General case' 0 C--N 1.361 1.095 0 C-N-CA 130.384 3.474 . . . . 0.0 110.777 175.929 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 9.4 p90 -143.49 154.46 43.67 Favored 'General case' 0 C--N 1.365 1.271 0 C-N-CA 127.44 2.296 . . . . 0.0 109.691 174.456 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 11.5 t80 -94.49 121.87 36.48 Favored 'General case' 0 C--N 1.371 1.523 0 N-CA-C 106.269 -1.752 . . . . 0.0 106.269 177.404 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.11 102.56 14.37 Favored 'General case' 0 N--CA 1.431 -1.383 0 CA-C-O 122.032 0.92 . . . . 0.0 110.282 178.709 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 14.9 t-105 -48.11 -46.36 33.99 Favored 'General case' 0 C--N 1.355 0.824 0 C-N-CA 130.26 3.424 . . . . 0.0 118.266 -174.93 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 3.0 p -79.08 -18.6 53.08 Favored 'General case' 0 C--N 1.358 0.941 0 C-N-CA 125.675 1.59 . . . . 0.0 112.98 179.191 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -87.54 -40.81 13.95 Favored 'General case' 0 C--N 1.366 1.324 0 C-N-CA 124.401 1.08 . . . . 0.0 111.18 172.936 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . 0.297 0.0 OUTLIER 77.45 30.2 0.51 Allowed 'General case' 0 C--N 1.363 1.179 0 C-N-CA 128.94 2.896 . . . . 0.0 113.41 179.349 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 53.2 tptt -148.35 167.39 25.34 Favored 'General case' 0 C--N 1.358 0.971 0 C-N-CA 127.247 2.219 . . . . 0.0 107.204 176.899 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 92.7 m -78.67 138.26 38.21 Favored 'General case' 0 C--N 1.357 0.93 0 C-N-CA 128.481 2.713 . . . . 0.0 114.822 178.971 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 12.0 mt -122.95 148.44 54.06 Favored Pre-proline 0 C--N 1.359 1.013 0 C-N-CA 125.846 1.659 . . . . 0.0 109.328 176.19 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 63.3 Cg_endo -82.8 159.5 16.2 Favored 'Trans proline' 0 CA--C 1.535 0.527 0 C-N-CA 123.115 2.543 . . . . 0.0 111.689 167.311 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . 0.317 2.0 p90 -150.97 -160.27 1.15 Allowed 'General case' 0 C--N 1.347 0.468 0 N-CA-C 104.888 -2.264 . . . . 0.0 104.888 169.796 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 18.8 mt -140.87 153.11 45.58 Favored 'General case' 0 N--CA 1.436 -1.128 0 N-CA-C 101.83 -3.396 . . . . 0.0 101.83 175.472 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -121.95 130.59 53.45 Favored 'General case' 0 N--CA 1.469 0.484 0 N-CA-C 105.071 -2.196 . . . . 0.0 105.071 178.035 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 89.3 p -77.84 -82.54 0.09 Allowed 'General case' 0 C--N 1.37 1.48 0 O-C-N 121.13 -0.981 . . . . 0.0 112.2 179.733 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 176.7 -59.6 0.1 Allowed Glycine 0 CA--C 1.488 -1.597 0 N-CA-C 108.99 -1.644 . . . . 0.0 108.99 173.565 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 20.2 p -83.73 79.42 9.47 Favored 'General case' 0 C--N 1.359 1.018 0 C-N-CA 126.692 1.997 . . . . 0.0 112.963 179.694 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 144.4 19.36 0.19 Allowed Glycine 0 C--N 1.352 1.425 0 N-CA-C 116.933 1.533 . . . . 0.0 116.933 174.557 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -71.14 176.07 38.06 Favored Glycine 0 C--N 1.366 2.204 0 N-CA-C 119.711 2.645 . . . . 0.0 119.711 175.692 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . 0.451 ' H ' ' CZ ' ' A' ' 46' ' ' ARG . 36.0 t-20 -136.76 -156.68 0.72 Allowed 'General case' 0 C--N 1.353 0.726 0 C-N-CA 125.392 1.477 . . . . 0.0 109.114 -174.596 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -99.44 -15.87 18.57 Favored 'General case' 0 C--N 1.354 0.784 0 O-C-N 120.256 -1.527 . . . . 0.0 114.261 -176.869 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 63.0 t30 -94.5 73.83 3.79 Favored 'General case' 0 C--N 1.363 1.165 0 O-C-N 119.653 -1.904 . . . . 0.0 110.396 -178.555 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.451 ' CZ ' ' H ' ' A' ' 43' ' ' ASN 0.303 0.0 OUTLIER -137.21 127.59 26.54 Favored 'General case' 0 C--N 1.352 0.704 0 CA-C-O 124.135 1.921 . . . . 0.0 109.759 172.02 . . . . . . . . 4 4 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 23.4 m-85 -108.06 142.99 37.4 Favored 'General case' 0 C--N 1.353 0.748 0 C-N-CA 127.364 2.266 . . . . 0.0 109.011 -175.248 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 32.5 mt-30 -66.12 -68.63 0.35 Allowed 'General case' 0 C--N 1.365 1.255 0 C-N-CA 128.57 2.748 . . . . 0.0 113.49 -178.544 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 40.9 p -119.12 170.65 8.88 Favored 'General case' 0 C--N 1.354 0.793 0 C-N-CA 124.955 1.302 . . . . 0.0 108.788 176.901 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 16.0 tt -58.72 -26.78 32.72 Favored 'Isoleucine or valine' 0 C--N 1.361 1.105 0 C-N-CA 128.46 2.704 . . . . 0.0 116.297 178.664 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -86.04 -16.9 62.15 Favored Glycine 0 C--N 1.36 1.88 0 O-C-N 120.282 -1.511 . . . . 0.0 116.088 175.35 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 15.2 tp10 -82.9 -25.58 32.33 Favored 'General case' 0 C--N 1.371 1.52 0 CA-C-N 120.358 2.079 . . . . 0.0 111.349 176.313 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 9.6 t -59.84 -44.6 93.99 Favored 'General case' 0 CA--C 1.559 1.293 0 C-N-CA 127.526 2.33 . . . . 0.0 115.955 177.524 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 5.4 ptt180 -82.24 -18.66 41.72 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 126.509 1.923 . . . . 0.0 113.645 178.087 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 36.1 ttmt -75.46 -16.42 60.32 Favored 'General case' 0 C--N 1.361 1.091 0 C-N-CA 126.797 2.039 . . . . 0.0 114.656 178.552 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.58 ' HD2' ' CD1' ' A' ' 6' ' ' TYR . 5.4 ttmt -103.98 -24.33 13.25 Favored 'General case' 0 C--N 1.361 1.098 0 C-N-CA 126.208 1.803 . . . . 0.0 110.82 175.985 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . 0.452 ' SG ' ' HB2' ' A' ' 6' ' ' TYR . 34.4 m -127.21 10.38 6.85 Favored 'General case' 0 C--N 1.364 1.21 0 N-CA-C 118.031 2.604 . . . . 0.0 118.031 -169.14 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 12.1 mt -139.34 -18.67 0.98 Allowed 'General case' 0 C--N 1.35 0.614 0 CA-C-N 121.838 2.108 . . . . 0.0 112.87 172.256 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 82.05 51.53 4.42 Favored Glycine 0 C--N 1.362 1.988 0 C-N-CA 127.589 2.518 . . . . 0.0 111.673 -171.275 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 12.8 mtpt . . . . . 0 C--O 1.262 1.743 0 C-N-CA 124.76 1.224 . . . . 0.0 108.232 -177.024 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 1' ' ' TRP . . . . . 0.465 ' CZ2' ' HB3' ' A' ' 3' ' ' PRO . 83.0 t90 . . . . . 0 N--CA 1.432 -1.338 0 N-CA-C 107.386 -1.339 . . . . 0.0 107.386 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -144.76 148.22 38.6 Favored Pre-proline 0 C--N 1.353 0.728 1 N-CA-C 96.865 -5.235 . . . . 0.0 96.865 172.185 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . 0.465 ' HB3' ' CZ2' ' A' ' 1' ' ' TRP . 90.3 Cg_endo -81.08 123.23 4.47 Favored 'Trans proline' 0 CA--C 1.555 1.553 0 CA-C-N 125.702 3.072 . . . . 0.0 115.259 -165.815 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_exo -74.52 -115.48 0.01 OUTLIER 'Trans proline' 0 CA--C 1.55 1.301 1 C-N-CA 126.751 4.967 . . . . 0.0 113.828 174.527 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' TRP . . . . . 0.488 ' CE3' ' CD2' ' A' ' 6' ' ' TYR . 21.7 p-90 -87.75 -72.3 0.53 Allowed 'General case' 0 C--N 1.376 1.729 0 C-N-CA 126.71 2.004 . . . . 0.0 115.01 179.882 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.505 ' CD2' ' HD2' ' A' ' 56' ' ' LYS . 0.0 OUTLIER -31.26 -53.99 0.23 Allowed 'General case' 0 C--N 1.356 0.877 1 C-N-CA 133.868 4.867 . . . . 0.0 118.065 -173.378 . . . . . . . . 4 4 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.9 m -54.96 -33.49 62.4 Favored 'General case' 0 CA--C 1.502 -0.901 0 C-N-CA 131.444 3.897 . . . . 0.0 116.488 -176.501 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 11.7 mtpp -113.96 13.73 18.32 Favored 'General case' 0 N--CA 1.439 -0.987 0 C-N-CA 129.978 3.311 . . . . 0.0 109.891 -177.857 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 34.7 tp10 -90.67 142.37 27.81 Favored Pre-proline 0 C--N 1.364 1.209 0 O-C-N 120.74 -1.225 . . . . 0.0 114.289 -170.29 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -68.0 117.7 5.09 Favored 'Trans proline' 0 C--N 1.367 1.531 0 C-N-CA 124.682 3.588 . . . . 0.0 115.324 -173.891 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 14.5 p -69.72 128.02 32.48 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.938 0 C-N-CA 128.387 2.675 . . . . 0.0 111.885 176.138 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.431 ' HB2' HH22 ' A' ' 46' ' ' ARG . 2.2 mmp_? -142.36 122.58 13.84 Favored 'General case' 0 C--N 1.366 1.313 0 C-N-CA 125.65 1.58 . . . . 0.0 113.546 -170.708 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 12.9 tt -86.78 -42.22 15.35 Favored 'Isoleucine or valine' 0 C--N 1.376 1.757 0 C-N-CA 127.873 2.469 . . . . 0.0 115.931 -179.692 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.362 2.003 0 O-C-N 121.279 -0.888 . . . . 0.0 114.161 -173.451 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.537 ' HG3' ' H ' ' A' ' 19' ' ' GLN . 14.8 tptp . . . . . 0 CA--C 1.504 -0.811 0 N-CA-C 104.37 -2.456 . . . . 0.0 104.37 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . 0.537 ' H ' ' HG3' ' A' ' 18' ' ' LYS . 9.6 mm-40 -131.93 110.02 10.49 Favored 'General case' 0 N--CA 1.432 -1.328 0 N-CA-C 101.183 -3.636 . . . . 0.0 101.183 171.254 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 30.7 m-85 -106.83 138.45 42.98 Favored 'General case' 0 C--N 1.354 0.788 0 C-N-CA 125.794 1.638 . . . . 0.0 108.099 178.234 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' SER . . . . . 0.419 ' HA ' ' HG ' ' A' ' 36' ' ' LEU . 3.9 t -65.71 120.96 13.92 Favored 'General case' 0 C--N 1.371 1.513 0 N-CA-C 117.554 2.427 . . . . 0.0 117.554 -175.053 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -116.53 -168.24 1.42 Allowed 'General case' 0 C--N 1.37 1.487 0 C-N-CA 128.541 2.736 . . . . 0.0 111.232 177.171 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 23.6 m-85 -150.34 150.41 31.41 Favored 'General case' 0 C--N 1.355 0.835 0 C-N-CA 129.494 3.118 . . . . 0.0 108.191 174.258 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 8.9 p90 -145.14 166.14 26.28 Favored 'General case' 0 C--N 1.356 0.889 0 C-N-CA 126.325 1.85 . . . . 0.0 109.684 171.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 19.0 t80 -98.02 125.72 43.11 Favored 'General case' 0 C--N 1.36 1.045 0 O-C-N 120.026 -1.671 . . . . 0.0 108.814 176.655 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 26.7 ttpt -85.05 103.15 13.81 Favored 'General case' 0 C--N 1.379 1.862 0 O-C-N 120.152 -1.593 . . . . 0.0 108.57 173.92 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 26.1 t-105 -46.07 -43.52 14.67 Favored 'General case' 0 C--N 1.358 0.951 0 C-N-CA 129.904 3.282 . . . . 0.0 117.528 -176.917 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 4.0 p -82.36 -29.83 30.71 Favored 'General case' 0 C--N 1.35 0.59 0 C-N-CA 127.787 2.435 . . . . 0.0 113.885 179.727 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -82.63 -23.69 34.18 Favored 'General case' 0 C--N 1.37 1.494 0 CA-C-N 120.935 1.698 . . . . 0.0 113.853 176.608 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . 0.261 30.5 mmmt 73.23 23.01 2.7 Favored 'General case' 0 C--N 1.367 1.328 0 C-N-CA 126.929 2.092 . . . . 0.0 112.246 -176.842 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.931 ' HZ1' HH12 ' A' ' 54' ' ' ARG . 6.8 mmtm -146.21 164.6 31.77 Favored 'General case' 0 C--N 1.365 1.246 0 C-N-CA 125.655 1.582 . . . . 0.0 112.684 -177.06 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 68.5 m -89.9 141.28 28.8 Favored 'General case' 0 C--N 1.359 1.005 0 C-N-CA 127.501 2.32 . . . . 0.0 116.321 -173.863 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 39.3 mt -127.44 145.59 55.14 Favored Pre-proline 0 C--N 1.363 1.183 0 C-N-CA 125.034 1.334 . . . . 0.0 110.741 -179.083 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 62.2 Cg_endo -84.54 143.17 9.66 Favored 'Trans proline' 0 CA--C 1.536 0.606 0 C-N-CA 123.474 2.783 . . . . 0.0 111.07 167.138 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 1.6 p90 -142.35 159.83 41.45 Favored 'General case' 0 C--N 1.349 0.569 0 N-CA-C 101.098 -3.667 . . . . 0.0 101.098 170.964 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.419 ' HG ' ' HA ' ' A' ' 21' ' ' SER . 6.9 mp -104.82 158.5 16.48 Favored 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 125.655 1.582 . . . . 0.0 107.75 178.39 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 9.0 t80 -125.55 144.2 50.67 Favored 'General case' 0 CA--C 1.557 1.228 0 C-N-CA 127.55 2.34 . . . . 0.0 110.088 179.749 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.9 t -84.86 -19.64 32.06 Favored 'General case' 0 C--N 1.376 1.724 0 N-CA-C 117.834 2.531 . . . . 0.0 117.834 -179.722 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 119.3 -30.71 5.7 Favored Glycine 0 C--N 1.361 1.966 0 C-N-CA 126.265 1.888 . . . . 0.0 116.333 172.871 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -137.23 142.85 42.05 Favored 'General case' 0 C--N 1.345 0.405 0 N-CA-C 104.756 -2.313 . . . . 0.0 104.756 173.418 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 100.8 10.53 43.05 Favored Glycine 0 C--N 1.365 2.178 0 O-C-N 121.085 -1.01 . . . . 0.0 115.429 -174.341 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -105.82 -171.33 23.51 Favored Glycine 0 C--N 1.358 1.77 0 C-N-CA 124.888 1.232 . . . . 0.0 114.446 177.012 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . 0.491 ' H ' ' CZ ' ' A' ' 46' ' ' ARG 0.311 31.8 p30 -124.3 -106.53 0.34 Allowed 'General case' 0 C--N 1.363 1.168 0 N-CA-C 116.265 1.95 . . . . 0.0 116.265 178.782 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -152.92 6.79 0.39 Allowed 'General case' 0 C--N 1.352 0.711 0 O-C-N 121.256 -0.903 . . . . 0.0 112.686 -172.042 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 55.8 t30 -104.17 46.43 0.92 Allowed 'General case' 0 C--N 1.365 1.28 0 O-C-N 120.574 -1.328 . . . . 0.0 109.406 176.264 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.491 ' CZ ' ' H ' ' A' ' 43' ' ' ASN 0.365 0.0 OUTLIER -132.1 106.93 8.3 Favored 'General case' 0 C--N 1.358 0.971 0 CA-C-O 124.468 2.08 . . . . 0.0 107.508 -179.368 . . . . . . . . 4 4 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 13.0 m-30 -93.02 149.62 21.09 Favored 'General case' 0 C--N 1.346 0.427 0 C-N-CA 128.54 2.736 . . . . 0.0 111.762 -165.573 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 35.8 mt-30 -74.73 -41.55 59.93 Favored 'General case' 0 C--N 1.37 1.495 0 N-CA-C 116.746 2.128 . . . . 0.0 116.746 -172.289 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 48.9 p -136.84 179.02 6.63 Favored 'General case' 0 C--N 1.356 0.849 0 C-N-CA 128.584 2.754 . . . . 0.0 105.54 178.55 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 18.1 tt -75.56 -17.65 15.74 Favored 'Isoleucine or valine' 0 C--N 1.37 1.463 0 O-C-N 120.42 -1.425 . . . . 0.0 113.452 175.596 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -77.25 -18.18 78.56 Favored Glycine 0 C--N 1.366 2.225 0 C-N-CA 125.704 1.621 . . . . 0.0 116.166 175.781 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -83.27 -2.17 54.98 Favored 'General case' 0 C--N 1.365 1.28 0 C-N-CA 126.371 1.868 . . . . 0.0 112.109 177.388 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 4.7 t -94.94 -24.34 17.01 Favored 'General case' 0 C--N 1.356 0.88 0 C-N-CA 128.715 2.806 . . . . 0.0 114.449 179.87 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.931 HH12 ' HZ1' ' A' ' 31' ' ' LYS . 0.0 OUTLIER -84.78 -37.91 20.24 Favored 'General case' 0 C--O 1.237 0.419 1 C-N-CA 132.393 4.277 . . . . 0.0 109.398 179.034 . . . . . . . . 4 4 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 28.0 ttmt -71.71 -28.03 63.42 Favored 'General case' 0 C--N 1.351 0.654 0 C-N-CA 129.303 3.041 . . . . 0.0 113.871 -178.285 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.505 ' HD2' ' CD2' ' A' ' 6' ' ' TYR . 27.2 mtmt -101.08 -39.18 7.82 Favored 'General case' 0 C--N 1.358 0.941 0 C-N-CA 125.094 1.358 . . . . 0.0 112.592 178.098 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 99.2 m -126.49 17.22 7.59 Favored 'General case' 0 C--N 1.358 0.951 0 N-CA-C 116.98 2.215 . . . . 0.0 116.98 -170.13 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 22.5 mt -137.15 -23.05 1.15 Allowed 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 122.518 2.417 . . . . 0.0 112.682 168.666 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 86.78 48.74 4.34 Favored Glycine 0 C--N 1.367 2.268 0 C-N-CA 127.134 2.302 . . . . 0.0 111.524 -175.655 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 13.9 ptmt . . . . . 0 C--O 1.261 1.666 0 CA-C-O 118.572 -0.727 . . . . 0.0 110.544 -173.26 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 11.9 t90 . . . . . 0 N--CA 1.434 -1.239 0 CA-C-O 122.748 1.261 . . . . 0.0 109.294 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -135.75 148.91 67.32 Favored Pre-proline 0 C--N 1.351 0.659 1 N-CA-C 100.148 -4.019 . . . . 0.0 100.148 172.737 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 1.4 Cg_endo -77.35 125.38 7.7 Favored 'Trans proline' 0 CA--C 1.554 1.495 0 CA-C-N 124.807 2.753 . . . . 0.0 115.222 -169.026 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . 0.422 ' HG2' ' CD2' ' A' ' 6' ' ' TYR . 38.3 Cg_endo -96.29 -116.09 0.0 OUTLIER 'Trans proline' 0 CA--C 1.549 1.239 1 C-N-CA 126.549 4.833 . . . . 0.0 110.855 -176.473 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' TRP . . . . . 0.471 ' CE3' ' CD1' ' A' ' 6' ' ' TYR 0.274 35.5 p-90 -85.67 -67.59 0.79 Allowed 'General case' 0 C--N 1.38 1.908 0 C-N-CA 126.496 1.918 . . . . 0.0 115.093 178.395 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.485 ' CD1' ' HD2' ' A' ' 56' ' ' LYS . 0.1 OUTLIER -32.71 -53.06 0.33 Allowed 'General case' 0 N--CA 1.48 1.071 1 C-N-CA 132.277 4.231 . . . . 0.0 119.162 -172.353 . . . . . . . . 4 4 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.7 m -60.51 -38.16 83.46 Favored 'General case' 0 N--CA 1.449 -0.514 0 C-N-CA 128.733 2.813 . . . . 0.0 113.277 -179.488 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 39.8 mtpt -104.16 14.01 31.26 Favored 'General case' 0 C--N 1.363 1.17 0 C-N-CA 129.08 2.952 . . . . 0.0 110.579 -177.71 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -96.67 127.79 38.28 Favored Pre-proline 0 C--N 1.364 1.217 0 O-C-N 119.853 -1.779 . . . . 0.0 112.015 -172.273 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -68.16 120.85 7.81 Favored 'Trans proline' 0 C--N 1.358 1.056 0 C-N-CA 124.167 3.245 . . . . 0.0 115.093 -165.881 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 8.1 p -67.85 133.85 31.03 Favored 'Isoleucine or valine' 0 C--N 1.36 1.057 0 C-N-CA 126.568 1.947 . . . . 0.0 113.934 -179.585 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . 0.287 16.5 mmt-85 -134.49 117.9 16.74 Favored 'General case' 0 C--N 1.36 1.04 0 C-N-CA 126.611 1.964 . . . . 0.0 108.494 -171.772 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 21.1 tt -93.18 -40.25 11.74 Favored 'Isoleucine or valine' 0 C--N 1.369 1.443 0 CA-C-N 120.399 1.454 . . . . 0.0 109.453 173.387 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.36 1.895 0 C-N-CA 124.67 1.129 . . . . 0.0 114.533 175.942 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . 0.264 0.0 OUTLIER . . . . . 0 N--CA 1.451 -0.409 0 N-CA-C 104.472 -2.418 . . . . 0.0 104.472 . . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -150.11 123.48 9.0 Favored 'General case' 0 C--N 1.351 0.665 0 N-CA-C 103.643 -2.725 . . . . 0.0 103.643 175.314 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 19.6 m-85 -105.84 158.08 17.01 Favored 'General case' 0 C--N 1.36 1.024 0 C-N-CA 126.46 1.904 . . . . 0.0 106.14 177.662 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 2.6 t -82.31 144.59 30.49 Favored 'General case' 0 C--N 1.367 1.331 0 CA-C-N 122.111 2.232 . . . . 0.0 115.964 -176.247 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 61.1 p -146.77 -170.91 3.64 Favored 'General case' 0 C--N 1.364 1.197 0 C-N-CA 127.767 2.427 . . . . 0.0 112.671 -177.471 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 45.1 m-85 -141.05 152.76 45.1 Favored 'General case' 0 C--N 1.358 0.958 0 C-N-CA 129.984 3.313 . . . . 0.0 109.921 171.384 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . 0.303 2.9 p90 -144.68 158.97 43.56 Favored 'General case' 0 C--N 1.365 1.275 0 C-N-CA 126.999 2.12 . . . . 0.0 110.035 172.832 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 12.6 t80 -104.17 130.31 51.93 Favored 'General case' 0 C--N 1.365 1.263 0 N-CA-C 106.931 -1.507 . . . . 0.0 106.931 179.018 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.521 ' NZ ' ' H ' ' A' ' 28' ' ' THR . 0.0 OUTLIER -96.27 112.57 24.27 Favored 'General case' 0 N--CA 1.446 -0.671 0 C-N-CA 125.099 1.36 . . . . 0.0 110.047 179.222 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' TRP . . . . . 0.475 ' N ' ' HZ3' ' A' ' 26' ' ' LYS . 38.2 t-105 -50.47 -48.57 56.62 Favored 'General case' 0 C--N 1.355 0.819 0 C-N-CA 129.553 3.141 . . . . 0.0 116.494 175.007 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' THR . . . . . 0.521 ' H ' ' NZ ' ' A' ' 26' ' ' LYS 0.294 39.7 p -82.3 -25.7 33.73 Favored 'General case' 0 C--N 1.36 1.052 0 C-N-CA 124.471 1.109 . . . . 0.0 112.792 178.362 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -78.1 -38.9 43.01 Favored 'General case' 0 C--N 1.378 1.813 0 CA-C-N 120.779 1.627 . . . . 0.0 114.072 172.799 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . 0.301 52.5 mmtt 78.45 21.36 0.8 Allowed 'General case' 0 C--N 1.369 1.418 0 C-N-CA 128.107 2.563 . . . . 0.0 113.547 179.742 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 63.1 tttt -147.6 168.41 22.07 Favored 'General case' 0 C--N 1.355 0.835 0 C-N-CA 126.578 1.951 . . . . 0.0 106.509 -179.931 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 79.1 m -81.21 146.05 30.67 Favored 'General case' 0 C--N 1.358 0.942 0 C-N-CA 126.961 2.104 . . . . 0.0 115.745 179.894 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 12.8 mt -122.83 142.97 39.15 Favored Pre-proline 0 C--N 1.358 0.941 0 C-N-CA 125.75 1.62 . . . . 0.0 109.828 177.086 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 63.7 Cg_endo -85.6 147.32 9.68 Favored 'Trans proline' 0 C--N 1.35 0.645 0 C-N-CA 124.403 3.402 . . . . 0.0 111.077 169.181 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . 0.386 3.4 p90 -145.42 -157.73 0.82 Allowed 'General case' 0 C--N 1.352 0.695 0 CA-C-N 114.95 -1.023 . . . . 0.0 109.41 174.749 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 40.2 mt -140.31 153.85 46.6 Favored 'General case' 0 N--CA 1.436 -1.134 0 C-N-CA 128.31 2.644 . . . . 0.0 104.153 -178.598 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -137.98 127.17 24.42 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 127.817 2.447 . . . . 0.0 108.465 -178.169 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 96.7 p -83.71 4.51 28.42 Favored 'General case' 0 C--N 1.368 1.371 0 N-CA-C 119.714 3.227 . . . . 0.0 119.714 -176.247 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 88.2 -31.25 4.83 Favored Glycine 0 C--N 1.355 1.615 0 C-N-CA 129.252 3.31 . . . . 0.0 120.103 172.58 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -136.22 31.78 2.9 Favored 'General case' 0 CA--C 1.509 -0.597 0 O-C-N 121.441 -1.035 . . . . 0.0 109.931 -175.681 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -150.36 36.91 0.93 Allowed Glycine 0 C--N 1.355 1.599 0 N-CA-C 110.457 -1.057 . . . . 0.0 110.457 176.186 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -101.3 -177.42 28.84 Favored Glycine 0 C--N 1.357 1.739 0 C-N-CA 125.455 1.502 . . . . 0.0 113.99 174.72 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . 0.476 ' H ' ' NH1' ' A' ' 46' ' ' ARG 0.381 42.0 p30 -125.01 -96.0 0.45 Allowed 'General case' 0 C--N 1.356 0.891 0 O-C-N 120.945 -1.327 . . . . 0.0 111.225 174.322 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -145.3 -16.56 0.49 Allowed 'General case' 0 C--N 1.348 0.541 0 C-N-CA 125.205 1.402 . . . . 0.0 112.274 -174.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 50.6 t30 -94.11 74.1 4.05 Favored 'General case' 0 C--N 1.363 1.168 0 O-C-N 120.165 -1.584 . . . . 0.0 111.738 -177.939 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.476 ' NH1' ' H ' ' A' ' 43' ' ' ASN 0.295 0.0 OUTLIER -137.27 130.55 31.03 Favored 'General case' 0 C--N 1.352 0.674 0 CA-C-O 124.271 1.986 . . . . 0.0 108.868 173.638 . . . . . . . . 4 4 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . 0.458 ' CD2' ' HA ' ' A' ' 53' ' ' CYS . 21.7 m-85 -111.31 141.94 44.18 Favored 'General case' 0 CA--C 1.507 -0.685 0 C-N-CA 127.914 2.486 . . . . 0.0 108.598 -174.763 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 31.0 mt-30 -67.35 -64.63 0.82 Allowed 'General case' 0 C--N 1.363 1.167 0 C-N-CA 127.097 2.159 . . . . 0.0 114.609 -175.572 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 31.4 p -121.47 171.9 8.46 Favored 'General case' 0 C--N 1.353 0.743 0 C-N-CA 126.492 1.917 . . . . 0.0 107.499 177.791 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 17.7 tt -59.36 -25.71 31.73 Favored 'Isoleucine or valine' 0 C--N 1.363 1.174 0 C-N-CA 127.802 2.441 . . . . 0.0 117.227 178.78 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -88.48 -17.32 57.25 Favored Glycine 0 C--N 1.353 1.503 0 N-CA-C 116.669 1.427 . . . . 0.0 116.669 174.301 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 15.8 tp10 -70.05 -34.62 73.45 Favored 'General case' 0 C--N 1.378 1.835 0 CA-C-N 120.015 1.908 . . . . 0.0 112.016 174.547 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . 0.458 ' HA ' ' CD2' ' A' ' 47' ' ' PHE . 48.7 t -47.92 -44.17 29.67 Favored 'General case' 0 C--N 1.361 1.108 0 C-N-CA 128.575 2.75 . . . . 0.0 116.024 175.444 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 8.4 mtp85 -74.34 -26.67 60.29 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 130.964 3.705 . . . . 0.0 117.385 -179.174 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 12.5 mttp -80.34 -11.72 59.67 Favored 'General case' 0 C--N 1.364 1.225 0 C-N-CA 125.572 1.549 . . . . 0.0 114.815 -179.634 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.485 ' HD2' ' CD1' ' A' ' 6' ' ' TYR . 9.9 mtmm -103.52 -28.69 11.6 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 126.664 1.986 . . . . 0.0 109.38 175.001 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 53.6 m -125.86 6.68 7.36 Favored 'General case' 0 C--N 1.365 1.265 0 N-CA-C 119.551 3.167 . . . . 0.0 119.551 -170.502 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 16.3 mt -134.54 -15.39 2.14 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 123.435 2.834 . . . . 0.0 113.334 174.826 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 77.49 57.47 3.59 Favored Glycine 0 C--N 1.361 1.931 0 C-N-CA 128.238 2.828 . . . . 0.0 113.02 -171.443 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 16.0 ptpt . . . . . 0 C--O 1.259 1.604 0 N-CA-C 107.889 -1.152 . . . . 0.0 107.889 -176.197 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 1' ' ' TRP . . . . . 0.513 ' CZ2' ' HB3' ' A' ' 3' ' ' PRO . 81.0 t90 . . . . . 0 N--CA 1.434 -1.263 0 N-CA-C 107.099 -1.445 . . . . 0.0 107.099 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 81.2 mt-30 -149.38 149.0 28.02 Favored Pre-proline 0 C--N 1.355 0.829 1 N-CA-C 97.549 -4.982 . . . . 0.0 97.549 174.22 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . 0.513 ' HB3' ' CZ2' ' A' ' 1' ' ' TRP . 60.5 Cg_endo -86.95 118.84 1.48 Allowed 'Trans proline' 0 CA--C 1.557 1.635 0 CA-C-N 125.045 2.838 . . . . 0.0 115.845 -162.997 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 30.0 Cg_exo -76.09 -110.53 0.01 OUTLIER 'Trans proline' 0 C--N 1.362 1.287 1 C-N-CA 126.552 4.834 . . . . 0.0 114.658 178.942 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' TRP . . . . . 0.487 ' CE3' ' CD2' ' A' ' 6' ' ' TYR 0.316 36.5 p-90 -88.46 -70.47 0.64 Allowed 'General case' 0 C--N 1.379 1.854 0 C-N-CA 126.671 1.988 . . . . 0.0 116.334 -178.695 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.509 ' CD2' ' HD2' ' A' ' 56' ' ' LYS . 0.0 OUTLIER -32.06 -55.76 0.31 Allowed 'General case' 0 C--N 1.36 1.042 1 C-N-CA 135.74 5.616 . . . . 0.0 118.07 -173.338 . . . . . . . . 4 4 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -55.13 -39.78 69.8 Favored 'General case' 0 N--CA 1.444 -0.769 0 C-N-CA 130.287 3.435 . . . . 0.0 114.553 -179.8 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 10.1 mtpp -105.12 13.5 30.65 Favored 'General case' 0 C--N 1.356 0.867 0 C-N-CA 127.559 2.344 . . . . 0.0 110.56 -178.074 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -93.46 132.84 29.35 Favored Pre-proline 0 C--N 1.368 1.385 0 O-C-N 120.012 -1.68 . . . . 0.0 112.458 -171.884 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_exo -66.46 122.71 10.2 Favored 'Trans proline' 0 C--N 1.359 1.091 0 C-N-CA 124.054 3.17 . . . . 0.0 116.88 -165.957 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 8.4 p -72.52 132.53 33.27 Favored 'Isoleucine or valine' 0 C--N 1.36 1.026 0 C-N-CA 125.882 1.673 . . . . 0.0 111.743 175.924 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . 0.251 1.6 mmp_? -146.41 124.43 12.07 Favored 'General case' 0 C--N 1.353 0.751 0 CA-C-O 115.063 -2.399 . . . . 0.0 112.956 -168.822 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.278 6.5 tt -88.44 -35.16 7.63 Favored 'Isoleucine or valine' 0 C--N 1.384 2.097 0 CA-C-N 124.922 3.51 . . . . 0.0 115.179 177.64 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.358 1.764 0 N-CA-C 117.388 1.715 . . . . 0.0 117.388 175.081 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.552 ' HG3' ' H ' ' A' ' 19' ' ' GLN . 20.5 tptp . . . . . 0 CA--C 1.509 -0.596 0 N-CA-C 102.025 -3.324 . . . . 0.0 102.025 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . 0.552 ' H ' ' HG3' ' A' ' 18' ' ' LYS . 23.4 mp0 -133.75 113.23 12.08 Favored 'General case' 0 N--CA 1.438 -1.068 0 N-CA-C 101.983 -3.34 . . . . 0.0 101.983 170.979 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 33.1 m-85 -107.18 141.66 38.11 Favored 'General case' 0 C--N 1.355 0.845 0 O-C-N 120.484 -1.385 . . . . 0.0 107.921 179.65 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.7 t -66.39 122.65 18.01 Favored 'General case' 0 C--N 1.372 1.573 0 N-CA-C 117.695 2.48 . . . . 0.0 117.695 -176.619 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' SER . . . . . 0.403 ' HG ' ' N ' ' A' ' 23' ' ' PHE . 1.2 t -120.73 -175.68 3.08 Favored 'General case' 0 C--N 1.363 1.159 0 C-N-CA 129.157 2.983 . . . . 0.0 109.175 -178.881 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . 0.403 ' N ' ' HG ' ' A' ' 22' ' ' SER . 37.0 m-85 -146.12 141.62 27.71 Favored 'General case' 0 C--N 1.349 0.56 0 C-N-CA 129.854 3.262 . . . . 0.0 104.312 170.716 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 16.0 p90 -124.57 148.87 47.56 Favored 'General case' 0 C--N 1.358 0.967 0 N-CA-C 107.499 -1.297 . . . . 0.0 107.499 172.102 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 10.4 t80 -94.76 126.11 39.86 Favored 'General case' 0 C--N 1.363 1.189 0 N-CA-C 104.129 -2.545 . . . . 0.0 104.129 175.639 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -100.0 113.32 25.82 Favored 'General case' 0 N--CA 1.425 -1.682 0 C-N-CA 125.569 1.548 . . . . 0.0 108.85 -175.232 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 45.8 t-105 -53.54 -46.96 70.38 Favored 'General case' 0 C--N 1.361 1.097 0 C-N-CA 129.544 3.138 . . . . 0.0 117.457 -177.922 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 11.0 p -83.49 -5.54 59.19 Favored 'General case' 0 C--N 1.353 0.749 0 C-N-CA 124.542 1.137 . . . . 0.0 113.604 179.456 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -97.06 -47.93 5.59 Favored 'General case' 0 C--N 1.363 1.188 0 C-N-CA 124.819 1.247 . . . . 0.0 111.868 174.993 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . 0.294 0.7 OUTLIER 83.45 26.38 0.11 Allowed 'General case' 0 C--N 1.366 1.287 0 C-N-CA 127.672 2.389 . . . . 0.0 112.489 -178.333 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.455 ' HZ1' ' HB2' ' A' ' 32' ' ' CYS . 7.8 tmtm? -147.78 164.22 34.3 Favored 'General case' 0 C--N 1.356 0.868 0 C-N-CA 128.008 2.523 . . . . 0.0 107.344 179.197 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.455 ' HB2' ' HZ1' ' A' ' 31' ' ' LYS . 64.6 m -81.98 118.81 23.27 Favored 'General case' 0 C--N 1.363 1.195 0 C-N-CA 129.739 3.216 . . . . 0.0 114.606 178.831 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 29.6 mt -105.26 145.73 31.35 Favored Pre-proline 0 C--N 1.354 0.8 0 O-C-N 119.83 -1.794 . . . . 0.0 111.203 177.924 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 69.2 Cg_endo -86.92 144.28 7.24 Favored 'Trans proline' 0 N--CA 1.46 -0.452 0 C-N-CA 123.129 2.552 . . . . 0.0 112.245 173.481 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -149.03 171.16 16.83 Favored 'General case' 0 N--CA 1.444 -0.755 0 N-CA-C 101.338 -3.579 . . . . 0.0 101.338 170.255 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 8.4 mp -111.72 156.23 22.23 Favored 'General case' 0 N--CA 1.449 -0.519 0 C-N-CA 125.967 1.707 . . . . 0.0 106.882 178.398 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 8.3 t80 -116.95 139.69 50.35 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 127.137 2.175 . . . . 0.0 112.157 -179.104 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.3 t -92.76 -4.97 52.18 Favored 'General case' 0 C--N 1.377 1.786 0 N-CA-C 117.401 2.371 . . . . 0.0 117.401 178.291 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 106.21 -44.04 1.56 Allowed Glycine 0 C--N 1.366 2.197 0 CA-C-N 120.908 1.686 . . . . 0.0 116.541 170.856 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -133.69 139.37 46.38 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 103.634 -2.728 . . . . 0.0 103.634 177.322 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 103.09 -12.2 55.69 Favored Glycine 0 C--N 1.358 1.775 0 O-C-N 121.329 -0.857 . . . . 0.0 113.606 -173.75 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -102.93 177.24 25.27 Favored Glycine 0 C--N 1.361 1.922 0 C-N-CA 127.707 2.575 . . . . 0.0 112.622 177.052 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 15.1 p30 -119.72 -100.13 0.44 Allowed 'General case' 0 C--N 1.365 1.269 0 N-CA-C 115.446 1.647 . . . . 0.0 115.446 179.241 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -158.75 17.87 0.2 Allowed 'General case' 0 C--N 1.363 1.19 0 N-CA-C 114.981 1.475 . . . . 0.0 114.981 -172.155 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 36.6 t30 -106.69 55.64 0.66 Allowed 'General case' 0 C--N 1.366 1.315 0 N-CA-C 104.401 -2.444 . . . . 0.0 104.401 172.47 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 7.0 ptp180 -144.07 105.31 4.24 Favored 'General case' 0 CA--C 1.5 -0.95 0 CA-C-O 124.721 2.201 . . . . 0.0 106.442 -172.08 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 18.4 m-85 -107.14 133.53 51.61 Favored 'General case' 0 N--CA 1.434 -1.241 0 CA-C-N 111.87 -2.423 . . . . 0.0 109.04 -169.849 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 30.9 mt-30 -55.23 -40.0 70.37 Favored 'General case' 0 C--N 1.355 0.845 0 C-N-CA 130.221 3.409 . . . . 0.0 116.605 -177.223 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 81.9 p -136.3 174.08 11.01 Favored 'General case' 0 C--N 1.356 0.862 0 C-N-CA 127.551 2.341 . . . . 0.0 107.656 178.163 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 18.6 tt -68.32 -13.04 16.52 Favored 'Isoleucine or valine' 0 C--N 1.36 1.049 0 C-N-CA 129.36 3.064 . . . . 0.0 116.883 177.58 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -99.61 -25.27 9.36 Favored Glycine 0 C--N 1.353 1.501 0 N-CA-C 116.72 1.448 . . . . 0.0 116.72 176.646 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -68.79 -21.77 64.31 Favored 'General case' 0 N--CA 1.491 1.611 0 CA-C-N 120.254 2.027 . . . . 0.0 113.188 176.509 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 22.7 t -70.84 -23.7 62.38 Favored 'General case' 0 CA--C 1.557 1.222 0 C-N-CA 129.105 2.962 . . . . 0.0 113.593 173.659 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 47.3 mtm180 -86.07 -30.79 22.32 Favored 'General case' 0 C--N 1.354 0.8 0 N-CA-C 116.719 2.118 . . . . 0.0 116.719 -175.102 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 84.1 tttt -77.29 -10.12 59.24 Favored 'General case' 0 C--N 1.369 1.439 0 C-N-CA 126.397 1.879 . . . . 0.0 113.6 -177.509 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.509 ' HD2' ' CD2' ' A' ' 6' ' ' TYR . 31.6 mtmt -102.06 -30.38 11.21 Favored 'General case' 0 N--CA 1.442 -0.856 0 C-N-CA 126.648 1.979 . . . . 0.0 114.132 -178.878 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . 0.419 ' SG ' ' HB2' ' A' ' 6' ' ' TYR . 47.3 m -139.4 25.46 2.43 Favored 'General case' 0 C--N 1.36 1.031 0 O-C-N 120.652 -1.28 . . . . 0.0 114.275 -166.644 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 18.3 mt -145.98 -27.62 0.43 Allowed 'General case' 0 C--N 1.345 0.405 0 O-C-N 120.625 -1.297 . . . . 0.0 111.735 174.436 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 86.61 57.58 2.06 Favored Glycine 0 C--N 1.364 2.094 0 C-N-CA 126.739 2.114 . . . . 0.0 112.706 -173.169 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 15.6 ptmt . . . . . 0 C--O 1.262 1.754 0 N-CA-C 106.433 -1.691 . . . . 0.0 106.433 -176.274 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 84.8 t90 . . . . . 0 N--CA 1.436 -1.166 0 CA-C-O 122.141 0.972 . . . . 0.0 108.496 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 18.6 mm-40 -143.92 149.73 47.08 Favored Pre-proline 0 N--CA 1.442 -0.844 1 N-CA-C 98.596 -4.594 . . . . 0.0 98.596 170.486 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 23.7 Cg_endo -71.88 123.27 9.2 Favored 'Trans proline' 0 CA--C 1.559 1.761 0 C-N-CA 123.655 2.903 . . . . 0.0 114.747 -170.092 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . 0.433 ' HG2' ' CD2' ' A' ' 6' ' ' TYR . 43.7 Cg_endo -92.07 -113.93 0.0 OUTLIER 'Trans proline' 0 CA--C 1.543 0.931 1 C-N-CA 127.263 5.309 . . . . 0.0 110.196 -178.006 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . 0.443 ' CE3' ' CD1' ' A' ' 6' ' ' TYR . 4.6 p-90 -85.55 -70.46 0.59 Allowed 'General case' 0 C--N 1.38 1.911 0 C-N-CA 126.817 2.047 . . . . 0.0 114.48 177.029 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.475 ' CD1' ' HD2' ' A' ' 56' ' ' LYS . 0.1 OUTLIER -31.18 -52.27 0.19 Allowed 'General case' 0 C--N 1.365 1.24 1 C-N-CA 132.992 4.517 . . . . 0.0 118.411 -170.811 . . . . . . . . 4 4 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 2.3 m -58.75 -40.31 83.49 Favored 'General case' 0 C--N 1.35 0.613 0 C-N-CA 127.567 2.347 . . . . 0.0 114.633 -177.334 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 27.8 mtpp -98.24 15.21 25.17 Favored 'General case' 0 C--N 1.359 0.993 0 C-N-CA 125.9 1.68 . . . . 0.0 111.533 177.616 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 16.9 tt0 -92.27 125.42 56.45 Favored Pre-proline 0 C--N 1.364 1.199 0 O-C-N 119.176 -2.202 . . . . 0.0 110.735 -173.518 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_exo -62.21 145.36 96.22 Favored 'Trans proline' 0 CA--C 1.547 1.126 0 C-N-CA 124.28 3.32 . . . . 0.0 117.508 -169.525 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 7.8 p -79.74 130.88 35.37 Favored 'Isoleucine or valine' 0 C--N 1.369 1.417 0 C-N-CA 123.48 0.712 . . . . 0.0 110.673 174.086 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 22.8 mmt85 -128.91 133.4 47.87 Favored 'General case' 0 C--N 1.35 0.617 0 N-CA-C 104.736 -2.32 . . . . 0.0 104.736 -173.543 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.315 19.4 tt -99.02 -45.04 12.18 Favored 'Isoleucine or valine' 0 C--N 1.369 1.414 0 CA-C-N 122.769 2.531 . . . . 0.0 111.355 175.577 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 93.32 -169.55 30.58 Favored Glycine 0 C--N 1.358 1.761 0 C-N-CA 124.438 1.018 . . . . 0.0 111.348 -170.353 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 57.7 m -156.58 102.75 2.07 Favored 'General case' 0 C--N 1.357 0.904 0 O-C-N 118.257 -2.908 . . . . 0.0 113.418 -178.76 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 2.9 p -168.25 146.53 4.34 Favored 'General case' 0 C--N 1.352 0.677 0 N-CA-C 103.513 -2.773 . . . . 0.0 103.513 175.663 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 41.4 mmtm -77.74 44.36 0.45 Allowed 'General case' 0 C--N 1.359 1.014 0 N-CA-C 121.033 3.716 . . . . 0.0 121.033 -165.035 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 25.6 tttp -149.11 141.7 24.4 Favored 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 103.381 -2.822 . . . . 0.0 103.381 171.598 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -126.19 134.08 51.36 Favored 'General case' 0 C--N 1.357 0.917 0 CA-C-N 121.746 2.066 . . . . 0.0 107.766 178.386 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 25.8 m-85 -107.29 146.03 32.01 Favored 'General case' 0 C--N 1.356 0.851 0 C-N-CA 128.094 2.558 . . . . 0.0 109.215 177.093 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.8 t -70.4 136.73 49.85 Favored 'General case' 0 C--N 1.371 1.532 0 N-CA-C 117.902 2.556 . . . . 0.0 117.902 -175.717 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 33.9 p -145.63 161.36 40.01 Favored 'General case' 0 C--N 1.359 1.009 0 C-N-CA 124.79 1.236 . . . . 0.0 113.787 -176.577 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . 0.445 ' HB2' ' HB2' ' A' ' 47' ' ' PHE . 94.3 m-85 -132.49 134.65 45.29 Favored 'General case' 0 C--N 1.343 0.303 0 C-N-CA 126.121 1.768 . . . . 0.0 107.479 177.048 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 29.2 p90 -114.95 144.18 43.99 Favored 'General case' 0 C--N 1.366 1.294 0 N-CA-C 106.772 -1.566 . . . . 0.0 106.772 175.725 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . 0.414 ' HA ' ' HA ' ' A' ' 32' ' ' CYS . 11.9 t80 -89.55 119.12 29.7 Favored 'General case' 0 C--N 1.374 1.646 0 CA-C-N 122.274 2.306 . . . . 0.0 105.692 -179.467 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.59 ' HZ1' ' H ' ' A' ' 28' ' ' THR . 0.5 OUTLIER -89.03 116.41 27.29 Favored 'General case' 0 N--CA 1.429 -1.5 0 C-N-CA 125.303 1.441 . . . . 0.0 109.577 -176.71 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -64.99 -39.63 93.75 Favored 'General case' 0 C--N 1.343 0.317 0 N-CA-C 118.332 2.716 . . . . 0.0 118.332 -172.84 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' THR . . . . . 0.59 ' H ' ' HZ1' ' A' ' 26' ' ' LYS . 17.4 p -89.89 -2.86 58.28 Favored 'General case' 0 C--N 1.359 0.98 0 O-C-N 120.523 -1.36 . . . . 0.0 111.496 176.498 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -96.64 -46.88 6.14 Favored 'General case' 0 C--N 1.364 1.22 0 C-N-CA 125.196 1.398 . . . . 0.0 114.183 175.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . 0.296 18.8 tptt 89.3 19.42 0.04 OUTLIER 'General case' 0 C--N 1.368 1.385 0 C-N-CA 126.778 2.031 . . . . 0.0 113.333 -178.242 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 8.1 ptpp? -147.86 169.4 19.9 Favored 'General case' 0 C--N 1.352 0.698 0 C-N-CA 126.486 1.914 . . . . 0.0 108.237 176.728 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.414 ' HA ' ' HA ' ' A' ' 25' ' ' PHE . 74.0 m -90.86 141.33 28.93 Favored 'General case' 0 C--N 1.367 1.357 0 O-C-N 120.513 -1.367 . . . . 0.0 111.668 175.941 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.2 mt -110.93 146.03 33.63 Favored Pre-proline 0 C--N 1.347 0.48 0 N-CA-C 107.77 -1.196 . . . . 0.0 107.77 178.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 69.3 Cg_endo -86.58 149.52 8.76 Favored 'Trans proline' 0 N--CA 1.458 -0.606 0 C-N-CA 123.882 3.055 . . . . 0.0 112.797 -179.758 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 5.9 p90 -146.0 -161.52 1.33 Allowed 'General case' 0 N--CA 1.444 -0.774 0 N-CA-C 104.462 -2.422 . . . . 0.0 104.462 171.713 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 84.9 mt -141.96 148.23 38.27 Favored 'General case' 0 N--CA 1.433 -1.321 0 N-CA-C 101.048 -3.686 . . . . 0.0 101.048 173.815 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.443 ' CZ ' ' HA2' ' A' ' 39' ' ' GLY . 2.9 t80 -109.77 138.09 46.63 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 127.497 2.319 . . . . 0.0 106.44 176.925 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 51.8 m -78.62 -43.05 27.26 Favored 'General case' 0 C--N 1.373 1.601 0 CA-C-O 122.935 1.35 . . . . 0.0 111.899 178.615 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . 0.443 ' HA2' ' CZ ' ' A' ' 37' ' ' PHE . . . 125.12 -51.8 0.82 Allowed Glycine 0 C--N 1.349 1.265 0 C-N-CA 125.953 1.74 . . . . 0.0 109.772 -175.43 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 8.0 m -80.27 65.61 5.49 Favored 'General case' 0 C--N 1.357 0.903 0 N-CA-C 116.758 2.133 . . . . 0.0 116.758 -175.156 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 128.82 57.79 0.11 Allowed Glycine 0 C--N 1.37 2.425 0 N-CA-C 118.812 2.285 . . . . 0.0 118.812 173.325 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -103.2 -159.87 25.26 Favored Glycine 0 C--N 1.37 2.434 0 CA-C-N 119.992 1.896 . . . . 0.0 114.423 174.585 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . 0.538 ' H ' ' NH1' ' A' ' 46' ' ' ARG 0.304 46.9 p30 -136.93 -106.6 0.2 Allowed 'General case' 0 C--N 1.356 0.854 0 O-C-N 121.303 -1.116 . . . . 0.0 111.351 -179.809 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -167.75 29.32 0.03 OUTLIER 'General case' 0 C--N 1.355 0.805 0 C-N-CA 124.49 1.116 . . . . 0.0 111.888 -177.734 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 51.9 t-20 -105.94 34.26 3.4 Favored 'General case' 0 C--N 1.37 1.482 0 N-CA-C 105.442 -2.058 . . . . 0.0 105.442 173.523 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.538 ' NH1' ' H ' ' A' ' 43' ' ' ASN . 0.8 OUTLIER -121.91 110.6 16.06 Favored 'General case' 0 C--N 1.358 0.949 0 CA-C-O 125.172 2.415 . . . . 0.0 111.272 -172.554 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . 0.445 ' HB2' ' HB2' ' A' ' 23' ' ' PHE . 84.6 m-85 -92.59 127.23 38.01 Favored 'General case' 0 N--CA 1.445 -0.71 0 C-N-CA 129.569 3.148 . . . . 0.0 106.622 179.729 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.92 -17.35 59.79 Favored 'General case' 0 C--N 1.37 1.49 0 N-CA-C 117.025 2.232 . . . . 0.0 117.025 -173.982 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 31.2 p -142.74 171.49 13.98 Favored 'General case' 0 C--N 1.357 0.917 0 N-CA-C 102.649 -3.093 . . . . 0.0 102.649 175.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 6.7 tt -85.67 7.43 2.09 Favored 'Isoleucine or valine' 0 C--N 1.363 1.163 0 O-C-N 119.648 -1.907 . . . . 0.0 113.407 176.297 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -97.75 -13.82 42.46 Favored Glycine 0 C--N 1.362 2.012 0 O-C-N 119.596 -1.94 . . . . 0.0 113.498 178.024 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -85.87 -29.8 23.41 Favored 'General case' 0 C--N 1.359 0.99 0 C-N-CA 126.533 1.933 . . . . 0.0 110.114 175.363 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 6.8 t -37.75 -58.4 0.91 Allowed 'General case' 0 C--N 1.372 1.584 1 C-N-CA 133.302 4.641 . . . . 0.0 116.362 179.654 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.69 -12.11 60.9 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 130.399 3.479 . . . . 0.0 116.836 -178.778 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -86.26 -12.04 50.69 Favored 'General case' 0 C--N 1.368 1.392 0 O-C-N 119.8 -1.813 . . . . 0.0 114.458 -176.863 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.475 ' HD2' ' CD1' ' A' ' 6' ' ' TYR . 18.7 mtmt -105.02 -34.13 8.09 Favored 'General case' 0 C--N 1.352 0.68 0 C-N-CA 125.525 1.53 . . . . 0.0 110.53 177.572 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 17.8 m -124.17 15.49 9.12 Favored 'General case' 0 C--N 1.358 0.956 0 N-CA-C 117.236 2.31 . . . . 0.0 117.236 -169.073 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 15.0 mt -137.37 -26.55 0.99 Allowed 'General case' 0 N--CA 1.472 0.656 0 O-C-N 119.349 -2.095 . . . . 0.0 112.981 175.507 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 85.4 55.06 2.67 Favored Glycine 0 C--N 1.363 2.052 0 C-N-CA 127.911 2.672 . . . . 0.0 112.86 -171.922 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 8.6 ptpt . . . . . 0 C--O 1.263 1.774 0 CA-C-O 116.26 -1.828 . . . . 0.0 106.539 -178.229 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' TRP . . . . . 0.416 ' CZ2' ' HA ' ' A' ' 3' ' ' PRO . 20.8 t90 . . . . . 0 N--CA 1.432 -1.35 0 N-CA-C 106.224 -1.769 . . . . 0.0 106.224 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 37.1 mt-30 -143.42 143.25 23.36 Favored Pre-proline 0 C--N 1.351 0.648 1 N-CA-C 99.034 -4.432 . . . . 0.0 99.034 175.128 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.416 ' HA ' ' CZ2' ' A' ' 1' ' ' TRP . 28.8 Cg_endo -72.37 114.86 4.12 Favored 'Trans proline' 0 CA--C 1.555 1.528 0 C-N-CA 124.776 3.65 . . . . 0.0 117.846 -165.623 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 33.3 Cg_exo -77.76 -115.88 0.01 OUTLIER 'Trans proline' 0 C--N 1.371 1.722 1 C-N-CA 127.201 5.267 . . . . 0.0 114.428 177.318 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . 0.467 ' CE2' ' CE2' ' A' ' 6' ' ' TYR . 5.0 p-90 -85.44 -68.87 0.7 Allowed 'General case' 0 C--N 1.38 1.902 0 C-N-CA 128.129 2.572 . . . . 0.0 114.874 -178.164 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.502 ' CD2' ' HD2' ' A' ' 56' ' ' LYS . 0.1 OUTLIER -31.67 -56.98 0.28 Allowed 'General case' 0 CA--C 1.492 -1.288 1 C-N-CA 133.717 4.807 . . . . 0.0 116.989 -172.222 . . . . . . . . 4 4 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -56.53 -44.52 80.91 Favored 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 129.158 2.983 . . . . 0.0 115.239 -178.109 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 45.8 mttm -93.18 -13.94 27.77 Favored 'General case' 0 C--N 1.358 0.943 0 C-N-CA 128.921 2.889 . . . . 0.0 113.638 -177.662 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -71.41 135.6 84.14 Favored Pre-proline 0 C--N 1.361 1.074 0 C-N-CA 127.581 2.352 . . . . 0.0 113.25 -175.06 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_exo -65.63 131.01 26.41 Favored 'Trans proline' 0 C--N 1.358 1.077 0 C-N-CA 124.232 3.288 . . . . 0.0 118.959 -167.119 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 8.2 p -77.33 124.39 35.65 Favored 'Isoleucine or valine' 0 C--N 1.368 1.395 0 C-N-CA 127.825 2.45 . . . . 0.0 113.912 175.535 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.409 ' HB2' HH22 ' A' ' 46' ' ' ARG . 1.0 OUTLIER -147.37 133.12 18.94 Favored 'General case' 0 C--N 1.367 1.344 0 C-N-CA 126.951 2.1 . . . . 0.0 112.906 -174.228 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.287 7.2 tt -88.26 -48.4 15.0 Favored 'Isoleucine or valine' 0 C--N 1.372 1.562 0 N-CA-C 117.619 2.451 . . . . 0.0 117.619 179.795 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 83.94 -167.21 43.66 Favored Glycine 0 C--N 1.364 2.122 0 N-CA-C 117.411 1.724 . . . . 0.0 117.411 -170.231 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 17.8 m -171.24 76.03 0.06 Allowed 'General case' 0 C--N 1.361 1.084 0 O-C-N 119.695 -2.062 . . . . 0.0 105.816 179.389 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 2.8 t -125.13 -71.76 0.69 Allowed 'General case' 0 C--N 1.354 0.79 0 CA-C-N 114.677 -1.147 . . . . 0.0 111.869 -174.784 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 31.1 mmmt -96.7 -80.08 0.44 Allowed 'General case' 0 C--N 1.349 0.553 0 C-N-CA 124.179 0.992 . . . . 0.0 112.835 -174.609 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 12.0 ptmm? -146.87 -145.61 0.17 Allowed 'General case' 0 CA--C 1.503 -0.843 0 N-CA-C 102.328 -3.212 . . . . 0.0 102.328 178.608 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 5.1 mm100 -126.04 112.35 15.77 Favored 'General case' 0 N--CA 1.438 -1.058 0 N-CA-C 100.475 -3.898 . . . . 0.0 100.475 170.333 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 50.0 m-85 -94.4 144.23 25.73 Favored 'General case' 0 C--N 1.364 1.224 0 C-N-CA 126.385 1.874 . . . . 0.0 108.804 -179.654 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 4.9 t -67.54 112.74 4.87 Favored 'General case' 0 C--N 1.367 1.333 0 C-N-CA 126.723 2.009 . . . . 0.0 115.918 -175.764 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 4.6 p -120.26 -167.11 1.4 Allowed 'General case' 0 C--N 1.365 1.248 0 CA-C-O 123.263 1.506 . . . . 0.0 112.924 177.611 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 14.8 m-85 -148.99 136.82 20.58 Favored 'General case' 0 N--CA 1.446 -0.667 0 C-N-CA 129.236 3.014 . . . . 0.0 103.706 170.846 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 9.9 p90 -119.57 152.06 37.63 Favored 'General case' 0 C--N 1.364 1.216 0 CA-C-N 123.074 2.67 . . . . 0.0 109.684 173.102 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 19.6 t80 -94.01 121.66 35.71 Favored 'General case' 0 C--N 1.363 1.158 0 N-CA-C 106.45 -1.685 . . . . 0.0 106.45 -179.157 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 4.9 ttpp -90.9 108.59 19.94 Favored 'General case' 0 C--N 1.367 1.35 0 C-N-CA 123.48 0.712 . . . . 0.0 109.109 176.235 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 11.1 t-105 -52.09 -38.95 58.96 Favored 'General case' 0 C--N 1.355 0.823 0 C-N-CA 128.68 2.792 . . . . 0.0 117.1 -177.925 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 2.1 p -79.42 -30.09 42.17 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 129.686 3.194 . . . . 0.0 113.486 -179.397 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -86.1 -37.31 18.95 Favored 'General case' 0 C--N 1.365 1.273 0 C-N-CA 124.72 1.208 . . . . 0.0 111.473 177.748 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . 0.326 1.5 tptp 80.01 26.39 0.34 Allowed 'General case' 0 C--N 1.361 1.082 0 C-N-CA 127.693 2.397 . . . . 0.0 112.801 -178.621 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.47 ' HZ2' ' HD3' ' A' ' 54' ' ' ARG . 4.5 tmtt? -147.52 177.27 9.39 Favored 'General case' 0 C--N 1.363 1.171 0 C-N-CA 125.827 1.651 . . . . 0.0 110.87 175.476 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 61.8 m -93.17 122.53 35.65 Favored 'General case' 0 C--N 1.363 1.161 0 C-N-CA 129.043 2.937 . . . . 0.0 114.394 -175.731 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 19.2 mt -104.42 142.44 24.63 Favored Pre-proline 0 C--N 1.358 0.96 0 CA-C-O 117.83 -1.081 . . . . 0.0 109.971 177.536 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 96.9 Cg_endo -82.12 127.62 5.39 Favored 'Trans proline' 0 CA--C 1.531 0.334 0 C-N-CA 123.878 3.052 . . . . 0.0 112.273 175.541 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . 0.261 0.2 OUTLIER -141.39 177.45 8.1 Favored 'General case' 0 C--N 1.35 0.621 0 N-CA-C 102.325 -3.213 . . . . 0.0 102.325 169.512 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 1.1 mp -117.88 165.56 13.53 Favored 'General case' 0 N--CA 1.44 -0.96 0 C-N-CA 125.27 1.428 . . . . 0.0 107.263 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.439 ' CE2' ' HA2' ' A' ' 39' ' ' GLY . 30.3 t80 -123.01 136.52 54.88 Favored 'General case' 0 CA--C 1.551 1.011 0 C-N-CA 125.578 1.551 . . . . 0.0 112.071 178.882 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.9 t -88.08 -24.6 23.38 Favored 'General case' 0 C--N 1.38 1.9 0 CA-C-N 122.073 2.215 . . . . 0.0 114.315 173.422 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . 0.439 ' HA2' ' CE2' ' A' ' 37' ' ' PHE . . . 118.23 -58.66 0.51 Allowed Glycine 0 C--N 1.361 1.93 0 C-N-CA 125.78 1.657 . . . . 0.0 114.166 175.411 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -102.81 115.91 31.52 Favored 'General case' 0 C--N 1.351 0.635 0 C-N-CA 126.307 1.843 . . . . 0.0 106.654 178.721 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 134.46 -45.86 1.09 Allowed Glycine 0 CA--C 1.49 -1.528 0 N-CA-C 109.861 -1.296 . . . . 0.0 109.861 -174.435 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -93.45 -165.93 37.71 Favored Glycine 0 C--N 1.36 1.907 0 O-C-N 121.13 -1.217 . . . . 0.0 113.932 173.263 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . 0.392 3.9 p30 -134.37 -99.81 0.25 Allowed 'General case' 0 C--N 1.353 0.734 0 O-C-N 121.177 -1.19 . . . . 0.0 113.466 179.916 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -150.79 24.4 0.76 Allowed 'General case' 0 C--N 1.374 1.635 0 N-CA-C 117.022 2.23 . . . . 0.0 117.022 -171.059 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . 0.423 ' H ' ' NH1' ' A' ' 46' ' ' ARG . 40.2 t30 -101.7 48.2 0.89 Allowed 'General case' 0 N--CA 1.491 1.587 0 N-CA-C 105.106 -2.183 . . . . 0.0 105.106 171.458 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.423 ' NH1' ' H ' ' A' ' 45' ' ' ASN . 0.0 OUTLIER -146.3 118.42 8.3 Favored 'General case' 0 CA--C 1.492 -1.276 0 N-CA-C 104.275 -2.491 . . . . 0.0 104.275 -176.131 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . 0.431 ' CD2' ' HA ' ' A' ' 53' ' ' CYS . 21.8 m-85 -107.23 129.41 54.87 Favored 'General case' 0 N--CA 1.429 -1.49 0 C-N-CA 127.681 2.392 . . . . 0.0 107.524 -165.261 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 23.4 mp0 -70.06 -30.45 67.71 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 126.249 1.82 . . . . 0.0 115.558 -169.107 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 1.4 p -146.21 168.3 21.37 Favored 'General case' 0 C--N 1.352 0.696 0 N-CA-C 104.272 -2.492 . . . . 0.0 104.272 176.268 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 2.3 tt -84.23 138.31 19.4 Favored 'Isoleucine or valine' 0 C--N 1.37 1.484 0 C-N-CA 125.576 1.55 . . . . 0.0 108.246 176.288 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 117.17 -50.06 0.82 Allowed Glycine 0 C--N 1.364 2.105 0 N-CA-C 107.49 -2.244 . . . . 0.0 107.49 -157.367 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 16.2 tp10 -77.71 -20.03 54.24 Favored 'General case' 0 C--N 1.366 1.324 0 N-CA-C 115.813 1.783 . . . . 0.0 115.813 -178.297 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . 0.431 ' HA ' ' CD2' ' A' ' 47' ' ' PHE . 52.7 t -77.57 -42.03 36.75 Favored 'General case' 0 C--N 1.361 1.094 0 C-N-CA 128.509 2.723 . . . . 0.0 112.882 177.923 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.47 ' HD3' ' HZ2' ' A' ' 31' ' ' LYS . 72.5 mtm180 -74.52 -45.73 43.85 Favored 'General case' 0 N--CA 1.447 -0.609 1 C-N-CA 133.732 4.813 . . . . 0.0 112.466 179.96 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 69.8 tttt -82.63 55.03 2.83 Favored 'General case' 0 C--N 1.373 1.609 0 CA-C-O 123.616 1.674 . . . . 0.0 111.852 174.198 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.502 ' HD2' ' CD2' ' A' ' 6' ' ' TYR . 22.1 mtmt -167.77 -47.03 0.02 OUTLIER 'General case' 0 N--CA 1.444 -0.763 0 C-N-CA 129.977 3.311 . . . . 0.0 105.171 -178.547 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . 0.45 ' SG ' ' HB2' ' A' ' 6' ' ' TYR . 56.3 m -121.65 7.87 10.03 Favored 'General case' 0 C--N 1.357 0.914 0 N-CA-C 119.579 3.178 . . . . 0.0 119.579 -172.942 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 18.7 mt -133.83 -8.6 2.75 Favored 'General case' 0 N--CA 1.481 1.115 0 CA-C-N 125.646 3.839 . . . . 0.0 114.066 175.288 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 67.82 59.35 6.61 Favored Glycine 0 C--N 1.359 1.832 0 C-N-CA 128.262 2.839 . . . . 0.0 113.863 -171.449 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 2.5 ptpp? . . . . . 0 C--O 1.264 1.824 0 N-CA-C 102.366 -3.198 . . . . 0.0 102.366 -175.396 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' TRP . . . . . 0.54 ' CZ2' ' HB3' ' A' ' 3' ' ' PRO . 9.6 t90 . . . . . 0 N--CA 1.433 -1.32 0 N-CA-C 108.076 -1.083 . . . . 0.0 108.076 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 16.6 mm-40 -142.02 150.09 54.78 Favored Pre-proline 0 C--N 1.353 0.758 1 N-CA-C 98.382 -4.673 . . . . 0.0 98.382 171.07 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.54 ' HB3' ' CZ2' ' A' ' 1' ' ' TRP . 87.5 Cg_endo -80.76 132.79 8.91 Favored 'Trans proline' 0 CA--C 1.563 1.933 0 CA-C-N 124.291 2.568 . . . . 0.0 113.455 -166.8 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . 0.41 ' HG2' ' CD2' ' A' ' 6' ' ' TYR . 44.7 Cg_endo -94.46 -113.22 0.0 OUTLIER 'Trans proline' 0 CA--C 1.546 1.119 1 C-N-CA 127.114 5.209 . . . . 0.0 110.784 -178.053 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . 0.433 ' CE3' ' CD1' ' A' ' 6' ' ' TYR 0.265 52.7 p-90 -86.98 -69.71 0.66 Allowed 'General case' 0 C--N 1.384 2.103 0 C-N-CA 128.097 2.559 . . . . 0.0 114.926 178.902 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.501 ' CD1' ' HD2' ' A' ' 56' ' ' LYS . 0.0 OUTLIER -32.8 -51.59 0.3 Allowed 'General case' 0 C--N 1.368 1.386 1 C-N-CA 132.472 4.309 . . . . 0.0 117.575 -174.168 . . . . . . . . 4 4 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 3.0 m -60.75 -28.7 68.9 Favored 'General case' 0 CA--C 1.507 -0.708 0 C-N-CA 129.275 3.03 . . . . 0.0 118.127 -175.305 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . 0.25 61.2 tttm -118.41 17.72 13.74 Favored 'General case' 0 C--N 1.355 0.81 0 C-N-CA 128.276 2.63 . . . . 0.0 108.487 -178.218 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 22.9 tp10 -94.86 127.78 41.9 Favored Pre-proline 0 C--N 1.36 1.041 0 O-C-N 119.263 -2.148 . . . . 0.0 112.722 -173.428 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_exo -72.99 140.9 32.22 Favored 'Trans proline' 0 C--N 1.352 0.746 0 C-N-CA 123.903 3.069 . . . . 0.0 113.45 -169.814 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -81.41 153.07 4.18 Favored 'Isoleucine or valine' 0 C--N 1.362 1.109 0 N-CA-C 115.426 1.639 . . . . 0.0 115.426 178.871 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -147.0 119.8 8.65 Favored 'General case' 0 N--CA 1.438 -1.034 0 C-N-CA 125.369 1.468 . . . . 0.0 111.14 -178.281 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.285 11.7 tt -74.02 -40.7 52.25 Favored 'Isoleucine or valine' 0 C--N 1.357 0.894 0 N-CA-C 115.413 1.634 . . . . 0.0 115.413 175.829 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 124.21 -166.38 16.81 Favored Glycine 0 C--N 1.352 1.419 0 N-CA-C 109.617 -1.393 . . . . 0.0 109.617 -178.933 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 15.4 m -106.3 -5.32 19.2 Favored 'General case' 0 C--N 1.357 0.925 0 N-CA-C 115.272 1.582 . . . . 0.0 115.272 -179.109 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 81.4 m -111.03 170.48 8.08 Favored 'General case' 0 C--N 1.359 1.008 0 O-C-N 119.871 -1.768 . . . . 0.0 110.355 -178.808 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.446 ' NZ ' HE21 ' A' ' 19' ' ' GLN . 4.2 mmmp? -111.05 58.27 0.62 Allowed 'General case' 0 C--N 1.356 0.87 0 C-N-CA 125.432 1.493 . . . . 0.0 110.707 177.007 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 38.3 ttmt -134.25 124.97 26.81 Favored 'General case' 0 CA--C 1.504 -0.823 1 N-CA-C 99.545 -4.243 . . . . 0.0 99.545 174.394 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . 0.446 HE21 ' NZ ' ' A' ' 17' ' ' LYS . 0.0 OUTLIER -130.31 128.04 40.71 Favored 'General case' 0 C--N 1.354 0.768 0 C-N-CA 123.873 0.869 . . . . 0.0 112.339 -170.071 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 26.8 m-85 -112.04 135.33 52.82 Favored 'General case' 0 C--N 1.358 0.966 0 C-N-CA 127.294 2.238 . . . . 0.0 107.7 177.184 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' SER . . . . . 0.448 ' HA ' ' HG ' ' A' ' 36' ' ' LEU 0.277 4.0 t -69.26 132.31 46.27 Favored 'General case' 0 C--N 1.375 1.684 0 N-CA-C 116.492 2.034 . . . . 0.0 116.492 -177.133 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 3.2 p -146.06 -172.08 3.85 Favored 'General case' 0 N--CA 1.448 -0.538 0 C-N-CA 127.633 2.373 . . . . 0.0 110.312 -173.029 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 48.6 m-85 -145.27 153.37 41.22 Favored 'General case' 0 C--N 1.35 0.628 0 C-N-CA 128.631 2.772 . . . . 0.0 110.733 177.083 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . 0.251 12.5 p90 -131.98 154.93 48.83 Favored 'General case' 0 C--N 1.373 1.624 0 C-N-CA 125.292 1.437 . . . . 0.0 108.671 168.106 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 16.2 t80 -94.97 111.88 23.63 Favored 'General case' 0 C--N 1.365 1.268 0 O-C-N 119.716 -1.865 . . . . 0.0 107.966 -179.477 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -83.38 107.03 15.62 Favored 'General case' 0 C--N 1.363 1.195 0 O-C-N 120.366 -1.459 . . . . 0.0 111.83 -176.51 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 41.1 t-105 -46.05 -53.59 9.95 Favored 'General case' 0 C--N 1.357 0.931 1 C-N-CA 132.155 4.182 . . . . 0.0 117.746 -171.546 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.5 p -81.27 -15.74 54.63 Favored 'General case' 0 C--N 1.353 0.723 0 C-N-CA 126.657 1.983 . . . . 0.0 113.084 179.686 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -88.79 -37.63 15.27 Favored 'General case' 0 C--N 1.366 1.299 0 C-N-CA 124.175 0.99 . . . . 0.0 112.044 174.304 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . 0.301 12.0 mmmm 77.25 27.03 0.68 Allowed 'General case' 0 C--N 1.366 1.309 0 C-N-CA 129.562 3.145 . . . . 0.0 113.327 -178.519 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 52.1 pttt -146.45 163.97 33.97 Favored 'General case' 0 C--N 1.355 0.811 0 C-N-CA 125.807 1.643 . . . . 0.0 110.502 -179.572 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 89.4 m -80.48 126.34 31.09 Favored 'General case' 0 C--N 1.359 0.991 0 C-N-CA 128.308 2.643 . . . . 0.0 115.222 -177.247 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 13.2 mt -112.19 147.58 37.26 Favored Pre-proline 0 C--N 1.36 1.039 0 O-C-N 120.461 -1.4 . . . . 0.0 108.725 176.298 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -86.57 142.54 7.02 Favored 'Trans proline' 0 C--N 1.344 0.311 1 C-N-CA 125.542 4.161 . . . . 0.0 111.444 170.976 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -145.7 165.12 29.68 Favored 'General case' 0 N--CA 1.439 -0.993 1 N-CA-C 98.313 -4.699 . . . . 0.0 98.313 169.691 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.448 ' HG ' ' HA ' ' A' ' 21' ' ' SER . 7.8 mp -109.72 149.93 29.04 Favored 'General case' 0 N--CA 1.44 -0.942 0 N-CA-C 104.428 -2.434 . . . . 0.0 104.428 174.922 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -100.51 138.15 37.96 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 126.953 2.101 . . . . 0.0 109.129 176.598 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 9.2 t -107.66 119.0 38.21 Favored 'General case' 0 C--N 1.363 1.179 0 N-CA-C 104.585 -2.376 . . . . 0.0 104.585 171.521 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -68.93 19.58 0.43 Allowed Glycine 0 N--CA 1.479 1.515 0 C-N-CA 127.681 2.563 . . . . 0.0 119.134 -178.397 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 78.7 m -114.12 56.22 0.72 Allowed 'General case' 0 C--N 1.354 0.791 0 C-N-CA 128.943 2.897 . . . . 0.0 108.825 172.355 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 118.29 54.77 0.28 Allowed Glycine 0 C--N 1.359 1.842 0 N-CA-C 120.367 2.907 . . . . 0.0 120.367 171.107 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -86.47 -176.72 49.62 Favored Glycine 0 C--N 1.37 2.466 0 CA-C-N 121.48 2.64 . . . . 0.0 116.412 175.12 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . 0.498 ' H ' ' CZ ' ' A' ' 46' ' ' ARG 0.355 30.2 p30 -113.07 -112.88 0.34 Allowed 'General case' 0 C--N 1.362 1.136 0 O-C-N 119.923 -1.927 . . . . 0.0 114.435 179.887 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -141.64 -9.31 0.94 Allowed 'General case' 0 C--N 1.354 0.761 0 O-C-N 120.406 -1.434 . . . . 0.0 112.894 -174.814 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 61.7 t30 -101.53 57.2 0.84 Allowed 'General case' 0 C--N 1.365 1.261 0 O-C-N 120.19 -1.568 . . . . 0.0 109.969 -179.409 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.498 ' CZ ' ' H ' ' A' ' 43' ' ' ASN 0.37 0.0 OUTLIER -131.06 130.53 43.35 Favored 'General case' 0 CA--C 1.498 -1.033 0 CA-C-O 124.415 2.055 . . . . 0.0 110.197 178.292 . . . . . . . . 4 4 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 10.5 m-85 -114.75 131.42 56.78 Favored 'General case' 0 C--N 1.35 0.593 0 C-N-CA 128.388 2.675 . . . . 0.0 106.894 -177.258 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -85.99 -27.08 25.07 Favored 'General case' 0 C--N 1.371 1.523 0 CA-C-N 121.62 2.009 . . . . 0.0 115.579 -177.311 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 23.9 p -125.19 155.72 39.57 Favored 'General case' 0 C--N 1.351 0.667 0 N-CA-C 104.8 -2.296 . . . . 0.0 104.8 177.497 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 16.4 tt -58.87 -32.17 46.59 Favored 'Isoleucine or valine' 0 C--N 1.36 1.046 0 N-CA-C 117.347 2.351 . . . . 0.0 117.347 -177.621 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -91.37 1.68 76.84 Favored Glycine 0 C--N 1.358 1.782 0 O-C-N 120.187 -1.571 . . . . 0.0 115.795 178.222 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 15.6 tp10 -82.28 -20.23 37.93 Favored 'General case' 0 C--N 1.365 1.248 0 O-C-N 120.896 -1.355 . . . . 0.0 110.67 170.774 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 19.7 t -72.12 -30.19 64.82 Favored 'General case' 0 C--N 1.363 1.162 0 C-N-CA 129.07 2.948 . . . . 0.0 112.86 175.573 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 43.8 mtp180 -76.16 -48.56 20.12 Favored 'General case' 0 C--N 1.355 0.81 0 C-N-CA 127.697 2.399 . . . . 0.0 114.875 176.461 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 30.8 ttmt -82.15 59.92 4.67 Favored 'General case' 0 C--N 1.361 1.075 0 C-N-CA 127.809 2.444 . . . . 0.0 111.841 -174.266 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.501 ' HD2' ' CD1' ' A' ' 6' ' ' TYR . 23.9 mtmt -179.62 -39.81 0.01 OUTLIER 'General case' 0 N--CA 1.439 -0.993 0 C-N-CA 130.854 3.662 . . . . 0.0 106.09 -176.11 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . 0.409 ' O ' ' CZ2' ' A' ' 1' ' ' TRP . 67.7 m -125.01 7.38 7.98 Favored 'General case' 0 C--N 1.364 1.238 0 N-CA-C 119.862 3.282 . . . . 0.0 119.862 -170.503 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 14.7 mt -140.58 -8.97 1.09 Allowed 'General case' 0 N--CA 1.476 0.834 0 CA-C-N 124.124 3.147 . . . . 0.0 114.466 169.713 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 71.41 51.32 17.42 Favored Glycine 0 C--N 1.356 1.654 0 C-N-CA 128.107 2.765 . . . . 0.0 113.395 -171.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 12.3 ptpt . . . . . 0 C--O 1.26 1.629 0 N-CA-C 103.707 -2.701 . . . . 0.0 103.707 -174.195 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' TRP . . . . . 0.418 ' CZ2' ' HA ' ' A' ' 3' ' ' PRO . 23.3 t90 . . . . . 0 N--CA 1.433 -1.297 0 N-CA-C 108.254 -1.017 . . . . 0.0 108.254 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 23.5 mm-40 -144.14 144.06 24.7 Favored Pre-proline 0 C--N 1.353 0.726 0 N-CA-C 100.482 -3.895 . . . . 0.0 100.482 174.927 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.418 ' HA ' ' CZ2' ' A' ' 1' ' ' TRP . 19.9 Cg_endo -72.69 122.59 8.34 Favored 'Trans proline' 0 CA--C 1.557 1.631 0 CA-C-N 124.782 2.744 . . . . 0.0 116.441 -169.257 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -91.78 -123.15 0.01 OUTLIER 'Trans proline' 0 CA--C 1.555 1.533 1 C-N-CA 127.034 5.156 . . . . 0.0 111.81 178.694 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . 0.469 ' CE3' ' CD1' ' A' ' 6' ' ' TYR 0.336 54.7 p-90 -73.09 -74.14 0.18 Allowed 'General case' 0 C--N 1.384 2.076 0 C-N-CA 126.521 1.928 . . . . 0.0 114.44 178.538 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.531 ' CD1' ' HD2' ' A' ' 56' ' ' LYS . 0.1 OUTLIER -32.04 -51.46 0.24 Allowed 'General case' 0 C--N 1.363 1.169 1 C-N-CA 132.183 4.193 . . . . 0.0 117.469 -175.619 . . . . . . . . 4 4 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.1 m -71.5 -8.01 51.19 Favored 'General case' 0 CA--C 1.51 -0.587 0 C-N-CA 129.885 3.274 . . . . 0.0 115.747 -176.902 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 47.8 mttp -134.81 11.63 3.67 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 128.118 2.567 . . . . 0.0 107.242 -179.604 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.408 ' HA ' ' HD3' ' A' ' 10' ' ' PRO . 34.9 tp10 -96.85 134.42 23.08 Favored Pre-proline 0 C--N 1.364 1.228 0 N-CA-C 115.092 1.515 . . . . 0.0 115.092 -167.849 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.408 ' HD3' ' HA ' ' A' ' 9' ' ' GLU . 72.0 Cg_exo -66.35 121.1 8.32 Favored 'Trans proline' 0 C--N 1.365 1.433 0 C-N-CA 124.707 3.604 . . . . 0.0 116.182 -169.495 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 14.3 p -69.39 136.46 26.2 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.908 0 C-N-CA 127.642 2.377 . . . . 0.0 112.885 177.584 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 61.6 mtp180 -146.33 126.09 13.46 Favored 'General case' 0 C--N 1.359 1.02 0 C-N-CA 125.237 1.415 . . . . 0.0 111.869 -172.274 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 12.9 tt -103.65 -37.27 4.49 Favored 'Isoleucine or valine' 0 C--N 1.37 1.482 0 C-N-CA 126.334 1.854 . . . . 0.0 112.452 175.593 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 70.38 154.7 1.29 Allowed Glycine 0 C--N 1.366 2.195 0 C-N-CA 127.171 2.319 . . . . 0.0 116.95 176.722 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 58.6 p -93.27 71.53 4.49 Favored 'General case' 0 C--N 1.356 0.886 0 O-C-N 120.456 -1.614 . . . . 0.0 112.693 -178.452 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 4.1 t -125.89 -127.55 0.24 Allowed 'General case' 0 C--N 1.353 0.752 0 C-N-CA 123.518 0.727 . . . . 0.0 112.682 -175.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 2.3 mtmp? -79.9 -99.4 0.03 OUTLIER 'General case' 0 C--N 1.356 0.886 0 N-CA-C 120.296 3.443 . . . . 0.0 120.296 -172.548 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 15.0 tppt? -122.32 138.58 54.46 Favored 'General case' 0 C--N 1.359 1.019 0 N-CA-C 106.547 -1.649 . . . . 0.0 106.547 -174.153 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . 0.337 4.1 mp0 -93.5 121.15 34.61 Favored 'General case' 0 C--N 1.358 0.946 0 CA-C-O 122.955 1.359 . . . . 0.0 112.075 178.736 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 30.0 m-85 -108.21 150.13 27.66 Favored 'General case' 0 C--N 1.356 0.874 0 C-N-CA 128.148 2.579 . . . . 0.0 106.069 -179.176 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 4.1 t -72.0 143.95 49.01 Favored 'General case' 0 C--N 1.368 1.404 0 N-CA-C 117.127 2.269 . . . . 0.0 117.127 -173.536 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 27.7 p -145.87 -173.28 4.11 Favored 'General case' 0 C--N 1.36 1.062 0 C-N-CA 127.934 2.494 . . . . 0.0 112.458 -177.856 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . 0.431 ' HA ' ' HA ' ' A' ' 34' ' ' PRO . 43.0 m-85 -139.69 153.21 47.19 Favored 'General case' 0 C--N 1.361 1.089 0 C-N-CA 129.454 3.102 . . . . 0.0 111.66 174.876 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . 0.282 10.7 p90 -147.93 161.42 41.36 Favored 'General case' 0 C--N 1.367 1.355 0 C-N-CA 126.437 1.895 . . . . 0.0 110.158 172.134 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . 0.409 ' CD2' ' HB2' ' A' ' 57' ' ' CYS . 27.5 t80 -100.53 127.44 46.9 Favored 'General case' 0 C--N 1.368 1.387 0 O-C-N 120.54 -1.35 . . . . 0.0 108.274 178.438 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 1.7 ttpp -85.77 103.17 14.3 Favored 'General case' 0 C--N 1.364 1.21 0 C-N-CA 124.334 1.054 . . . . 0.0 112.04 177.873 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 35.3 t-105 -50.69 -44.43 57.92 Favored 'General case' 0 C--N 1.35 0.612 0 C-N-CA 129.301 3.04 . . . . 0.0 116.116 179.361 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 3.7 p -87.31 -6.56 58.47 Favored 'General case' 0 C--N 1.36 1.064 0 C-N-CA 125.193 1.397 . . . . 0.0 113.326 178.478 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -99.51 -38.48 8.76 Favored 'General case' 0 C--N 1.368 1.376 0 CA-C-N 120.561 1.528 . . . . 0.0 112.095 173.701 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . 0.273 30.4 tptt 84.36 23.59 0.11 Allowed 'General case' 0 C--N 1.367 1.351 0 C-N-CA 127.623 2.369 . . . . 0.0 111.616 -176.258 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 55.2 mtmt -145.54 166.43 25.75 Favored 'General case' 0 C--N 1.357 0.92 0 C-N-CA 126.636 1.974 . . . . 0.0 109.55 -177.61 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 75.0 m -89.39 145.8 25.1 Favored 'General case' 0 C--N 1.358 0.938 0 C-N-CA 127.646 2.379 . . . . 0.0 113.293 -178.791 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 44.6 mt -129.09 148.93 71.08 Favored Pre-proline 0 C--N 1.357 0.934 0 C-N-CA 125.296 1.438 . . . . 0.0 109.182 176.298 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.431 ' HA ' ' HA ' ' A' ' 23' ' ' PHE . 18.6 Cg_endo -86.64 162.31 9.34 Favored 'Trans proline' 0 N--CA 1.46 -0.445 0 C-N-CA 123.267 2.645 . . . . 0.0 110.868 165.933 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . 0.352 2.9 p90 -149.55 -159.24 1.01 Allowed 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 113.269 -1.787 . . . . 0.0 108.332 174.775 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 18.8 mt -139.65 144.94 37.88 Favored 'General case' 0 N--CA 1.439 -1.016 0 N-CA-C 103.323 -2.843 . . . . 0.0 103.323 -178.598 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.43 ' CE2' ' HA2' ' A' ' 39' ' ' GLY . 12.3 t80 -121.2 128.97 52.97 Favored 'General case' 0 CA--C 1.551 0.982 0 C-N-CA 128.852 2.861 . . . . 0.0 109.338 -179.792 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 37.7 m -76.52 2.57 13.48 Favored 'General case' 0 C--N 1.388 2.252 0 N-CA-C 115.976 1.843 . . . . 0.0 115.976 -178.318 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . 0.43 ' HA2' ' CE2' ' A' ' 37' ' ' PHE . . . 83.85 -39.45 2.85 Favored Glycine 0 C--N 1.358 1.776 0 N-CA-C 118.374 2.11 . . . . 0.0 118.374 176.3 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -125.51 38.06 4.25 Favored 'General case' 0 C--N 1.35 0.595 0 C-N-CA 124.514 1.125 . . . . 0.0 108.591 178.484 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -147.8 28.31 1.44 Allowed Glycine 0 C--N 1.356 1.655 0 N-CA-C 116.762 1.465 . . . . 0.0 116.762 -176.398 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -105.43 178.36 23.31 Favored Glycine 0 C--N 1.356 1.644 0 O-C-N 119.598 -2.119 . . . . 0.0 116.467 177.727 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . 0.449 ' CG ' ' H ' ' A' ' 44' ' ' ALA . 43.6 p-10 -127.31 -92.98 0.48 Allowed 'General case' 0 C--N 1.356 0.882 0 C-N-CA 124.615 1.166 . . . . 0.0 112.5 176.425 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . 0.449 ' H ' ' CG ' ' A' ' 43' ' ' ASN . . . -136.52 -30.0 0.93 Allowed 'General case' 0 C--N 1.358 0.972 0 N-CA-C 114.537 1.31 . . . . 0.0 114.537 -172.182 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 45.5 t30 -92.72 72.09 4.93 Favored 'General case' 0 C--N 1.372 1.547 0 O-C-N 119.743 -1.848 . . . . 0.0 111.918 -176.343 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . 0.377 0.0 OUTLIER -135.77 125.59 25.65 Favored 'General case' 0 C--N 1.351 0.673 0 CA-C-O 124.517 2.103 . . . . 0.0 110.238 174.606 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 20.2 m-30 -105.0 137.83 42.15 Favored 'General case' 0 N--CA 1.441 -0.905 0 C-N-CA 128.69 2.796 . . . . 0.0 107.795 -176.526 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 30.9 mt-30 -74.73 -45.65 42.61 Favored 'General case' 0 C--N 1.368 1.41 0 N-CA-C 114.734 1.383 . . . . 0.0 114.734 -177.413 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 30.1 p -129.56 172.23 11.78 Favored 'General case' 0 C--N 1.353 0.744 0 N-CA-C 105.529 -2.026 . . . . 0.0 105.529 175.747 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 18.6 tt -59.55 -28.07 39.08 Favored 'Isoleucine or valine' 0 C--N 1.365 1.281 0 C-N-CA 128.869 2.868 . . . . 0.0 117.05 178.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -84.75 -8.9 82.09 Favored Glycine 0 C--N 1.361 1.956 0 N-CA-C 115.961 1.144 . . . . 0.0 115.961 -177.226 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -88.49 -1.93 58.32 Favored 'General case' 0 C--N 1.362 1.123 0 C-N-CA 126.06 1.744 . . . . 0.0 111.248 176.274 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 33.9 t -85.05 -47.79 9.86 Favored 'General case' 0 C--N 1.355 0.821 0 C-N-CA 128.333 2.653 . . . . 0.0 112.983 -178.191 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.438 ' HB2' ' HD2' ' A' ' 60' ' ' LYS 0.338 0.0 OUTLIER -85.79 -25.27 26.45 Favored 'General case' 0 C--O 1.234 0.277 0 C-N-CA 128.64 2.776 . . . . 0.0 111.815 -179.916 . . . . . . . . 4 4 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.67 -25.39 63.88 Favored 'General case' 0 C--N 1.373 1.601 0 C-N-CA 125.857 1.663 . . . . 0.0 113.794 171.696 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.531 ' HD2' ' CD1' ' A' ' 6' ' ' TYR . 23.5 mtmt -98.49 -32.1 11.64 Favored 'General case' 0 C--N 1.362 1.116 0 C-N-CA 125.034 1.334 . . . . 0.0 111.636 172.695 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . 0.447 ' SG ' ' HB2' ' A' ' 6' ' ' TYR . 87.7 m -124.33 11.46 8.71 Favored 'General case' 0 C--N 1.362 1.132 0 N-CA-C 120.12 3.378 . . . . 0.0 120.12 -172.167 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 17.3 mt -132.15 -17.97 2.65 Favored 'General case' 0 N--CA 1.477 0.879 0 CA-C-N 124.579 3.354 . . . . 0.0 112.102 170.214 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 76.61 56.09 4.34 Favored Glycine 0 C--N 1.359 1.831 0 C-N-CA 128.034 2.73 . . . . 0.0 112.381 -171.601 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . 0.438 ' HD2' ' HB2' ' A' ' 54' ' ' ARG . 13.7 ptpt . . . . . 0 C--O 1.258 1.526 0 N-CA-C 102.892 -3.003 . . . . 0.0 102.892 -176.373 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 19.3 t90 . . . . . 0 N--CA 1.436 -1.171 0 CA-C-O 122.706 1.241 . . . . 0.0 109.753 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 35.3 mt-30 -138.75 147.6 55.09 Favored Pre-proline 0 C--N 1.359 1.016 1 N-CA-C 99.91 -4.107 . . . . 0.0 99.91 169.279 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 5.0 Cg_endo -73.76 123.57 8.61 Favored 'Trans proline' 0 CA--C 1.553 1.444 0 CA-C-N 125.556 3.02 . . . . 0.0 116.03 -169.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . 0.454 ' HG2' ' CD2' ' A' ' 6' ' ' TYR . 49.5 Cg_endo -94.11 -116.92 0.0 OUTLIER 'Trans proline' 0 CA--C 1.548 1.221 1 C-N-CA 126.392 4.728 . . . . 0.0 110.362 179.592 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . 0.264 63.9 p-90 -87.06 -57.09 3.09 Favored 'General case' 0 C--N 1.384 2.093 0 C-N-CA 127.977 2.511 . . . . 0.0 115.234 176.249 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.454 ' CD2' ' HG2' ' A' ' 4' ' ' PRO . 0.1 OUTLIER -48.44 -7.77 0.02 OUTLIER 'General case' 0 C--N 1.363 1.162 1 C-N-CA 132.255 4.222 . . . . 0.0 120.663 -174.683 . . . . . . . . 4 4 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 4.1 m -103.09 -31.67 10.06 Favored 'General case' 0 N--CA 1.442 -0.868 0 N-CA-C 106.829 -1.545 . . . . 0.0 106.829 -177.331 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 26.0 mtmt -98.27 20.77 11.95 Favored 'General case' 0 C--N 1.364 1.231 0 C-N-CA 128.904 2.881 . . . . 0.0 113.206 -175.181 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.406 ' HA ' ' HD3' ' A' ' 10' ' ' PRO . 0.1 OUTLIER -104.94 126.36 31.31 Favored Pre-proline 0 C--N 1.362 1.131 0 CA-C-O 115.645 -2.121 . . . . 0.0 108.558 -176.763 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.406 ' HD3' ' HA ' ' A' ' 9' ' ' GLU . 30.5 Cg_exo -77.19 156.02 33.35 Favored 'Trans proline' 0 C--N 1.374 1.872 0 C-N-CA 125.23 3.954 . . . . 0.0 113.689 -167.22 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 9.4 p -72.52 134.12 30.44 Favored 'Isoleucine or valine' 0 C--N 1.37 1.483 0 N-CA-C 117.966 2.58 . . . . 0.0 117.966 178.379 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.697 ' NE ' HH21 ' A' ' 46' ' ' ARG . 0.0 OUTLIER -106.08 -176.72 3.16 Favored 'General case' 0 C--N 1.355 0.846 0 C-N-CA 129.109 2.964 . . . . 0.0 109.741 179.069 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.451 0.6 OUTLIER -155.49 -55.42 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.355 0.812 0 C-N-CA 126.133 1.773 . . . . 0.0 112.95 162.996 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 77.11 -152.26 39.91 Favored Glycine 0 C--N 1.366 2.232 0 CA-C-N 119.506 1.048 . . . . 0.0 114.245 -174.152 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 18.5 m -176.66 134.73 0.22 Allowed 'General case' 0 CA--C 1.504 -0.804 1 N-CA-C 100.163 -4.014 . . . . 0.0 100.163 175.73 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -176.03 -63.77 0.01 OUTLIER 'General case' 0 C--N 1.354 0.775 0 CA-C-O 123.066 1.412 . . . . 0.0 109.401 -175.68 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 29.7 mmmt -105.29 -98.46 0.33 Allowed 'General case' 0 C--N 1.352 0.705 0 CA-C-N 113.653 -1.612 . . . . 0.0 112.051 -173.738 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 13.6 tptp -147.78 166.41 27.62 Favored 'General case' 0 N--CA 1.439 -1.0 1 N-CA-C 99.094 -4.41 . . . . 0.0 99.094 -177.369 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 3.2 mm100 -93.07 120.22 33.13 Favored 'General case' 0 C--N 1.356 0.866 0 N-CA-C 107.24 -1.392 . . . . 0.0 107.24 178.13 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 29.5 m-85 -109.49 131.27 55.22 Favored 'General case' 0 C--N 1.355 0.806 0 O-C-N 121.033 -1.042 . . . . 0.0 108.271 -179.002 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' SER . . . . . 0.406 ' HA ' ' HG ' ' A' ' 36' ' ' LEU . 8.2 t -68.08 127.43 32.85 Favored 'General case' 0 C--N 1.375 1.701 0 CA-C-N 120.708 1.594 . . . . 0.0 115.121 -176.863 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 90.5 p -125.5 -159.62 0.91 Allowed 'General case' 0 C--N 1.348 0.501 0 C-N-CA 126.188 1.795 . . . . 0.0 112.451 -176.544 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 95.4 m-85 -146.94 132.35 18.59 Favored 'General case' 0 C--N 1.366 1.298 0 C-N-CA 129.646 3.178 . . . . 0.0 108.302 176.663 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 7.7 p90 -130.02 154.63 47.22 Favored 'General case' 0 C--N 1.363 1.183 0 CA-C-N 120.692 1.587 . . . . 0.0 107.746 169.757 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 7.8 t80 -102.94 127.47 50.14 Favored 'General case' 0 C--N 1.36 1.04 0 N-CA-C 105.652 -1.981 . . . . 0.0 105.652 -179.768 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 16.8 tptp -109.12 111.35 22.92 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 120.875 -1.14 . . . . 0.0 110.153 -178.058 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 33.7 t-105 -33.98 -58.08 0.45 Allowed 'General case' 0 C--N 1.369 1.453 0 N-CA-C 120.494 3.516 . . . . 0.0 120.494 176.551 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 2.0 p -80.27 -5.92 57.05 Favored 'General case' 0 C--N 1.363 1.173 0 C-N-CA 126.524 1.93 . . . . 0.0 113.868 -179.564 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -94.88 -39.67 10.11 Favored 'General case' 0 C--N 1.363 1.194 0 C-N-CA 124.663 1.185 . . . . 0.0 109.94 173.924 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 11.7 tptm 78.09 17.95 1.19 Allowed 'General case' 0 C--N 1.373 1.619 0 C-N-CA 128.44 2.696 . . . . 0.0 112.241 179.079 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 56.8 mtmt -138.0 167.27 22.12 Favored 'General case' 0 C--N 1.354 0.789 0 C-N-CA 128.469 2.707 . . . . 0.0 110.637 -175.567 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 87.9 m -93.17 119.29 32.2 Favored 'General case' 0 C--N 1.365 1.249 0 C-N-CA 129.528 3.131 . . . . 0.0 111.291 179.434 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 58.3 mt -110.48 139.31 21.42 Favored Pre-proline 0 C--N 1.35 0.591 0 O-C-N 119.949 -1.72 . . . . 0.0 109.788 -179.882 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -87.89 104.62 0.53 Allowed 'Trans proline' 0 N--CA 1.462 -0.346 0 C-N-CA 124.163 3.242 . . . . 0.0 112.12 -178.92 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 1.1 p90 -98.8 -177.95 3.81 Favored 'General case' 0 C--N 1.359 0.982 0 N-CA-C 107.218 -1.401 . . . . 0.0 107.218 173.782 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.406 ' HG ' ' HA ' ' A' ' 21' ' ' SER . 6.8 mp -118.65 145.04 45.77 Favored 'General case' 0 CA--C 1.507 -0.684 0 O-C-N 119.251 -2.156 . . . . 0.0 105.896 176.092 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 25.9 t80 -106.86 138.67 42.59 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 126.408 1.883 . . . . 0.0 110.164 177.851 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 2.7 m -92.85 -5.33 51.21 Favored 'General case' 0 C--N 1.376 1.724 0 N-CA-C 116.475 2.028 . . . . 0.0 116.475 178.073 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 105.82 -58.18 0.46 Allowed Glycine 0 C--N 1.366 2.245 0 CA-C-N 120.415 1.461 . . . . 0.0 115.71 -176.764 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 3.3 m -116.02 134.64 54.74 Favored 'General case' 0 C--N 1.354 0.781 0 N-CA-C 104.323 -2.473 . . . . 0.0 104.323 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 113.35 -10.61 24.2 Favored Glycine 0 C--N 1.362 2.002 0 CA-C-N 120.591 1.541 . . . . 0.0 112.562 -174.599 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -87.43 126.76 8.14 Favored Glycine 0 C--N 1.361 1.932 0 C-N-CA 125.883 1.706 . . . . 0.0 110.206 168.587 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 42.0 p30 -88.48 -78.49 0.33 Allowed 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 127.272 2.229 . . . . 0.0 115.307 -179.52 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -136.84 -27.11 1.02 Allowed 'General case' 0 C--N 1.362 1.151 0 N-CA-C 117.53 2.419 . . . . 0.0 117.53 -176.165 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 55.8 t30 -109.45 78.49 1.14 Allowed 'General case' 0 CA--C 1.55 0.958 0 N-CA-C 117.962 2.578 . . . . 0.0 117.962 -170.635 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.697 HH21 ' NE ' ' A' ' 12' ' ' ARG 0.445 0.2 OUTLIER -146.34 147.96 31.88 Favored 'General case' 0 C--N 1.366 1.312 0 CA-C-N 123.902 3.046 . . . . 0.0 112.67 168.007 . . . . . . . . 4 4 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 7.2 m-85 -108.05 139.08 43.21 Favored 'General case' 0 C--N 1.368 1.409 0 C-N-CA 127.428 2.291 . . . . 0.0 112.416 -168.458 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -81.96 -24.63 35.42 Favored 'General case' 0 C--N 1.374 1.642 0 C-N-CA 126.311 1.844 . . . . 0.0 115.367 -179.61 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 57.3 p -139.54 163.94 31.22 Favored 'General case' 0 C--N 1.36 1.037 0 N-CA-C 105.599 -2.0 . . . . 0.0 105.599 176.519 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 14.1 tt -64.61 -21.52 29.4 Favored 'Isoleucine or valine' 0 C--N 1.367 1.354 0 C-N-CA 126.817 2.047 . . . . 0.0 116.191 179.489 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -84.43 -13.37 73.58 Favored Glycine 0 C--N 1.365 2.148 0 C-N-CA 126.05 1.786 . . . . 0.0 114.618 -179.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -82.76 -12.69 57.33 Favored 'General case' 0 C--N 1.366 1.319 0 O-C-N 120.823 -1.398 . . . . 0.0 111.61 174.577 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 14.9 t -72.71 -48.1 41.54 Favored 'General case' 0 C--N 1.361 1.107 0 C-N-CA 127.628 2.371 . . . . 0.0 112.755 178.045 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 11.0 mtp180 -69.99 -33.16 71.68 Favored 'General case' 0 C--N 1.346 0.424 1 C-N-CA 132.778 4.431 . . . . 0.0 112.994 173.699 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 31.5 ttmt -69.84 -36.94 75.99 Favored 'General case' 0 C--N 1.369 1.421 0 C-N-CA 126.825 2.05 . . . . 0.0 113.213 178.83 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.414 ' HD2' ' CD1' ' A' ' 6' ' ' TYR . 6.0 mtmm -89.09 -31.64 17.92 Favored 'General case' 0 C--N 1.367 1.366 0 C-N-CA 124.918 1.287 . . . . 0.0 111.91 172.88 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 56.4 m -127.33 8.85 6.59 Favored 'General case' 0 C--N 1.365 1.247 0 N-CA-C 121.558 3.91 . . . . 0.0 121.558 -173.557 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 14.1 mt -136.54 -32.41 0.83 Allowed 'General case' 0 C--N 1.359 1.018 1 CA-C-N 126.984 4.447 . . . . 0.0 115.228 169.392 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 86.46 55.31 2.48 Favored Glycine 0 C--N 1.359 1.827 0 CA-C-N 119.577 1.08 . . . . 0.0 112.279 -169.634 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 1.3 ptpp? . . . . . 0 C--O 1.258 1.527 0 N-CA-C 103.264 -2.865 . . . . 0.0 103.264 -176.594 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' TRP . . . . . 0.463 ' CZ2' ' HB3' ' A' ' 3' ' ' PRO . 3.4 t90 . . . . . 0 N--CA 1.433 -1.299 0 N-CA-C 105.996 -1.853 . . . . 0.0 105.996 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 30.4 mt-30 -136.38 144.86 49.35 Favored Pre-proline 0 N--CA 1.443 -0.789 0 N-CA-C 100.322 -3.955 . . . . 0.0 100.322 173.585 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.463 ' HB3' ' CZ2' ' A' ' 1' ' ' TRP . 47.1 Cg_endo -76.0 125.83 8.92 Favored 'Trans proline' 0 CA--C 1.558 1.701 0 C-N-CA 123.369 2.712 . . . . 0.0 114.5 -168.461 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_endo -96.59 -114.38 0.0 OUTLIER 'Trans proline' 0 CA--C 1.547 1.168 1 C-N-CA 126.886 5.058 . . . . 0.0 111.345 -176.395 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . 0.506 ' CE3' ' CD1' ' A' ' 6' ' ' TYR 0.29 45.9 p-90 -86.74 -69.71 0.66 Allowed 'General case' 0 C--N 1.382 1.998 0 C-N-CA 127.623 2.369 . . . . 0.0 114.867 178.469 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.547 ' CD1' ' HD2' ' A' ' 56' ' ' LYS . 0.1 OUTLIER -33.14 -45.09 0.13 Allowed 'General case' 0 C--N 1.36 1.046 1 C-N-CA 132.995 4.518 . . . . 0.0 119.137 -173.397 . . . . . . . . 4 4 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.6 m -65.84 -41.79 91.31 Favored 'General case' 0 N--CA 1.448 -0.57 0 C-N-CA 128.235 2.614 . . . . 0.0 112.148 -179.827 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 44.2 mtpt -93.95 -7.97 41.42 Favored 'General case' 0 C--N 1.363 1.154 0 C-N-CA 129.073 2.949 . . . . 0.0 112.368 -179.278 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.417 ' HA ' ' HD3' ' A' ' 10' ' ' PRO . 0.6 OUTLIER -80.89 123.44 82.23 Favored Pre-proline 0 C--N 1.363 1.183 0 CA-C-O 116.326 -1.797 . . . . 0.0 112.738 -172.676 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.417 ' HD3' ' HA ' ' A' ' 9' ' ' GLU . 50.7 Cg_exo -70.86 147.78 56.5 Favored 'Trans proline' 0 CA--C 1.54 0.779 0 C-N-CA 123.525 2.817 . . . . 0.0 115.479 -163.801 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 3.5 p -78.8 131.99 33.21 Favored 'Isoleucine or valine' 0 C--N 1.363 1.177 0 C-N-CA 125.375 1.47 . . . . 0.0 110.659 176.236 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 38.3 mtt-85 -136.23 152.03 50.31 Favored 'General case' 0 C--N 1.359 0.995 0 N-CA-C 106.408 -1.701 . . . . 0.0 106.408 -173.812 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.385 14.5 tt -125.18 -54.03 2.14 Favored 'Isoleucine or valine' 0 C--N 1.375 1.706 0 CA-C-N 120.988 1.722 . . . . 0.0 112.733 179.209 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 146.31 -163.78 28.4 Favored Glycine 0 C--N 1.357 1.716 0 CA-C-N 119.564 1.074 . . . . 0.0 112.168 173.84 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 75.6 m -150.66 52.65 0.88 Allowed 'General case' 0 C--N 1.355 0.818 0 N-CA-C 105.8 -1.926 . . . . 0.0 105.8 176.806 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 7.6 m -143.35 -172.35 3.68 Favored 'General case' 0 C--N 1.358 0.969 1 C-N-CA 132.253 4.221 . . . . 0.0 103.965 -179.403 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 64.7 mmtt -131.29 80.32 1.93 Allowed 'General case' 0 C--N 1.358 0.953 0 C-N-CA 125.55 1.54 . . . . 0.0 111.851 -177.512 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.644 ' HZ1' ' H ' ' A' ' 19' ' ' GLN . 4.8 tptp -149.91 154.7 38.74 Favored 'General case' 0 C--N 1.347 0.498 0 N-CA-C 104.898 -2.26 . . . . 0.0 104.898 177.957 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . 0.644 ' H ' ' HZ1' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -145.82 102.22 3.64 Favored 'General case' 0 C--N 1.358 0.949 0 O-C-N 119.433 -2.042 . . . . 0.0 109.721 174.261 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 58.4 m-85 -93.71 147.21 23.25 Favored 'General case' 0 C--N 1.358 0.962 0 C-N-CA 127.644 2.378 . . . . 0.0 108.168 175.304 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 3.8 t -72.88 114.01 10.55 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 126.324 1.85 . . . . 0.0 115.175 -176.703 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 88.0 p -129.96 161.71 30.3 Favored 'General case' 0 C--N 1.367 1.327 0 N-CA-C 114.679 1.363 . . . . 0.0 114.679 -178.952 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . 0.404 ' HB2' ' HB2' ' A' ' 47' ' ' PHE . 91.8 m-85 -135.97 148.16 48.34 Favored 'General case' 0 CA--C 1.51 -0.594 0 N-CA-C 107.392 -1.336 . . . . 0.0 107.392 176.224 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 2.6 p90 -137.72 153.8 49.72 Favored 'General case' 0 C--N 1.358 0.945 0 C-N-CA 125.751 1.62 . . . . 0.0 108.996 176.183 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 15.7 t80 -96.32 135.81 37.66 Favored 'General case' 0 C--N 1.362 1.137 0 O-C-N 120.727 -1.233 . . . . 0.0 108.353 178.429 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.63 102.97 14.86 Favored 'General case' 0 N--CA 1.441 -0.914 0 O-C-N 121.799 -0.563 . . . . 0.0 110.813 178.882 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 10.6 t-105 -39.68 -47.02 1.95 Allowed 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 130.061 3.345 . . . . 0.0 118.196 169.484 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . 0.278 4.0 p -86.48 -23.23 26.04 Favored 'General case' 0 C--N 1.363 1.169 0 CA-C-O 118.147 -0.93 . . . . 0.0 112.774 176.875 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -82.07 -37.09 26.92 Favored 'General case' 0 C--N 1.376 1.753 0 CA-C-N 121.884 2.129 . . . . 0.0 114.854 173.705 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . 0.292 0.8 OUTLIER 81.96 22.28 0.27 Allowed 'General case' 0 C--N 1.371 1.503 0 C-N-CA 127.876 2.471 . . . . 0.0 111.8 -177.153 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 53.5 mtmt -143.94 169.68 17.34 Favored 'General case' 0 C--N 1.357 0.897 0 C-N-CA 127.174 2.189 . . . . 0.0 108.712 -177.182 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 80.0 m -91.52 145.24 24.78 Favored 'General case' 0 C--N 1.357 0.899 0 C-N-CA 127.108 2.163 . . . . 0.0 112.414 -179.452 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 31.2 mt -123.65 145.01 45.95 Favored Pre-proline 0 C--N 1.36 1.035 0 C-N-CA 125.374 1.47 . . . . 0.0 111.013 176.667 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -86.55 145.12 7.97 Favored 'Trans proline' 0 C--N 1.348 0.513 0 C-N-CA 124.492 3.462 . . . . 0.0 111.842 169.603 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . 0.273 13.5 p90 -141.27 -160.03 1.03 Allowed 'General case' 0 C--N 1.344 0.332 0 N-CA-C 105.787 -1.931 . . . . 0.0 105.787 170.896 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 58.5 mt -141.56 154.5 45.5 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 104.756 -2.313 . . . . 0.0 104.756 175.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 3.3 t80 -115.46 129.11 56.45 Favored 'General case' 0 CA--C 1.567 1.628 0 C-N-CA 125.457 1.503 . . . . 0.0 110.767 177.833 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 49.1 m -98.73 16.06 23.34 Favored 'General case' 0 C--N 1.382 2.01 0 N-CA-C 115.262 1.579 . . . . 0.0 115.262 -178.766 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 76.53 -56.47 3.36 Favored Glycine 0 C--N 1.352 1.469 0 O-C-N 120.133 -1.604 . . . . 0.0 116.257 178.936 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 14.4 m -79.45 34.23 0.26 Allowed 'General case' 0 C--N 1.358 0.954 0 C-N-CA 127.574 2.35 . . . . 0.0 115.666 179.744 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 173.17 49.67 0.05 OUTLIER Glycine 0 CA--C 1.482 -1.976 0 O-C-N 120.556 -1.34 . . . . 0.0 114.078 174.607 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -104.53 128.06 9.32 Favored Glycine 0 C--N 1.354 1.572 0 N-CA-C 109.432 -1.467 . . . . 0.0 109.432 169.797 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 45.6 p30 -77.33 -57.5 3.8 Favored 'General case' 0 C--N 1.361 1.099 0 N-CA-C 116.331 1.974 . . . . 0.0 116.331 -178.668 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -177.35 -21.95 0.01 OUTLIER 'General case' 0 C--N 1.354 0.778 0 C-N-CA 126.886 2.074 . . . . 0.0 111.926 -178.286 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 39.3 t30 -96.96 89.24 4.77 Favored 'General case' 0 CA--C 1.555 1.146 0 O-C-N 119.283 -2.136 . . . . 0.0 116.416 -174.247 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . 0.355 0.0 OUTLIER -150.42 129.64 12.78 Favored 'General case' 0 C--N 1.355 0.833 0 O-C-N 120.689 -1.257 . . . . 0.0 110.42 168.033 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . 0.404 ' HB2' ' HB2' ' A' ' 23' ' ' PHE . 27.0 m-85 -99.89 150.98 21.83 Favored 'General case' 0 N--CA 1.447 -0.587 0 C-N-CA 126.46 1.904 . . . . 0.0 106.683 175.807 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -78.33 -38.33 42.46 Favored 'General case' 0 C--N 1.363 1.162 0 C-N-CA 125.718 1.607 . . . . 0.0 113.163 -178.299 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 75.5 p -129.95 165.31 22.36 Favored 'General case' 0 C--N 1.357 0.923 0 C-N-CA 125.189 1.395 . . . . 0.0 107.324 175.518 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 13.0 tt -71.98 -10.16 13.66 Favored 'Isoleucine or valine' 0 C--N 1.363 1.185 0 C-N-CA 126.501 1.92 . . . . 0.0 114.673 175.088 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -91.25 -10.62 62.11 Favored Glycine 0 C--N 1.365 2.181 0 O-C-N 120.178 -1.576 . . . . 0.0 114.101 176.664 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 -86.13 -41.16 14.96 Favored 'General case' 0 C--N 1.364 1.228 0 C-N-CA 125.81 1.644 . . . . 0.0 110.887 174.326 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . 0.258 4.1 t -42.51 -47.45 5.1 Favored 'General case' 0 C--N 1.365 1.267 0 C-N-CA 128.952 2.901 . . . . 0.0 116.306 -175.908 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 10.0 ptt180 -69.42 -19.79 63.79 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 129.646 3.178 . . . . 0.0 117.37 174.671 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 8.6 mptt -79.84 -6.12 56.76 Favored 'General case' 0 C--N 1.375 1.694 0 O-C-N 119.493 -2.005 . . . . 0.0 113.495 178.193 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.547 ' HD2' ' CD1' ' A' ' 6' ' ' TYR . 5.6 mtmm -111.16 -21.78 11.76 Favored 'General case' 0 C--N 1.354 0.773 0 O-C-N 120.32 -1.487 . . . . 0.0 110.38 176.816 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . 0.401 ' SG ' ' HB2' ' A' ' 6' ' ' TYR . 57.4 m -131.3 8.38 4.66 Favored 'General case' 0 C--N 1.364 1.224 0 N-CA-C 116.736 2.125 . . . . 0.0 116.736 -171.0 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 11.6 mt -130.91 -13.51 3.6 Favored 'General case' 0 N--CA 1.476 0.85 0 CA-C-N 123.64 2.927 . . . . 0.0 111.675 172.528 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 73.52 59.68 4.04 Favored Glycine 0 C--N 1.359 1.828 0 C-N-CA 127.999 2.714 . . . . 0.0 112.863 -169.601 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 19.2 mtpt . . . . . 0 C--O 1.262 1.762 0 C-N-CA 124.721 1.208 . . . . 0.0 107.767 -178.83 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' TRP . . . . . 0.435 ' CZ2' ' HB3' ' A' ' 3' ' ' PRO . 4.4 t90 . . . . . 0 N--CA 1.433 -1.298 0 N-CA-C 107.456 -1.313 . . . . 0.0 107.456 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 25.0 mm-40 -147.57 150.66 37.54 Favored Pre-proline 0 C--N 1.351 0.669 1 N-CA-C 98.281 -4.711 . . . . 0.0 98.281 173.674 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.435 ' HB3' ' CZ2' ' A' ' 1' ' ' TRP . 66.2 Cg_endo -82.65 123.08 3.65 Favored 'Trans proline' 0 CA--C 1.558 1.717 0 CA-C-N 124.168 2.524 . . . . 0.0 114.906 -165.194 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 27.7 Cg_exo -73.79 -110.31 0.01 OUTLIER 'Trans proline' 0 C--N 1.365 1.416 1 C-N-CA 126.96 5.107 . . . . 0.0 112.827 173.088 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . 0.55 ' CE3' ' CD2' ' A' ' 6' ' ' TYR 0.298 17.5 p-90 -88.91 -76.52 0.4 Allowed 'General case' 0 C--N 1.375 1.687 0 N-CA-C 116.419 2.007 . . . . 0.0 116.419 178.968 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.565 ' CD2' ' HD2' ' A' ' 56' ' ' LYS . 0.0 OUTLIER -29.65 -51.88 0.12 Allowed 'General case' 0 C--N 1.36 1.062 1 C-N-CA 135.173 5.389 . . . . 0.0 118.404 -171.391 . . . . . . . . 4 4 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -53.12 -41.65 65.25 Favored 'General case' 0 N--CA 1.443 -0.795 1 C-N-CA 131.732 4.013 . . . . 0.0 112.503 178.739 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.82 17.56 21.7 Favored 'General case' 0 C--N 1.367 1.362 0 C-N-CA 127.366 2.266 . . . . 0.0 111.702 -178.451 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -93.61 133.11 28.61 Favored Pre-proline 0 C--N 1.361 1.108 0 CA-C-O 116.488 -1.72 . . . . 0.0 112.041 -173.172 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -70.24 125.95 12.45 Favored 'Trans proline' 0 CA--C 1.54 0.797 0 CA-C-N 125.276 2.92 . . . . 0.0 116.23 -164.73 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 10.1 p -68.9 139.73 20.04 Favored 'Isoleucine or valine' 0 C--N 1.367 1.339 0 C-N-CA 127.453 2.301 . . . . 0.0 114.041 178.582 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 61.8 mtt180 -145.73 120.61 9.97 Favored 'General case' 0 C--N 1.368 1.408 0 C-N-CA 126.297 1.839 . . . . 0.0 111.643 -173.487 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 14.4 tt -88.84 -32.33 5.8 Favored 'Isoleucine or valine' 0 C--N 1.371 1.532 0 CA-C-N 121.245 1.839 . . . . 0.0 113.783 179.691 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 92.89 -69.48 1.64 Allowed Glycine 0 C--N 1.351 1.393 0 C-N-CA 126.139 1.828 . . . . 0.0 115.279 179.902 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.487 ' H ' ' HB3' ' A' ' 38' ' ' SER . 70.8 m 76.12 67.6 0.06 Allowed 'General case' 0 C--N 1.366 1.313 0 C-N-CA 127.714 2.405 . . . . 0.0 110.525 -173.118 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 60.4 m -125.26 -63.05 1.17 Allowed 'General case' 0 N--CA 1.442 -0.838 0 CA-C-O 122.449 1.118 . . . . 0.0 109.92 -178.446 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 34.3 mmtm -90.79 -86.27 0.21 Allowed 'General case' 0 C--N 1.349 0.546 0 C-N-CA 127.342 2.257 . . . . 0.0 116.064 -170.307 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 53.8 tptt -147.87 -169.34 3.31 Favored 'General case' 0 C--N 1.35 0.597 0 N-CA-C 101.682 -3.451 . . . . 0.0 101.682 -177.718 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -118.54 105.52 11.73 Favored 'General case' 0 C--N 1.353 0.734 0 N-CA-C 106.488 -1.671 . . . . 0.0 106.488 173.181 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 22.5 m-85 -96.56 144.35 26.71 Favored 'General case' 0 C--N 1.362 1.116 0 C-N-CA 126.564 1.946 . . . . 0.0 109.77 -177.698 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 7.0 t -69.76 113.31 6.89 Favored 'General case' 0 C--N 1.369 1.441 0 N-CA-C 115.488 1.662 . . . . 0.0 115.488 -178.288 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 78.3 p -120.7 -166.25 1.31 Allowed 'General case' 0 C--N 1.359 0.988 0 C-N-CA 126.321 1.849 . . . . 0.0 113.431 -179.396 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 29.6 m-85 -148.35 149.58 32.05 Favored 'General case' 0 C--N 1.359 0.986 1 C-N-CA 131.877 4.071 . . . . 0.0 109.008 174.487 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 10.5 p90 -144.11 150.8 38.69 Favored 'General case' 0 C--N 1.362 1.113 0 C-N-CA 127.96 2.504 . . . . 0.0 110.986 175.685 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 9.2 t80 -98.24 119.1 36.32 Favored 'General case' 0 C--N 1.381 1.951 0 N-CA-C 106.916 -1.512 . . . . 0.0 106.916 177.071 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 9.4 tptt -103.74 110.44 22.54 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 125.538 1.535 . . . . 0.0 109.124 -179.256 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 33.2 t-105 -44.99 -49.88 10.98 Favored 'General case' 0 C--N 1.362 1.142 0 C-N-CA 131.14 3.776 . . . . 0.0 117.695 176.502 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 10.8 p -82.46 3.75 26.99 Favored 'General case' 0 C--N 1.36 1.059 0 C-N-CA 125.973 1.709 . . . . 0.0 113.617 -179.565 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -107.25 -46.49 3.87 Favored 'General case' 0 C--N 1.357 0.929 0 C-N-CA 125.604 1.562 . . . . 0.0 108.49 173.114 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . 0.309 0.2 OUTLIER 81.11 24.6 0.27 Allowed 'General case' 0 C--N 1.367 1.346 0 C-N-CA 128.845 2.858 . . . . 0.0 112.352 179.098 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 83.0 tttt -149.82 163.83 36.97 Favored 'General case' 0 N--CA 1.441 -0.902 0 N-CA-C 106.178 -1.786 . . . . 0.0 106.178 179.573 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 89.6 m -79.27 130.07 35.09 Favored 'General case' 0 C--N 1.358 0.957 0 C-N-CA 128.169 2.588 . . . . 0.0 113.927 175.805 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 80.8 mt -120.87 147.9 47.25 Favored Pre-proline 0 C--N 1.355 0.807 0 C-N-CA 124.591 1.157 . . . . 0.0 110.172 179.883 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -85.87 125.14 2.7 Favored 'Trans proline' 0 C--N 1.351 0.666 0 C-N-CA 124.454 3.436 . . . . 0.0 111.587 173.248 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -114.87 -168.86 1.44 Allowed 'General case' 0 C--N 1.354 0.764 0 N-CA-C 103.962 -2.607 . . . . 0.0 103.962 167.34 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 19.6 mt -119.25 155.82 31.05 Favored 'General case' 0 N--CA 1.441 -0.922 0 O-C-N 119.324 -2.11 . . . . 0.0 106.493 175.248 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 22.0 t80 -117.69 137.36 52.72 Favored 'General case' 0 N--CA 1.471 0.611 0 O-C-N 121.055 -1.028 . . . . 0.0 110.187 175.295 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' SER . . . . . 0.487 ' HB3' ' H ' ' A' ' 15' ' ' SER . 2.8 t -111.78 37.13 3.03 Favored 'General case' 0 C--N 1.375 1.715 0 N-CA-C 114.758 1.392 . . . . 0.0 114.758 175.721 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 72.29 -45.25 0.96 Allowed Glycine 0 C--N 1.36 1.897 0 N-CA-C 121.329 3.292 . . . . 0.0 121.329 161.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -116.43 165.94 12.64 Favored 'General case' 0 C--N 1.347 0.487 0 C-N-CA 126.694 1.998 . . . . 0.0 105.654 173.869 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 90.26 -33.63 4.45 Favored Glycine 0 N--CA 1.484 1.89 0 O-C-N 119.565 -1.959 . . . . 0.0 116.027 177.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -60.59 -174.51 1.11 Allowed Glycine 0 C--N 1.37 2.43 0 N-CA-C 120.696 3.039 . . . . 0.0 120.696 179.76 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . 0.516 ' H ' ' NH1' ' A' ' 46' ' ' ARG 0.272 26.2 p30 -136.39 -103.78 0.21 Allowed 'General case' 0 C--N 1.355 0.813 0 O-C-N 120.779 -1.424 . . . . 0.0 112.818 -179.648 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -155.33 5.03 0.21 Allowed 'General case' 0 C--N 1.35 0.627 0 O-C-N 120.873 -1.142 . . . . 0.0 113.271 -173.672 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 49.3 t30 -95.88 53.55 1.42 Allowed 'General case' 0 C--N 1.365 1.241 0 O-C-N 118.766 -2.459 . . . . 0.0 108.172 175.109 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.516 ' NH1' ' H ' ' A' ' 43' ' ' ASN . 0.0 OUTLIER -139.94 144.25 37.0 Favored 'General case' 0 N--CA 1.443 -0.798 0 N-CA-C 107.862 -1.162 . . . . 0.0 107.862 -177.463 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 52.8 m-85 -131.1 134.01 46.19 Favored 'General case' 0 N--CA 1.449 -0.494 0 C-N-CA 127.705 2.402 . . . . 0.0 107.358 -169.856 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.69 -16.93 61.67 Favored 'General case' 0 C--N 1.373 1.625 0 N-CA-C 116.699 2.111 . . . . 0.0 116.699 -177.35 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 40.9 p -146.29 -176.97 5.38 Favored 'General case' 0 C--N 1.352 0.685 0 N-CA-C 103.752 -2.684 . . . . 0.0 103.752 177.267 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 15.0 tt -76.59 -27.07 16.89 Favored 'Isoleucine or valine' 0 C--N 1.367 1.343 0 O-C-N 120.081 -1.637 . . . . 0.0 114.072 175.794 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -90.4 20.57 36.91 Favored Glycine 0 C--N 1.365 2.185 0 O-C-N 120.598 -1.314 . . . . 0.0 115.486 -171.688 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -112.87 -14.77 13.02 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 126.82 2.048 . . . . 0.0 108.587 171.51 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 15.9 t -87.07 -43.29 12.42 Favored 'General case' 0 C--N 1.361 1.067 0 C-N-CA 126.989 2.116 . . . . 0.0 115.748 -174.775 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.403 ' HB2' ' HD3' ' A' ' 60' ' ' LYS 0.301 0.0 OUTLIER -82.51 -24.75 33.98 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 126.623 1.969 . . . . 0.0 115.07 -175.546 . . . . . . . . 4 4 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 28.2 ttmt -71.88 -15.98 62.12 Favored 'General case' 0 C--N 1.357 0.925 0 C-N-CA 127.497 2.319 . . . . 0.0 115.564 176.61 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.565 ' HD2' ' CD2' ' A' ' 6' ' ' TYR . 9.3 mtmm -100.81 -24.9 14.29 Favored 'General case' 0 C--N 1.36 1.058 0 C-N-CA 126.31 1.844 . . . . 0.0 112.357 175.458 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 43.6 m -137.54 26.68 2.82 Favored 'General case' 0 C--N 1.355 0.825 0 N-CA-C 116.935 2.198 . . . . 0.0 116.935 -167.305 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 16.7 mt -146.0 -23.73 0.45 Allowed 'General case' 0 N--CA 1.471 0.625 0 CA-C-N 120.546 1.521 . . . . 0.0 112.396 170.924 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 82.43 63.26 1.79 Allowed Glycine 0 C--N 1.36 1.904 0 C-N-CA 128.561 2.981 . . . . 0.0 112.576 -168.323 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . 0.403 ' HD3' ' HB2' ' A' ' 54' ' ' ARG . 14.0 ptmt . . . . . 0 C--O 1.258 1.55 0 CA-C-O 116.284 -1.817 . . . . 0.0 106.723 -176.088 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 70.0 t90 . . . . . 0 N--CA 1.433 -1.281 0 N-CA-C 106.541 -1.651 . . . . 0.0 106.541 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 68.1 mt-30 -144.11 152.32 54.34 Favored Pre-proline 0 CA--C 1.512 -0.489 1 N-CA-C 97.996 -4.816 . . . . 0.0 97.996 172.352 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.417 ' HA ' ' HD3' ' A' ' 4' ' ' PRO . 1.5 Cg_endo -79.83 122.16 4.8 Favored 'Trans proline' 0 N--CA 1.452 -0.956 0 CA-C-N 124.207 2.538 . . . . 0.0 112.618 -170.351 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . 0.417 ' HD3' ' HA ' ' A' ' 3' ' ' PRO . 16.2 Cg_exo -85.25 -116.08 0.01 OUTLIER 'Trans proline' 0 C--N 1.359 1.103 0 C-N-CA 124.913 3.742 . . . . 0.0 111.185 179.677 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . 0.501 ' CE2' ' CE2' ' A' ' 6' ' ' TYR . 42.6 p-90 -81.72 -72.53 0.43 Allowed 'General case' 0 C--N 1.375 1.68 0 C-N-CA 124.941 1.296 . . . . 0.0 114.021 -179.746 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.501 ' CE2' ' CE2' ' A' ' 5' ' ' TRP . 0.0 OUTLIER -33.35 -43.89 0.12 Allowed 'General case' 0 C--N 1.361 1.09 1 C-N-CA 134.273 5.029 . . . . 0.0 117.206 -179.853 . . . . . . . . 4 4 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.5 m -83.19 -15.72 49.39 Favored 'General case' 0 N--CA 1.44 -0.956 0 C-N-CA 127.636 2.374 . . . . 0.0 114.173 -173.728 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 67.8 mttm -125.52 32.23 5.37 Favored 'General case' 0 C--N 1.357 0.928 0 C-N-CA 126.892 2.077 . . . . 0.0 105.904 178.537 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 5.9 tm-20 -94.15 141.38 23.54 Favored Pre-proline 0 C--N 1.366 1.3 0 C-N-CA 125.106 1.362 . . . . 0.0 109.862 -176.299 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -89.84 142.37 3.97 Favored 'Trans proline' 0 N--CA 1.448 -1.16 0 C-N-CA 124.858 3.706 . . . . 0.0 108.074 177.609 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . 0.397 3.0 p -77.05 122.32 31.33 Favored 'Isoleucine or valine' 0 C--N 1.362 1.141 0 O-C-N 119.21 -2.182 . . . . 0.0 116.559 -173.659 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.474 ' CZ ' HD21 ' A' ' 43' ' ' ASN . 11.0 mtm-85 -102.78 117.73 35.29 Favored 'General case' 0 N--CA 1.443 -0.809 0 C-N-CA 129.855 3.262 . . . . 0.0 109.778 -179.454 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 10.2 tt -90.52 -31.82 5.25 Favored 'Isoleucine or valine' 0 C--N 1.366 1.294 0 CA-C-N 121.103 1.774 . . . . 0.0 111.09 171.535 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 89.09 -64.43 3.33 Favored Glycine 0 C--N 1.358 1.773 0 C-N-CA 123.933 0.778 . . . . 0.0 114.087 -177.621 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . 0.358 86.1 p 78.0 81.73 0.07 Allowed 'General case' 0 C--N 1.359 0.983 0 C-N-CA 127.438 2.295 . . . . 0.0 110.928 -175.479 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 49.2 t -143.77 -80.74 0.19 Allowed 'General case' 0 C--N 1.357 0.898 0 O-C-N 121.263 -0.898 . . . . 0.0 112.863 -171.463 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 38.6 mmtm -86.74 -104.69 0.07 Allowed 'General case' 0 C--N 1.352 0.711 0 C-N-CA 127.104 2.162 . . . . 0.0 115.673 -171.084 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -126.88 151.41 48.44 Favored 'General case' 0 CA--C 1.503 -0.852 0 N-CA-C 100.831 -3.766 . . . . 0.0 100.831 179.245 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 7.1 mm-40 -92.82 113.25 25.47 Favored 'General case' 0 C--N 1.356 0.873 0 N-CA-C 106.699 -1.593 . . . . 0.0 106.699 -178.21 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 67.2 m-85 -106.98 141.85 37.53 Favored 'General case' 0 C--N 1.355 0.845 0 C-N-CA 125.147 1.379 . . . . 0.0 110.674 -174.435 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 24.6 t -70.5 104.62 2.81 Favored 'General case' 0 C--N 1.368 1.389 0 C-N-CA 125.704 1.602 . . . . 0.0 112.686 177.826 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 64.7 p -99.75 -161.17 0.85 Allowed 'General case' 0 C--N 1.349 0.544 0 C-N-CA 125.802 1.641 . . . . 0.0 112.151 177.866 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . 0.438 ' HB2' ' HB2' ' A' ' 47' ' ' PHE . 98.8 m-85 -148.2 132.99 17.96 Favored 'General case' 0 C--N 1.355 0.818 0 C-N-CA 127.237 2.215 . . . . 0.0 105.633 169.69 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 13.2 p90 -125.73 150.36 47.77 Favored 'General case' 0 CA--C 1.516 -0.327 0 C-N-CA 125.676 1.59 . . . . 0.0 109.638 177.414 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 10.8 t80 -91.01 118.97 30.81 Favored 'General case' 0 C--N 1.367 1.369 0 N-CA-C 103.447 -2.797 . . . . 0.0 103.447 176.921 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.94 115.86 27.98 Favored 'General case' 0 N--CA 1.431 -1.413 0 C-N-CA 123.236 0.615 . . . . 0.0 109.727 -176.895 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 48.1 t-105 -51.46 -45.75 62.83 Favored 'General case' 0 C--N 1.366 1.284 0 C-N-CA 128.628 2.771 . . . . 0.0 117.788 -178.324 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 17.3 p -84.75 -3.66 58.69 Favored 'General case' 0 C--N 1.352 0.676 0 C-N-CA 124.64 1.176 . . . . 0.0 113.778 179.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -100.79 -45.97 5.3 Favored 'General case' 0 C--N 1.361 1.085 0 C-N-CA 124.641 1.176 . . . . 0.0 113.631 176.675 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . 0.316 67.2 mmtt 85.15 20.55 0.11 Allowed 'General case' 0 C--N 1.368 1.383 0 C-N-CA 128.757 2.823 . . . . 0.0 112.161 -176.312 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.495 ' NZ ' ' H ' ' A' ' 32' ' ' CYS . 2.4 mmmp? -145.64 179.33 7.5 Favored 'General case' 0 C--N 1.355 0.812 0 C-N-CA 128.197 2.599 . . . . 0.0 109.979 -179.771 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.495 ' H ' ' NZ ' ' A' ' 31' ' ' LYS . 73.9 m -105.93 129.51 54.06 Favored 'General case' 0 C--N 1.358 0.977 0 C-N-CA 127.991 2.516 . . . . 0.0 115.085 -171.602 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 59.2 mt -120.37 144.55 38.45 Favored Pre-proline 0 C--N 1.357 0.916 0 O-C-N 119.707 -1.871 . . . . 0.0 110.505 -179.899 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_endo -81.39 110.19 2.19 Favored 'Trans proline' 0 C--N 1.351 0.677 0 C-N-CA 124.879 3.719 . . . . 0.0 113.797 176.414 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . 0.293 2.8 p90 -102.71 168.59 9.15 Favored 'General case' 0 C--N 1.363 1.175 0 CA-C-O 122.115 0.959 . . . . 0.0 109.751 174.644 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 61.0 mt -94.78 125.3 39.34 Favored 'General case' 0 C--N 1.351 0.634 0 N-CA-C 107.357 -1.349 . . . . 0.0 107.357 174.021 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 5.4 t80 -112.74 137.11 51.54 Favored 'General case' 0 C--N 1.35 0.603 0 C-N-CA 125.333 1.453 . . . . 0.0 109.055 179.31 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -90.77 9.97 27.92 Favored 'General case' 0 C--N 1.371 1.503 0 N-CA-C 116.758 2.132 . . . . 0.0 116.758 -177.318 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 93.4 -44.05 2.47 Favored Glycine 0 C--N 1.361 1.922 0 N-CA-C 119.056 2.383 . . . . 0.0 119.056 168.46 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -124.15 145.7 49.13 Favored 'General case' 0 C--N 1.35 0.603 0 N-CA-C 106.242 -1.762 . . . . 0.0 106.242 175.348 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 117.54 -41.06 2.16 Favored Glycine 0 C--N 1.361 1.932 0 C-N-CA 124.462 1.029 . . . . 0.0 113.744 -179.541 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -67.18 -171.23 4.9 Favored Glycine 0 C--N 1.36 1.878 0 N-CA-C 122.305 3.682 . . . . 0.0 122.305 -176.292 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . 0.474 HD21 ' CZ ' ' A' ' 12' ' ' ARG . 6.8 p30 -124.87 -115.75 0.29 Allowed 'General case' 0 C--N 1.359 1.002 0 C-N-CA 125.201 1.4 . . . . 0.0 111.214 -178.921 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -141.49 19.61 2.21 Favored 'General case' 0 C--N 1.364 1.232 0 O-C-N 119.952 -1.717 . . . . 0.0 112.483 178.271 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 49.9 t30 -91.25 36.59 0.93 Allowed 'General case' 0 CA--C 1.564 1.515 0 O-C-N 119.919 -1.738 . . . . 0.0 108.892 172.318 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.408 HH22 ' HB2' ' A' ' 12' ' ' ARG . 0.0 OUTLIER -137.91 97.81 3.5 Favored 'General case' 0 C--N 1.361 1.091 0 C-N-CA 127.839 2.456 . . . . 0.0 105.982 -178.341 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . 0.438 ' HB2' ' HB2' ' A' ' 23' ' ' PHE . 24.7 m-85 -94.24 153.22 18.16 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 111.679 -2.51 . . . . 0.0 111.895 -169.47 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . 0.262 0.0 OUTLIER -68.86 -43.56 75.14 Favored 'General case' 0 C--N 1.376 1.736 0 C-N-CA 125.786 1.635 . . . . 0.0 114.762 -179.806 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 72.2 p -137.88 162.28 34.42 Favored 'General case' 0 C--N 1.351 0.632 0 C-N-CA 127.996 2.518 . . . . 0.0 105.396 177.382 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 15.0 tt -66.45 -11.13 12.64 Favored 'Isoleucine or valine' 0 C--N 1.36 1.054 0 C-N-CA 127.577 2.351 . . . . 0.0 116.324 178.269 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -90.56 -9.09 65.07 Favored Glycine 0 C--N 1.367 2.295 0 C-N-CA 125.532 1.539 . . . . 0.0 114.259 174.385 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 12.8 tt0 -92.72 -14.09 28.45 Favored 'General case' 0 C--N 1.358 0.948 0 C-N-CA 125.304 1.442 . . . . 0.0 112.414 176.875 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . 0.426 ' HA ' ' CD2' ' A' ' 47' ' ' PHE . 40.6 t -64.97 -41.28 95.58 Favored 'General case' 0 C--N 1.361 1.1 0 C-N-CA 129.137 2.975 . . . . 0.0 114.911 179.791 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 12.0 mtp180 -71.15 -21.41 62.18 Favored 'General case' 0 CA--C 1.532 0.282 1 C-N-CA 134.323 5.049 . . . . 0.0 115.767 178.595 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 49.1 mtmt -82.89 -19.79 36.69 Favored 'General case' 0 C--N 1.36 1.025 0 O-C-N 120.235 -1.541 . . . . 0.0 114.004 -178.796 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.477 ' HD2' ' CD2' ' A' ' 6' ' ' TYR . 10.6 mtmm -100.4 -30.18 11.98 Favored 'General case' 0 C--N 1.361 1.097 0 C-N-CA 126.711 2.005 . . . . 0.0 109.553 174.241 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . 0.485 ' SG ' ' HB2' ' A' ' 6' ' ' TYR . 96.3 m -124.32 10.08 8.6 Favored 'General case' 0 C--N 1.359 0.989 0 N-CA-C 119.737 3.236 . . . . 0.0 119.737 -172.654 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . 0.259 15.6 mt -131.86 -11.13 3.43 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-N 125.081 3.582 . . . . 0.0 113.065 169.233 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 70.61 52.17 17.2 Favored Glycine 0 C--N 1.365 2.179 0 C-N-CA 128.606 3.003 . . . . 0.0 113.43 -172.869 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 13.6 ptpt . . . . . 0 C--O 1.262 1.725 0 N-CA-C 104.959 -2.238 . . . . 0.0 104.959 -175.064 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' TRP . . . . . 0.457 ' CZ2' ' HA ' ' A' ' 3' ' ' PRO . 83.4 t90 . . . . . 0 N--CA 1.435 -1.182 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 23.6 mm-40 -147.35 154.58 45.68 Favored Pre-proline 0 C--N 1.352 0.683 1 N-CA-C 98.905 -4.48 . . . . 0.0 98.905 171.45 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.457 ' HA ' ' CZ2' ' A' ' 1' ' ' TRP . 3.2 Cg_exo -79.71 118.34 3.81 Favored 'Trans proline' 0 CA--C 1.541 0.844 0 CA-C-N 124.974 2.812 . . . . 0.0 114.335 -167.174 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . 0.405 ' HD3' ' HA ' ' A' ' 3' ' ' PRO . 14.0 Cg_exo -88.63 -109.42 0.0 OUTLIER 'Trans proline' 0 C--N 1.365 1.407 0 C-N-CA 125.045 3.83 . . . . 0.0 110.184 -175.953 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . 0.468 ' CE3' ' CD2' ' A' ' 6' ' ' TYR 0.272 45.1 p-90 -88.25 -72.26 0.54 Allowed 'General case' 0 C--N 1.372 1.558 0 N-CA-C 116.188 1.922 . . . . 0.0 116.188 -179.476 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.468 ' CD2' ' CE3' ' A' ' 5' ' ' TRP . 0.0 OUTLIER -30.85 -49.67 0.13 Allowed 'General case' 0 C--N 1.359 0.981 1 C-N-CA 135.672 5.589 . . . . 0.0 118.182 -175.667 . . . . . . . . 4 4 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.8 m -57.99 -40.96 82.0 Favored 'General case' 0 C--N 1.349 0.572 0 C-N-CA 127.657 2.383 . . . . 0.0 114.116 -176.811 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 24.4 mtpp -105.55 22.26 15.8 Favored 'General case' 0 C--N 1.363 1.163 0 C-N-CA 126.283 1.833 . . . . 0.0 110.255 177.049 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -93.91 123.1 60.49 Favored Pre-proline 0 C--N 1.369 1.439 0 O-C-N 119.685 -1.885 . . . . 0.0 110.295 -174.709 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 80.3 Cg_exo -59.1 124.48 15.74 Favored 'Trans proline' 0 C--N 1.36 1.155 0 C-N-CA 124.758 3.639 . . . . 0.0 116.766 -165.023 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 9.9 p -88.02 126.66 41.45 Favored 'Isoleucine or valine' 0 C--N 1.37 1.479 0 C-N-CA 124.997 1.319 . . . . 0.0 111.328 -179.818 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.54 ' HB2' HH21 ' A' ' 46' ' ' ARG . 32.6 mtt180 -134.76 135.61 42.01 Favored 'General case' 0 N--CA 1.438 -1.047 0 C-N-CA 128.423 2.689 . . . . 0.0 111.158 -175.436 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 11.9 tt -95.41 -39.25 9.62 Favored 'Isoleucine or valine' 0 C--N 1.37 1.487 0 C-N-CA 127.428 2.291 . . . . 0.0 112.58 175.598 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 56.07 -133.85 50.56 Favored Glycine 0 C--N 1.364 2.085 0 C-N-CA 128.022 2.725 . . . . 0.0 116.983 -174.229 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 21.0 m -173.39 134.24 0.52 Allowed 'General case' 0 C--N 1.357 0.919 0 N-CA-C 100.662 -3.829 . . . . 0.0 100.662 179.209 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 31.3 t -167.86 -63.06 0.03 OUTLIER 'General case' 0 C--N 1.352 0.688 0 CA-C-N 120.336 1.425 . . . . 0.0 111.191 -174.867 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt -118.86 -89.18 0.6 Allowed 'General case' 0 C--N 1.347 0.488 0 C-N-CA 125.175 1.39 . . . . 0.0 111.458 -177.082 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 14.5 ptmm? -149.41 170.98 17.32 Favored 'General case' 0 CA--C 1.506 -0.745 0 N-CA-C 103.643 -2.725 . . . . 0.0 103.643 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.6 mm100 -93.27 108.81 20.37 Favored 'General case' 0 C--N 1.358 0.941 0 O-C-N 120.397 -1.439 . . . . 0.0 110.985 -176.577 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 83.1 m-85 -95.34 155.06 16.9 Favored 'General case' 0 C--N 1.354 0.803 0 C-N-CA 126.796 2.038 . . . . 0.0 109.638 -176.2 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 11.3 t -71.08 116.3 11.21 Favored 'General case' 0 C--N 1.369 1.416 0 C-N-CA 127.095 2.158 . . . . 0.0 114.35 -178.589 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 51.5 p -141.58 171.33 14.21 Favored 'General case' 0 C--N 1.353 0.749 0 N-CA-C 114.934 1.457 . . . . 0.0 114.934 -175.038 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 82.2 m-85 -135.88 158.11 45.19 Favored 'General case' 0 C--N 1.354 0.77 0 C-N-CA 128.839 2.856 . . . . 0.0 111.853 177.709 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 23.0 p90 -147.47 156.03 42.47 Favored 'General case' 0 C--N 1.368 1.406 0 C-N-CA 126.412 1.885 . . . . 0.0 110.771 176.029 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . 0.423 ' CD2' ' HB2' ' A' ' 57' ' ' CYS . 5.4 t80 -94.82 128.53 41.63 Favored 'General case' 0 C--N 1.376 1.728 0 N-CA-C 106.334 -1.728 . . . . 0.0 106.334 172.392 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -107.42 113.66 27.16 Favored 'General case' 0 N--CA 1.426 -1.638 0 C-N-CA 126.844 2.058 . . . . 0.0 108.135 -176.709 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 32.0 t-105 -49.46 -55.74 12.13 Favored 'General case' 0 C--N 1.359 0.998 0 C-N-CA 130.649 3.58 . . . . 0.0 117.942 -178.27 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.9 p -77.41 -14.72 59.64 Favored 'General case' 0 C--N 1.358 0.954 0 C-N-CA 126.327 1.851 . . . . 0.0 113.503 -178.347 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -88.35 -38.59 15.01 Favored 'General case' 0 C--N 1.363 1.17 0 C-N-CA 124.359 1.064 . . . . 0.0 111.732 174.317 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 60.2 mmtt 74.24 21.51 2.44 Favored 'General case' 0 C--N 1.372 1.548 0 C-N-CA 126.964 2.105 . . . . 0.0 112.682 -179.295 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 38.2 ttpt -147.76 166.92 26.06 Favored 'General case' 0 N--CA 1.437 -1.124 0 C-N-CA 126.852 2.061 . . . . 0.0 106.967 -174.433 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 74.9 m -90.94 144.84 25.26 Favored 'General case' 0 C--N 1.361 1.07 0 C-N-CA 126.044 1.738 . . . . 0.0 112.705 178.187 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 89.3 mt -131.87 148.88 71.66 Favored Pre-proline 0 C--N 1.36 1.052 0 C-N-CA 126.855 2.062 . . . . 0.0 109.559 179.238 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -83.98 152.01 12.7 Favored 'Trans proline' 0 C--N 1.352 0.735 0 C-N-CA 124.776 3.65 . . . . 0.0 111.591 166.532 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.459 ' CZ ' ' HD2' ' A' ' 46' ' ' ARG 0.317 0.8 OUTLIER -138.49 -156.22 0.67 Allowed 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 104.085 -2.561 . . . . 0.0 104.085 170.269 . . . . . . . . 4 4 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 48.1 mt -141.08 148.75 40.66 Favored 'General case' 0 CA--C 1.502 -0.901 1 N-CA-C 99.761 -4.163 . . . . 0.0 99.761 176.241 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -124.07 135.65 53.71 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 119.705 1.139 . . . . 0.0 109.759 -178.123 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.9 m -79.68 -10.76 59.84 Favored 'General case' 0 C--N 1.369 1.437 0 N-CA-C 119.433 3.124 . . . . 0.0 119.433 -176.592 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 128.79 -59.14 0.69 Allowed Glycine 0 C--N 1.358 1.795 0 CA-C-N 121.803 2.092 . . . . 0.0 114.464 -178.087 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 30.8 p -144.15 56.82 1.32 Allowed 'General case' 0 C--N 1.35 0.594 0 C-N-CA 125.794 1.638 . . . . 0.0 106.856 -179.364 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -121.16 -48.36 0.29 Allowed Glycine 0 C--N 1.356 1.641 0 C-N-CA 125.637 1.589 . . . . 0.0 110.002 -177.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -83.2 153.99 31.22 Favored Glycine 0 C--N 1.361 1.928 0 N-CA-C 116.048 1.179 . . . . 0.0 116.048 177.256 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . 0.507 ' H ' ' NH2' ' A' ' 46' ' ' ARG 0.422 10.2 p30 -95.3 -101.25 0.16 Allowed 'General case' 0 CA--C 1.55 0.947 0 N-CA-C 115.676 1.732 . . . . 0.0 115.676 179.696 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -129.39 9.08 5.55 Favored 'General case' 0 C--N 1.369 1.421 0 N-CA-C 117.476 2.399 . . . . 0.0 117.476 -170.341 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 33.7 t30 -109.65 30.29 6.79 Favored 'General case' 0 C--N 1.364 1.224 0 O-C-N 119.761 -1.837 . . . . 0.0 106.642 176.223 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.54 HH21 ' HB2' ' A' ' 12' ' ' ARG . 43.2 mmt-85 -111.42 123.2 49.74 Favored 'General case' 0 C--N 1.368 1.4 0 CA-C-O 124.821 2.248 . . . . 0.0 109.702 -177.59 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . 0.403 ' CE2' ' HA ' ' A' ' 53' ' ' CYS . 15.6 m-85 -113.55 148.28 36.41 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-N 112.207 -2.27 . . . . 0.0 112.167 -172.494 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -82.79 -27.64 30.82 Favored 'General case' 0 C--N 1.37 1.484 0 C-N-CA 125.931 1.692 . . . . 0.0 114.621 -179.85 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 61.9 p -137.65 173.54 11.54 Favored 'General case' 0 C--N 1.356 0.872 0 N-CA-C 106.588 -1.634 . . . . 0.0 106.588 177.827 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 14.0 tt -67.51 -27.96 40.37 Favored 'Isoleucine or valine' 0 C--N 1.365 1.26 0 C-N-CA 128.226 2.61 . . . . 0.0 114.764 179.003 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -94.35 5.3 70.91 Favored Glycine 0 C--N 1.361 1.947 0 O-C-N 121.251 -0.905 . . . . 0.0 114.464 -173.339 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -91.71 -21.96 20.46 Favored 'General case' 0 C--N 1.359 0.981 0 CA-C-O 122.227 1.013 . . . . 0.0 110.213 172.745 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . 0.403 ' HA ' ' CE2' ' A' ' 47' ' ' PHE . 40.0 t -64.41 -51.75 61.65 Favored 'General case' 0 C--N 1.359 1.012 0 C-N-CA 130.101 3.36 . . . . 0.0 116.593 -178.709 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 4.4 mtp180 -68.65 -29.7 68.24 Favored 'General case' 0 C--N 1.344 0.334 1 C-N-CA 132.051 4.14 . . . . 0.0 116.915 -175.883 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 56.9 tttm -78.72 -10.15 59.66 Favored 'General case' 0 C--N 1.357 0.934 0 C-N-CA 126.625 1.97 . . . . 0.0 113.937 -179.759 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.452 ' HB3' ' CG ' ' A' ' 6' ' ' TYR . 31.6 mttt -98.4 -36.42 9.97 Favored 'General case' 0 C--N 1.359 1.004 0 C-N-CA 127.217 2.207 . . . . 0.0 111.39 175.946 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . 0.423 ' HB2' ' CD2' ' A' ' 25' ' ' PHE . 27.8 m -126.52 15.43 7.64 Favored 'General case' 0 C--N 1.357 0.902 0 N-CA-C 118.147 2.647 . . . . 0.0 118.147 -168.763 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 18.3 mt -140.47 -20.07 0.85 Allowed 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 122.596 2.453 . . . . 0.0 113.631 174.915 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 82.69 56.58 2.75 Favored Glycine 0 C--N 1.363 2.081 0 C-N-CA 126.794 2.14 . . . . 0.0 112.279 -172.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 15.9 ptmt . . . . . 0 C--O 1.261 1.697 0 CA-C-O 116.62 -1.657 . . . . 0.0 107.394 -175.294 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 21.0 t90 . . . . . 0 N--CA 1.436 -1.165 0 CA-C-O 122.721 1.248 . . . . 0.0 110.397 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 80.7 mt-30 -140.23 151.99 65.94 Favored Pre-proline 0 C--N 1.357 0.896 1 N-CA-C 99.264 -4.347 . . . . 0.0 99.264 172.482 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 4.8 Cg_exo -81.2 117.69 3.2 Favored 'Trans proline' 0 CA--C 1.551 1.341 0 CA-C-N 126.14 3.228 . . . . 0.0 117.047 -164.275 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_exo -77.56 -117.01 0.01 OUTLIER 'Trans proline' 0 C--N 1.366 1.454 1 C-N-CA 126.003 4.469 . . . . 0.0 114.199 176.931 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . 0.483 ' CE2' ' CE1' ' A' ' 6' ' ' TYR . 52.0 p-90 -87.22 -68.01 0.78 Allowed 'General case' 0 C--N 1.374 1.657 0 C-N-CA 126.339 1.856 . . . . 0.0 115.011 -179.565 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.542 ' CD1' ' HD2' ' A' ' 56' ' ' LYS . 0.1 OUTLIER -31.73 -60.53 0.24 Allowed 'General case' 0 C--N 1.359 0.985 1 C-N-CA 134.296 5.038 . . . . 0.0 118.58 -173.818 . . . . . . . . 4 4 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 3.3 m -52.87 -40.24 63.27 Favored 'General case' 0 CA--C 1.497 -1.07 1 C-N-CA 131.987 4.115 . . . . 0.0 116.34 -176.129 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . 0.273 57.0 tttm -113.87 22.11 14.28 Favored 'General case' 0 N--CA 1.428 -1.569 0 C-N-CA 128.385 2.674 . . . . 0.0 108.166 -174.404 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 14.6 tp10 -95.36 138.74 21.85 Favored Pre-proline 0 C--N 1.374 1.64 0 O-C-N 120.325 -1.484 . . . . 0.0 112.148 -174.327 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_exo -70.05 110.18 2.55 Favored 'Trans proline' 0 C--N 1.363 1.333 0 C-N-CA 124.227 3.285 . . . . 0.0 112.555 -174.518 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 8.6 p -72.95 132.13 33.86 Favored 'Isoleucine or valine' 0 C--N 1.36 1.031 0 C-N-CA 128.057 2.543 . . . . 0.0 110.519 178.303 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . 0.252 41.1 mmt-85 -132.28 136.54 47.01 Favored 'General case' 0 CA--C 1.496 -1.123 0 C-N-CA 126.16 1.784 . . . . 0.0 106.645 -169.87 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.302 16.7 tt -97.67 -41.01 10.51 Favored 'Isoleucine or valine' 0 C--N 1.37 1.473 0 CA-C-N 119.924 1.238 . . . . 0.0 111.494 175.279 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 118.51 -151.94 17.61 Favored Glycine 0 C--N 1.362 1.982 0 C-N-CA 124.351 0.977 . . . . 0.0 115.303 172.914 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 70.5 m -153.65 38.85 0.48 Allowed 'General case' 0 C--N 1.362 1.151 0 O-C-N 119.123 -2.398 . . . . 0.0 108.672 178.405 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -98.04 179.1 4.89 Favored 'General case' 0 C--N 1.357 0.913 0 C-N-CA 128.322 2.649 . . . . 0.0 110.398 178.758 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 14.0 mmmm -102.85 36.83 2.09 Favored 'General case' 0 C--N 1.352 0.688 0 O-C-N 120.104 -1.623 . . . . 0.0 112.367 -175.719 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 1.5 tpmt? -148.35 168.28 23.0 Favored 'General case' 0 C--N 1.364 1.197 0 C-N-CA 124.231 1.012 . . . . 0.0 109.809 179.187 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 13.8 mm-40 -147.06 112.43 5.56 Favored 'General case' 0 N--CA 1.441 -0.907 0 C-N-CA 128.767 2.827 . . . . 0.0 105.104 169.357 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 82.9 m-85 -104.63 133.02 50.18 Favored 'General case' 0 C--N 1.354 0.768 0 O-C-N 119.886 -1.759 . . . . 0.0 107.609 174.424 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' SER . . . . . 0.415 ' HA ' ' HG ' ' A' ' 36' ' ' LEU . 5.1 t -69.49 125.72 27.58 Favored 'General case' 0 C--N 1.377 1.777 0 CA-C-N 122.179 2.263 . . . . 0.0 115.337 179.831 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 4.5 p -138.49 -169.37 2.58 Favored 'General case' 0 C--N 1.352 0.691 0 C-N-CA 128.043 2.537 . . . . 0.0 111.805 -173.297 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 79.9 m-85 -140.3 153.03 46.32 Favored 'General case' 0 C--N 1.359 0.979 0 C-N-CA 129.569 3.148 . . . . 0.0 112.008 176.042 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . 0.288 4.1 p90 -144.18 163.48 33.48 Favored 'General case' 0 C--N 1.376 1.73 0 C-N-CA 127.038 2.135 . . . . 0.0 109.816 170.683 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 16.0 t80 -99.53 128.32 45.63 Favored 'General case' 0 C--N 1.369 1.418 0 C-N-CA 125.693 1.597 . . . . 0.0 108.918 -179.07 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.486 ' NZ ' ' H ' ' A' ' 28' ' ' THR . 0.0 OUTLIER -91.29 112.17 23.97 Favored 'General case' 0 C--N 1.372 1.569 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 175.25 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . 0.472 ' N ' ' HZ3' ' A' ' 26' ' ' LYS . 16.9 t-105 -61.29 -40.67 95.01 Favored 'General case' 0 C--N 1.349 0.552 0 C-N-CA 128.918 2.887 . . . . 0.0 115.057 177.813 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' THR . . . . . 0.486 ' H ' ' NZ ' ' A' ' 26' ' ' LYS 0.318 46.4 p -83.24 -25.54 31.59 Favored 'General case' 0 C--N 1.36 1.03 0 C-N-CA 123.626 0.771 . . . . 0.0 112.504 176.402 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -82.19 -39.76 22.69 Favored 'General case' 0 C--N 1.379 1.864 0 CA-C-N 120.826 1.648 . . . . 0.0 114.036 172.351 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . 0.274 24.3 tptt 84.09 25.77 0.1 Allowed 'General case' 0 C--N 1.365 1.269 0 C-N-CA 129.007 2.923 . . . . 0.0 113.417 178.841 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.418 ' HZ2' ' HB2' ' A' ' 32' ' ' CYS . 23.6 tptp -147.39 170.39 17.46 Favored 'General case' 0 C--N 1.357 0.895 0 C-N-CA 126.035 1.734 . . . . 0.0 106.786 179.822 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.418 ' HB2' ' HZ2' ' A' ' 31' ' ' LYS . 78.8 m -85.61 142.16 29.29 Favored 'General case' 0 C--N 1.355 0.824 0 C-N-CA 127.786 2.434 . . . . 0.0 113.458 179.991 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 13.8 mt -127.14 149.71 70.24 Favored Pre-proline 0 C--N 1.356 0.879 0 C-N-CA 125.566 1.547 . . . . 0.0 109.388 178.382 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 65.3 Cg_endo -82.36 154.28 16.26 Favored 'Trans proline' 0 C--N 1.348 0.55 0 C-N-CA 123.928 3.085 . . . . 0.0 111.066 164.07 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 1.4 p90 -152.35 171.76 17.52 Favored 'General case' 0 N--CA 1.448 -0.559 1 N-CA-C 99.659 -4.2 . . . . 0.0 99.659 170.899 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.415 ' HG ' ' HA ' ' A' ' 21' ' ' SER . 7.8 mp -110.65 156.98 20.23 Favored 'General case' 0 N--CA 1.44 -0.942 0 N-CA-C 105.436 -2.061 . . . . 0.0 105.436 174.001 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 3.1 t80 -119.5 130.32 55.15 Favored 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 126.609 1.964 . . . . 0.0 108.332 179.603 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 43.2 m -83.78 -33.22 25.04 Favored 'General case' 0 C--N 1.361 1.097 0 N-CA-C 115.842 1.794 . . . . 0.0 115.842 178.891 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 121.37 -67.13 0.45 Allowed Glycine 0 C--N 1.355 1.601 0 C-N-CA 125.286 1.422 . . . . 0.0 113.682 -176.57 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 18.3 p -93.78 124.23 37.64 Favored 'General case' 0 C--N 1.355 0.833 0 O-C-N 120.652 -1.499 . . . . 0.0 110.106 179.096 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 105.53 -16.11 44.95 Favored Glycine 0 C--N 1.361 1.935 0 O-C-N 121.564 -0.71 . . . . 0.0 112.616 -175.904 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -81.19 165.85 47.48 Favored Glycine 0 C--N 1.364 2.126 0 CA-C-N 118.671 1.236 . . . . 0.0 114.722 173.079 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -155.22 118.52 4.42 Favored 'General case' 0 C--N 1.36 1.058 0 N-CA-C 116.24 1.941 . . . . 0.0 116.24 -178.963 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . 41.77 -34.63 0.0 OUTLIER 'General case' 0 C--N 1.368 1.373 2 N-CA-C 124.213 4.894 . . . . 0.0 124.213 170.828 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 53.7 t30 -93.25 72.13 4.53 Favored 'General case' 0 C--N 1.36 1.047 0 C-N-CA 125.715 1.606 . . . . 0.0 109.87 -175.598 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 5.4 ptp180 -148.3 131.38 16.32 Favored 'General case' 0 CA--C 1.508 -0.671 0 CA-C-O 123.916 1.817 . . . . 0.0 108.734 176.636 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . 0.435 ' CD2' ' HA ' ' A' ' 53' ' ' CYS . 13.9 m-85 -106.34 142.24 36.33 Favored 'General case' 0 C--N 1.349 0.571 0 C-N-CA 126.696 1.998 . . . . 0.0 109.322 -174.02 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.43 -37.4 60.42 Favored 'General case' 0 C--N 1.372 1.572 0 N-CA-C 114.965 1.468 . . . . 0.0 114.965 -178.332 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 72.8 p -123.29 -179.63 4.38 Favored 'General case' 0 C--N 1.361 1.081 0 C-N-CA 127.079 2.151 . . . . 0.0 107.863 175.561 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 18.6 tt -76.77 -16.28 14.78 Favored 'Isoleucine or valine' 0 C--N 1.364 1.206 0 C-N-CA 127.91 2.484 . . . . 0.0 113.594 174.513 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -96.59 -8.28 57.39 Favored Glycine 0 C--N 1.366 2.241 0 O-C-N 120.454 -1.404 . . . . 0.0 115.252 -178.779 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 14.0 tp10 -85.87 -18.8 31.77 Favored 'General case' 0 C--N 1.362 1.147 0 C-N-CA 125.509 1.524 . . . . 0.0 111.603 175.078 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . 0.435 ' HA ' ' CD2' ' A' ' 47' ' ' PHE . 52.9 t -63.51 -61.47 2.31 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 128.312 2.645 . . . . 0.0 114.779 179.99 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.407 ' HB2' ' HD3' ' A' ' 60' ' ' LYS . 6.7 ptt180 -68.92 -13.41 62.41 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 129.953 3.301 . . . . 0.0 118.632 -177.844 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 17.6 mmtp -68.34 -52.78 29.46 Favored 'General case' 0 C--N 1.366 1.309 0 C-N-CA 126.452 1.901 . . . . 0.0 112.647 176.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.542 ' HD2' ' CD1' ' A' ' 6' ' ' TYR . 32.3 mtmt -68.7 -24.63 64.51 Favored 'General case' 0 C--N 1.356 0.858 0 C-N-CA 130.419 3.488 . . . . 0.0 113.623 176.971 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . 0.404 ' SG ' ' HB2' ' A' ' 6' ' ' TYR . 90.7 m -128.37 5.39 5.73 Favored 'General case' 0 C--N 1.359 0.981 0 N-CA-C 119.166 3.024 . . . . 0.0 119.166 -170.04 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 13.5 mt -134.99 -15.58 1.99 Allowed 'General case' 0 N--CA 1.473 0.696 0 CA-C-N 123.15 2.704 . . . . 0.0 111.267 172.441 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 75.9 63.65 2.39 Favored Glycine 0 C--N 1.363 2.03 0 C-N-CA 128.252 2.834 . . . . 0.0 112.47 -168.391 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . 0.407 ' HD3' ' HB2' ' A' ' 54' ' ' ARG . 14.2 ptmt . . . . . 0 C--O 1.262 1.724 0 CA-C-O 115.655 -2.117 . . . . 0.0 107.134 -176.442 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' TRP . . . . . 0.421 ' CZ2' ' HA ' ' A' ' 3' ' ' PRO . 5.5 t90 . . . . . 0 N--CA 1.433 -1.292 0 N-CA-C 106.014 -1.847 . . . . 0.0 106.014 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 32.4 mt-30 -139.45 148.55 56.87 Favored Pre-proline 0 C--N 1.355 0.825 1 N-CA-C 100.008 -4.071 . . . . 0.0 100.008 172.093 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.421 ' HA ' ' CZ2' ' A' ' 1' ' ' TRP . 1.8 Cg_endo -74.23 124.23 8.85 Favored 'Trans proline' 0 CA--C 1.555 1.533 0 C-N-CA 123.491 2.794 . . . . 0.0 115.516 -169.562 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . 0.425 ' HG2' ' CD2' ' A' ' 6' ' ' TYR . 43.2 Cg_endo -93.3 -113.4 0.0 OUTLIER 'Trans proline' 0 CA--C 1.549 1.227 1 C-N-CA 126.569 4.846 . . . . 0.0 111.174 -179.446 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . 0.47 ' CE3' ' CD1' ' A' ' 6' ' ' TYR 0.272 47.7 p-90 -86.49 -70.62 0.59 Allowed 'General case' 0 C--N 1.383 2.023 0 C-N-CA 126.929 2.091 . . . . 0.0 114.483 178.591 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.541 ' CD1' ' HD2' ' A' ' 56' ' ' LYS . 0.1 OUTLIER -31.72 -55.66 0.28 Allowed 'General case' 0 C--N 1.36 1.061 1 C-N-CA 133.277 4.631 . . . . 0.0 118.887 -173.663 . . . . . . . . 4 4 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 3.2 m -59.52 -33.21 71.09 Favored 'General case' 0 CA--C 1.498 -1.038 0 C-N-CA 130.215 3.406 . . . . 0.0 117.638 -173.95 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . 0.303 65.3 tttm -117.14 18.31 14.59 Favored 'General case' 0 N--CA 1.436 -1.152 0 C-N-CA 128.978 2.911 . . . . 0.0 107.958 -176.232 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 23.3 tp10 -93.64 131.46 32.24 Favored Pre-proline 0 C--N 1.366 1.291 0 O-C-N 120.398 -1.439 . . . . 0.0 112.919 -173.419 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 77.9 Cg_exo -63.63 119.27 6.26 Favored 'Trans proline' 0 C--N 1.362 1.239 0 C-N-CA 124.368 3.379 . . . . 0.0 116.452 -167.348 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 11.1 p -69.11 141.14 17.74 Favored 'Isoleucine or valine' 0 C--N 1.359 0.989 0 C-N-CA 125.308 1.443 . . . . 0.0 114.256 178.815 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.436 ' NH2' ' H ' ' A' ' 14' ' ' GLY . 9.5 mmm180 -131.07 -160.56 1.05 Allowed 'General case' 0 N--CA 1.438 -1.045 0 C-N-CA 126.06 1.744 . . . . 0.0 110.969 -174.911 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 11.1 tt -159.07 -35.8 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.427 -1.576 0 C-N-CA 128.283 2.633 . . . . 0.0 109.454 171.663 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.436 ' H ' ' NH2' ' A' ' 12' ' ' ARG . . . 106.97 -62.81 0.3 Allowed Glycine 0 C--N 1.356 1.682 0 N-CA-C 108.574 -1.811 . . . . 0.0 108.574 -173.054 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . 0.337 69.0 m 90.89 49.5 0.0 OUTLIER 'General case' 0 C--N 1.354 0.799 0 C-N-CA 129.552 3.141 . . . . 0.0 111.17 178.019 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -92.41 -158.77 0.61 Allowed 'General case' 0 C--N 1.359 0.995 0 CA-C-O 123.981 1.848 . . . . 0.0 110.901 176.198 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 13.2 mmmm -88.06 -12.71 43.48 Favored 'General case' 0 N--CA 1.453 -0.317 0 N-CA-C 117.01 2.226 . . . . 0.0 117.01 -171.595 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 76.0 tttt -148.43 141.56 24.98 Favored 'General case' 0 C--N 1.361 1.099 0 O-C-N 120.149 -1.594 . . . . 0.0 108.159 176.776 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 10.0 mp0 -100.18 122.7 43.42 Favored 'General case' 0 C--N 1.355 0.809 0 C-N-CA 125.923 1.689 . . . . 0.0 108.218 179.376 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 7.1 m-85 -110.27 134.91 51.79 Favored 'General case' 0 C--N 1.359 0.997 0 N-CA-C 104.62 -2.363 . . . . 0.0 104.62 177.909 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 3.8 t -69.36 141.02 54.29 Favored 'General case' 0 C--N 1.365 1.282 0 CA-C-N 121.809 2.095 . . . . 0.0 116.172 -175.207 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 20.1 p -138.19 -171.15 2.96 Favored 'General case' 0 C--N 1.358 0.976 0 C-N-CA 126.849 2.06 . . . . 0.0 111.108 179.385 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 -139.91 147.06 40.03 Favored 'General case' 0 C--N 1.362 1.109 0 C-N-CA 127.37 2.268 . . . . 0.0 110.709 172.577 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 9.7 p90 -137.85 162.9 32.78 Favored 'General case' 0 C--N 1.373 1.607 0 C-N-CA 126.411 1.884 . . . . 0.0 109.558 172.723 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . 0.431 ' CZ ' ' HG ' ' A' ' 58' ' ' LEU . 11.7 t80 -100.19 127.05 46.53 Favored 'General case' 0 C--N 1.362 1.11 0 O-C-N 120.598 -1.314 . . . . 0.0 107.726 179.694 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 36.4 tttm -86.62 104.93 16.51 Favored 'General case' 0 C--N 1.371 1.528 0 O-C-N 121.335 -0.853 . . . . 0.0 111.102 178.126 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 43.3 t-105 -52.01 -46.49 64.96 Favored 'General case' 0 C--N 1.364 1.197 0 C-N-CA 128.863 2.865 . . . . 0.0 116.811 -176.279 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 2.2 p -88.32 1.25 55.0 Favored 'General case' 0 C--N 1.349 0.57 0 C-N-CA 125.53 1.532 . . . . 0.0 113.578 179.567 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -109.87 -40.27 4.83 Favored 'General case' 0 C--N 1.36 1.057 0 O-C-N 120.95 -1.094 . . . . 0.0 111.54 176.402 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . 0.253 26.9 tptt 86.39 27.16 0.05 OUTLIER 'General case' 0 C--N 1.363 1.187 0 C-N-CA 127.953 2.501 . . . . 0.0 113.54 179.523 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 61.4 tttp -146.48 159.55 43.26 Favored 'General case' 0 C--N 1.356 0.886 0 C-N-CA 125.422 1.489 . . . . 0.0 108.102 -178.321 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 76.5 m -79.72 140.77 36.85 Favored 'General case' 0 C--N 1.364 1.214 0 C-N-CA 127.717 2.407 . . . . 0.0 112.449 177.03 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 19.1 mt -128.32 157.38 74.68 Favored Pre-proline 0 C--N 1.355 0.807 0 C-N-CA 126.209 1.804 . . . . 0.0 109.183 177.274 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -88.11 167.77 6.67 Favored 'Trans proline' 0 N--CA 1.455 -0.745 0 C-N-CA 123.815 3.01 . . . . 0.0 111.412 167.976 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 5.4 p90 -163.32 -176.71 4.91 Favored 'General case' 0 N--CA 1.445 -0.683 0 N-CA-C 102.005 -3.331 . . . . 0.0 102.005 172.61 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -125.21 147.01 49.26 Favored 'General case' 0 N--CA 1.423 -1.808 0 N-CA-C 104.929 -2.249 . . . . 0.0 104.929 173.916 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.432 ' CZ ' ' HA2' ' A' ' 39' ' ' GLY . 36.8 t80 -111.1 137.69 48.45 Favored 'General case' 0 CA--C 1.533 0.302 0 N-CA-C 104.607 -2.368 . . . . 0.0 104.607 173.316 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 77.5 p -104.78 -2.3 25.01 Favored 'General case' 0 C--N 1.365 1.266 0 C-N-CA 125.521 1.528 . . . . 0.0 112.386 -178.665 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . 0.432 ' HA2' ' CZ ' ' A' ' 37' ' ' PHE . . . 94.11 -59.6 2.0 Favored Glycine 0 C--N 1.356 1.643 0 O-C-N 120.029 -1.669 . . . . 0.0 115.252 170.419 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.9 m -73.09 62.27 0.63 Allowed 'General case' 0 C--N 1.354 0.802 0 C-N-CA 127.876 2.471 . . . . 0.0 116.036 -176.432 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 127.77 34.79 0.54 Allowed Glycine 0 C--N 1.357 1.737 0 N-CA-C 119.344 2.497 . . . . 0.0 119.344 168.687 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -94.31 170.98 30.49 Favored Glycine 0 C--N 1.368 2.316 0 CA-C-N 121.793 2.796 . . . . 0.0 111.524 175.937 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . 0.312 27.2 p30 -88.9 -99.17 0.09 Allowed 'General case' 0 C--N 1.365 1.262 0 N-CA-C 117.297 2.332 . . . . 0.0 117.297 -178.087 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -144.78 -9.38 0.62 Allowed 'General case' 0 C--N 1.353 0.719 0 O-C-N 120.461 -1.399 . . . . 0.0 114.175 -171.989 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 61.3 t30 -94.93 77.44 3.59 Favored 'General case' 0 C--N 1.357 0.895 0 O-C-N 119.97 -1.706 . . . . 0.0 114.313 -177.781 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . 0.406 0.0 OUTLIER -145.17 145.03 31.19 Favored 'General case' 0 C--N 1.357 0.898 0 CA-C-O 124.542 2.115 . . . . 0.0 113.745 169.229 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 12.0 m-85 -111.32 133.68 53.47 Favored 'General case' 0 C--N 1.353 0.744 0 C-N-CA 128.025 2.53 . . . . 0.0 108.249 -177.386 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 4.2 mp0 -74.44 -55.04 6.41 Favored 'General case' 0 C--N 1.371 1.523 0 C-N-CA 126.492 1.917 . . . . 0.0 113.132 -178.095 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 9.8 p -111.69 160.79 16.93 Favored 'General case' 0 C--N 1.354 0.804 0 N-CA-C 104.958 -2.238 . . . . 0.0 104.958 174.939 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 16.4 tt -59.49 -30.13 43.81 Favored 'Isoleucine or valine' 0 C--N 1.361 1.095 0 N-CA-C 117.42 2.378 . . . . 0.0 117.42 -175.026 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -96.22 13.59 65.6 Favored Glycine 0 C--N 1.357 1.73 0 O-C-N 119.926 -1.734 . . . . 0.0 115.293 -179.168 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 16.1 tp10 -89.84 -4.58 57.52 Favored 'General case' 0 C--N 1.364 1.22 0 CA-C-O 122.899 1.333 . . . . 0.0 109.845 171.107 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 18.7 t -79.78 -39.03 31.8 Favored 'General case' 0 C--N 1.359 1.0 1 C-N-CA 132.687 4.395 . . . . 0.0 112.843 179.668 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.415 ' HB3' ' HG3' ' A' ' 60' ' ' LYS . 55.2 mtp180 -69.01 -47.31 65.8 Favored 'General case' 0 C--N 1.34 0.17 1 C-N-CA 133.925 4.89 . . . . 0.0 117.486 -178.532 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 87.3 tttt -66.94 -30.88 71.14 Favored 'General case' 0 C--N 1.362 1.13 0 C-N-CA 127.827 2.451 . . . . 0.0 113.727 -178.878 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.541 ' HD2' ' CD1' ' A' ' 6' ' ' TYR . 20.3 mtmm -87.88 -36.05 17.39 Favored 'General case' 0 C--N 1.359 1.02 0 C-N-CA 127.876 2.47 . . . . 0.0 112.192 174.636 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 97.6 m -127.04 2.82 6.52 Favored 'General case' 0 C--N 1.369 1.427 0 N-CA-C 120.725 3.602 . . . . 0.0 120.725 -171.725 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.431 ' HG ' ' CZ ' ' A' ' 25' ' ' PHE . 14.7 mt -130.4 -26.28 2.32 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 122.215 2.28 . . . . 0.0 110.756 170.365 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 88.9 52.64 2.73 Favored Glycine 0 C--N 1.361 1.963 0 C-N-CA 128.646 3.022 . . . . 0.0 111.327 -172.278 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . 0.415 ' HG3' ' HB3' ' A' ' 54' ' ' ARG . 19.3 ptmt . . . . . 0 C--O 1.259 1.59 0 CA-C-N 118.377 1.089 . . . . 0.0 111.033 -172.934 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 84.7 t90 . . . . . 0 N--CA 1.434 -1.229 0 CA-C-O 122.149 0.976 . . . . 0.0 108.681 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 24.2 mm-40 -144.32 148.48 41.1 Favored Pre-proline 0 C--N 1.349 0.584 1 N-CA-C 98.296 -4.705 . . . . 0.0 98.296 170.733 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_endo -74.47 120.33 6.17 Favored 'Trans proline' 0 CA--C 1.555 1.548 0 CA-C-N 124.701 2.715 . . . . 0.0 116.023 -168.511 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 24.1 Cg_exo -77.41 -120.22 0.01 OUTLIER 'Trans proline' 0 C--N 1.369 1.657 1 C-N-CA 126.968 5.112 . . . . 0.0 113.587 175.639 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . 0.482 ' CE3' ' CD1' ' A' ' 6' ' ' TYR . 0.4 OUTLIER -86.66 -68.16 0.76 Allowed 'General case' 0 C--N 1.379 1.885 0 C-N-CA 126.955 2.102 . . . . 0.0 113.432 177.557 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.58 ' CD1' ' HD2' ' A' ' 56' ' ' LYS . 0.1 OUTLIER -31.13 -51.46 0.17 Allowed 'General case' 0 C--N 1.363 1.191 1 C-N-CA 133.97 4.908 . . . . 0.0 117.591 -172.844 . . . . . . . . 4 4 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 2.9 m -57.87 -43.49 86.04 Favored 'General case' 0 CA--C 1.511 -0.519 0 C-N-CA 129.925 3.29 . . . . 0.0 116.007 -175.708 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 26.7 mtpp -103.8 17.38 24.23 Favored 'General case' 0 C--N 1.357 0.904 0 C-N-CA 127.231 2.212 . . . . 0.0 109.908 177.261 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 29.7 tp10 -90.22 127.06 54.76 Favored Pre-proline 0 C--N 1.361 1.072 0 O-C-N 120.468 -1.395 . . . . 0.0 112.234 -170.893 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -67.88 122.51 9.64 Favored 'Trans proline' 0 C--N 1.364 1.371 0 C-N-CA 124.08 3.186 . . . . 0.0 114.43 -165.977 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 7.8 p -69.78 134.06 30.78 Favored 'Isoleucine or valine' 0 C--N 1.357 0.918 0 C-N-CA 126.692 1.997 . . . . 0.0 112.674 -179.767 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 46.8 mtt180 -135.05 125.18 25.99 Favored 'General case' 0 C--N 1.359 0.981 0 CA-C-O 117.134 -1.412 . . . . 0.0 109.109 -175.486 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.267 17.3 tt -96.2 -38.73 8.63 Favored 'Isoleucine or valine' 0 C--N 1.37 1.486 0 CA-C-N 120.16 1.345 . . . . 0.0 112.106 175.398 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 114.4 -144.67 18.39 Favored Glycine 0 C--N 1.357 1.7 0 C-N-CA 125.805 1.669 . . . . 0.0 113.846 177.348 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 71.4 m -158.36 40.73 0.26 Allowed 'General case' 0 C--N 1.36 1.041 0 O-C-N 119.018 -2.46 . . . . 0.0 108.192 179.772 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -104.38 -175.56 2.83 Favored 'General case' 0 C--N 1.356 0.87 0 CA-C-O 124.555 2.122 . . . . 0.0 110.08 179.917 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 14.0 mmmm -111.14 39.35 2.3 Favored 'General case' 0 C--N 1.344 0.329 0 C-N-CA 125.669 1.588 . . . . 0.0 110.824 -177.966 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 16.6 tppt? -146.33 156.53 43.4 Favored 'General case' 0 N--CA 1.439 -1.024 0 N-CA-C 104.192 -2.521 . . . . 0.0 104.192 179.525 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 6.5 mp0 -147.94 118.83 7.61 Favored 'General case' 0 N--CA 1.433 -1.303 0 N-CA-C 105.054 -2.202 . . . . 0.0 105.054 171.843 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 73.5 m-85 -103.4 145.07 30.54 Favored 'General case' 0 C--N 1.353 0.723 0 N-CA-C 105.718 -1.956 . . . . 0.0 105.718 171.04 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 3.7 t -72.75 142.65 48.13 Favored 'General case' 0 C--N 1.371 1.534 0 CA-C-N 122.063 2.211 . . . . 0.0 115.146 -177.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 80.6 p -146.82 -169.38 3.28 Favored 'General case' 0 C--N 1.361 1.089 0 C-N-CA 125.553 1.541 . . . . 0.0 113.606 -175.948 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 62.0 m-85 -145.63 149.28 34.22 Favored 'General case' 0 C--N 1.361 1.095 0 C-N-CA 130.384 3.474 . . . . 0.0 110.777 175.929 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 9.4 p90 -143.49 154.46 43.67 Favored 'General case' 0 C--N 1.365 1.271 0 C-N-CA 127.44 2.296 . . . . 0.0 109.691 174.456 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 11.5 t80 -94.49 121.87 36.48 Favored 'General case' 0 C--N 1.371 1.523 0 N-CA-C 106.269 -1.752 . . . . 0.0 106.269 177.404 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.11 102.56 14.37 Favored 'General case' 0 N--CA 1.431 -1.383 0 CA-C-O 122.032 0.92 . . . . 0.0 110.282 178.709 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 14.9 t-105 -48.11 -46.36 33.99 Favored 'General case' 0 C--N 1.355 0.824 0 C-N-CA 130.26 3.424 . . . . 0.0 118.266 -174.93 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 3.0 p -79.08 -18.6 53.08 Favored 'General case' 0 C--N 1.358 0.941 0 C-N-CA 125.675 1.59 . . . . 0.0 112.98 179.191 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -87.54 -40.81 13.95 Favored 'General case' 0 C--N 1.366 1.324 0 C-N-CA 124.401 1.08 . . . . 0.0 111.18 172.936 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . 0.297 0.0 OUTLIER 77.45 30.2 0.51 Allowed 'General case' 0 C--N 1.363 1.179 0 C-N-CA 128.94 2.896 . . . . 0.0 113.41 179.349 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 53.2 tptt -148.35 167.39 25.34 Favored 'General case' 0 C--N 1.358 0.971 0 C-N-CA 127.247 2.219 . . . . 0.0 107.204 176.899 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 92.7 m -78.67 138.26 38.21 Favored 'General case' 0 C--N 1.357 0.93 0 C-N-CA 128.481 2.713 . . . . 0.0 114.822 178.971 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 12.0 mt -122.95 148.44 54.06 Favored Pre-proline 0 C--N 1.359 1.013 0 C-N-CA 125.846 1.659 . . . . 0.0 109.328 176.19 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 63.3 Cg_endo -82.8 159.5 16.2 Favored 'Trans proline' 0 CA--C 1.535 0.527 0 C-N-CA 123.115 2.543 . . . . 0.0 111.689 167.311 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . 0.317 2.0 p90 -150.97 -160.27 1.15 Allowed 'General case' 0 C--N 1.347 0.468 0 N-CA-C 104.888 -2.264 . . . . 0.0 104.888 169.796 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 18.8 mt -140.87 153.11 45.58 Favored 'General case' 0 N--CA 1.436 -1.128 0 N-CA-C 101.83 -3.396 . . . . 0.0 101.83 175.472 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -121.95 130.59 53.45 Favored 'General case' 0 N--CA 1.469 0.484 0 N-CA-C 105.071 -2.196 . . . . 0.0 105.071 178.035 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 89.3 p -77.84 -82.54 0.09 Allowed 'General case' 0 C--N 1.37 1.48 0 O-C-N 121.13 -0.981 . . . . 0.0 112.2 179.733 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 176.7 -59.6 0.1 Allowed Glycine 0 CA--C 1.488 -1.597 0 N-CA-C 108.99 -1.644 . . . . 0.0 108.99 173.565 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 20.2 p -83.73 79.42 9.47 Favored 'General case' 0 C--N 1.359 1.018 0 C-N-CA 126.692 1.997 . . . . 0.0 112.963 179.694 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 144.4 19.36 0.19 Allowed Glycine 0 C--N 1.352 1.425 0 N-CA-C 116.933 1.533 . . . . 0.0 116.933 174.557 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -71.14 176.07 38.06 Favored Glycine 0 C--N 1.366 2.204 0 N-CA-C 119.711 2.645 . . . . 0.0 119.711 175.692 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . 0.451 ' H ' ' CZ ' ' A' ' 46' ' ' ARG . 36.0 t-20 -136.76 -156.68 0.72 Allowed 'General case' 0 C--N 1.353 0.726 0 C-N-CA 125.392 1.477 . . . . 0.0 109.114 -174.596 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -99.44 -15.87 18.57 Favored 'General case' 0 C--N 1.354 0.784 0 O-C-N 120.256 -1.527 . . . . 0.0 114.261 -176.869 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 63.0 t30 -94.5 73.83 3.79 Favored 'General case' 0 C--N 1.363 1.165 0 O-C-N 119.653 -1.904 . . . . 0.0 110.396 -178.555 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.451 ' CZ ' ' H ' ' A' ' 43' ' ' ASN 0.303 0.0 OUTLIER -137.21 127.59 26.54 Favored 'General case' 0 C--N 1.352 0.704 0 CA-C-O 124.135 1.921 . . . . 0.0 109.759 172.02 . . . . . . . . 4 4 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 23.4 m-85 -108.06 142.99 37.4 Favored 'General case' 0 C--N 1.353 0.748 0 C-N-CA 127.364 2.266 . . . . 0.0 109.011 -175.248 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 32.5 mt-30 -66.12 -68.63 0.35 Allowed 'General case' 0 C--N 1.365 1.255 0 C-N-CA 128.57 2.748 . . . . 0.0 113.49 -178.544 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 40.9 p -119.12 170.65 8.88 Favored 'General case' 0 C--N 1.354 0.793 0 C-N-CA 124.955 1.302 . . . . 0.0 108.788 176.901 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 16.0 tt -58.72 -26.78 32.72 Favored 'Isoleucine or valine' 0 C--N 1.361 1.105 0 C-N-CA 128.46 2.704 . . . . 0.0 116.297 178.664 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -86.04 -16.9 62.15 Favored Glycine 0 C--N 1.36 1.88 0 O-C-N 120.282 -1.511 . . . . 0.0 116.088 175.35 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 15.2 tp10 -82.9 -25.58 32.33 Favored 'General case' 0 C--N 1.371 1.52 0 CA-C-N 120.358 2.079 . . . . 0.0 111.349 176.313 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 9.6 t -59.84 -44.6 93.99 Favored 'General case' 0 CA--C 1.559 1.293 0 C-N-CA 127.526 2.33 . . . . 0.0 115.955 177.524 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 5.4 ptt180 -82.24 -18.66 41.72 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 126.509 1.923 . . . . 0.0 113.645 178.087 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 36.1 ttmt -75.46 -16.42 60.32 Favored 'General case' 0 C--N 1.361 1.091 0 C-N-CA 126.797 2.039 . . . . 0.0 114.656 178.552 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.58 ' HD2' ' CD1' ' A' ' 6' ' ' TYR . 5.4 ttmt -103.98 -24.33 13.25 Favored 'General case' 0 C--N 1.361 1.098 0 C-N-CA 126.208 1.803 . . . . 0.0 110.82 175.985 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . 0.452 ' SG ' ' HB2' ' A' ' 6' ' ' TYR . 34.4 m -127.21 10.38 6.85 Favored 'General case' 0 C--N 1.364 1.21 0 N-CA-C 118.031 2.604 . . . . 0.0 118.031 -169.14 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 12.1 mt -139.34 -18.67 0.98 Allowed 'General case' 0 C--N 1.35 0.614 0 CA-C-N 121.838 2.108 . . . . 0.0 112.87 172.256 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 82.05 51.53 4.42 Favored Glycine 0 C--N 1.362 1.988 0 C-N-CA 127.589 2.518 . . . . 0.0 111.673 -171.275 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 12.8 mtpt . . . . . 0 C--O 1.262 1.743 0 C-N-CA 124.76 1.224 . . . . 0.0 108.232 -177.024 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' TRP . . . . . 0.465 ' CZ2' ' HB3' ' A' ' 3' ' ' PRO . 83.0 t90 . . . . . 0 N--CA 1.432 -1.338 0 N-CA-C 107.386 -1.339 . . . . 0.0 107.386 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -144.76 148.22 38.6 Favored Pre-proline 0 C--N 1.353 0.728 1 N-CA-C 96.865 -5.235 . . . . 0.0 96.865 172.185 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.465 ' HB3' ' CZ2' ' A' ' 1' ' ' TRP . 90.3 Cg_endo -81.08 123.23 4.47 Favored 'Trans proline' 0 CA--C 1.555 1.553 0 CA-C-N 125.702 3.072 . . . . 0.0 115.259 -165.815 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_exo -74.52 -115.48 0.01 OUTLIER 'Trans proline' 0 CA--C 1.55 1.301 1 C-N-CA 126.751 4.967 . . . . 0.0 113.828 174.527 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . 0.488 ' CE3' ' CD2' ' A' ' 6' ' ' TYR . 21.7 p-90 -87.75 -72.3 0.53 Allowed 'General case' 0 C--N 1.376 1.729 0 C-N-CA 126.71 2.004 . . . . 0.0 115.01 179.882 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.505 ' CD2' ' HD2' ' A' ' 56' ' ' LYS . 0.0 OUTLIER -31.26 -53.99 0.23 Allowed 'General case' 0 C--N 1.356 0.877 1 C-N-CA 133.868 4.867 . . . . 0.0 118.065 -173.378 . . . . . . . . 4 4 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.9 m -54.96 -33.49 62.4 Favored 'General case' 0 CA--C 1.502 -0.901 0 C-N-CA 131.444 3.897 . . . . 0.0 116.488 -176.501 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 11.7 mtpp -113.96 13.73 18.32 Favored 'General case' 0 N--CA 1.439 -0.987 0 C-N-CA 129.978 3.311 . . . . 0.0 109.891 -177.857 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 34.7 tp10 -90.67 142.37 27.81 Favored Pre-proline 0 C--N 1.364 1.209 0 O-C-N 120.74 -1.225 . . . . 0.0 114.289 -170.29 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -68.0 117.7 5.09 Favored 'Trans proline' 0 C--N 1.367 1.531 0 C-N-CA 124.682 3.588 . . . . 0.0 115.324 -173.891 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 14.5 p -69.72 128.02 32.48 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.938 0 C-N-CA 128.387 2.675 . . . . 0.0 111.885 176.138 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.431 ' HB2' HH22 ' A' ' 46' ' ' ARG . 2.2 mmp_? -142.36 122.58 13.84 Favored 'General case' 0 C--N 1.366 1.313 0 C-N-CA 125.65 1.58 . . . . 0.0 113.546 -170.708 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 12.9 tt -86.78 -42.22 15.35 Favored 'Isoleucine or valine' 0 C--N 1.376 1.757 0 C-N-CA 127.873 2.469 . . . . 0.0 115.931 -179.692 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 82.46 -165.42 44.55 Favored Glycine 0 C--N 1.362 2.003 0 O-C-N 121.279 -0.888 . . . . 0.0 114.161 -173.451 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 72.4 m -162.75 69.28 0.24 Allowed 'General case' 0 CA--C 1.507 -0.686 0 O-C-N 119.458 -2.201 . . . . 0.0 108.028 179.66 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 25.7 m -117.69 -85.33 0.64 Allowed 'General case' 0 N--CA 1.445 -0.688 0 CA-C-O 121.84 0.829 . . . . 0.0 112.815 -174.829 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 2.7 mmmp? -101.74 -64.81 1.02 Allowed 'General case' 0 CA--C 1.51 -0.593 0 N-CA-C 114.636 1.347 . . . . 0.0 114.636 -169.031 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.537 ' HG3' ' H ' ' A' ' 19' ' ' GLN . 14.8 tptp -143.96 -153.39 0.47 Allowed 'General case' 0 CA--C 1.504 -0.811 0 N-CA-C 104.37 -2.456 . . . . 0.0 104.37 -172.206 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . 0.537 ' H ' ' HG3' ' A' ' 18' ' ' LYS . 9.6 mm-40 -131.93 110.02 10.49 Favored 'General case' 0 N--CA 1.432 -1.328 0 N-CA-C 101.183 -3.636 . . . . 0.0 101.183 171.254 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 30.7 m-85 -106.83 138.45 42.98 Favored 'General case' 0 C--N 1.354 0.788 0 C-N-CA 125.794 1.638 . . . . 0.0 108.099 178.234 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' SER . . . . . 0.419 ' HA ' ' HG ' ' A' ' 36' ' ' LEU . 3.9 t -65.71 120.96 13.92 Favored 'General case' 0 C--N 1.371 1.513 0 N-CA-C 117.554 2.427 . . . . 0.0 117.554 -175.053 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -116.53 -168.24 1.42 Allowed 'General case' 0 C--N 1.37 1.487 0 C-N-CA 128.541 2.736 . . . . 0.0 111.232 177.171 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 23.6 m-85 -150.34 150.41 31.41 Favored 'General case' 0 C--N 1.355 0.835 0 C-N-CA 129.494 3.118 . . . . 0.0 108.191 174.258 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 8.9 p90 -145.14 166.14 26.28 Favored 'General case' 0 C--N 1.356 0.889 0 C-N-CA 126.325 1.85 . . . . 0.0 109.684 171.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 19.0 t80 -98.02 125.72 43.11 Favored 'General case' 0 C--N 1.36 1.045 0 O-C-N 120.026 -1.671 . . . . 0.0 108.814 176.655 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 26.7 ttpt -85.05 103.15 13.81 Favored 'General case' 0 C--N 1.379 1.862 0 O-C-N 120.152 -1.593 . . . . 0.0 108.57 173.92 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 26.1 t-105 -46.07 -43.52 14.67 Favored 'General case' 0 C--N 1.358 0.951 0 C-N-CA 129.904 3.282 . . . . 0.0 117.528 -176.917 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 4.0 p -82.36 -29.83 30.71 Favored 'General case' 0 C--N 1.35 0.59 0 C-N-CA 127.787 2.435 . . . . 0.0 113.885 179.727 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -82.63 -23.69 34.18 Favored 'General case' 0 C--N 1.37 1.494 0 CA-C-N 120.935 1.698 . . . . 0.0 113.853 176.608 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . 0.261 30.5 mmmt 73.23 23.01 2.7 Favored 'General case' 0 C--N 1.367 1.328 0 C-N-CA 126.929 2.092 . . . . 0.0 112.246 -176.842 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.931 ' HZ1' HH12 ' A' ' 54' ' ' ARG . 6.8 mmtm -146.21 164.6 31.77 Favored 'General case' 0 C--N 1.365 1.246 0 C-N-CA 125.655 1.582 . . . . 0.0 112.684 -177.06 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 68.5 m -89.9 141.28 28.8 Favored 'General case' 0 C--N 1.359 1.005 0 C-N-CA 127.501 2.32 . . . . 0.0 116.321 -173.863 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 39.3 mt -127.44 145.59 55.14 Favored Pre-proline 0 C--N 1.363 1.183 0 C-N-CA 125.034 1.334 . . . . 0.0 110.741 -179.083 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 62.2 Cg_endo -84.54 143.17 9.66 Favored 'Trans proline' 0 CA--C 1.536 0.606 0 C-N-CA 123.474 2.783 . . . . 0.0 111.07 167.138 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 1.6 p90 -142.35 159.83 41.45 Favored 'General case' 0 C--N 1.349 0.569 0 N-CA-C 101.098 -3.667 . . . . 0.0 101.098 170.964 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.419 ' HG ' ' HA ' ' A' ' 21' ' ' SER . 6.9 mp -104.82 158.5 16.48 Favored 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 125.655 1.582 . . . . 0.0 107.75 178.39 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 9.0 t80 -125.55 144.2 50.67 Favored 'General case' 0 CA--C 1.557 1.228 0 C-N-CA 127.55 2.34 . . . . 0.0 110.088 179.749 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.9 t -84.86 -19.64 32.06 Favored 'General case' 0 C--N 1.376 1.724 0 N-CA-C 117.834 2.531 . . . . 0.0 117.834 -179.722 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 119.3 -30.71 5.7 Favored Glycine 0 C--N 1.361 1.966 0 C-N-CA 126.265 1.888 . . . . 0.0 116.333 172.871 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -137.23 142.85 42.05 Favored 'General case' 0 C--N 1.345 0.405 0 N-CA-C 104.756 -2.313 . . . . 0.0 104.756 173.418 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 100.8 10.53 43.05 Favored Glycine 0 C--N 1.365 2.178 0 O-C-N 121.085 -1.01 . . . . 0.0 115.429 -174.341 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -105.82 -171.33 23.51 Favored Glycine 0 C--N 1.358 1.77 0 C-N-CA 124.888 1.232 . . . . 0.0 114.446 177.012 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . 0.491 ' H ' ' CZ ' ' A' ' 46' ' ' ARG 0.311 31.8 p30 -124.3 -106.53 0.34 Allowed 'General case' 0 C--N 1.363 1.168 0 N-CA-C 116.265 1.95 . . . . 0.0 116.265 178.782 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -152.92 6.79 0.39 Allowed 'General case' 0 C--N 1.352 0.711 0 O-C-N 121.256 -0.903 . . . . 0.0 112.686 -172.042 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 55.8 t30 -104.17 46.43 0.92 Allowed 'General case' 0 C--N 1.365 1.28 0 O-C-N 120.574 -1.328 . . . . 0.0 109.406 176.264 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.491 ' CZ ' ' H ' ' A' ' 43' ' ' ASN 0.365 0.0 OUTLIER -132.1 106.93 8.3 Favored 'General case' 0 C--N 1.358 0.971 0 CA-C-O 124.468 2.08 . . . . 0.0 107.508 -179.368 . . . . . . . . 4 4 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 13.0 m-30 -93.02 149.62 21.09 Favored 'General case' 0 C--N 1.346 0.427 0 C-N-CA 128.54 2.736 . . . . 0.0 111.762 -165.573 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 35.8 mt-30 -74.73 -41.55 59.93 Favored 'General case' 0 C--N 1.37 1.495 0 N-CA-C 116.746 2.128 . . . . 0.0 116.746 -172.289 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 48.9 p -136.84 179.02 6.63 Favored 'General case' 0 C--N 1.356 0.849 0 C-N-CA 128.584 2.754 . . . . 0.0 105.54 178.55 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 18.1 tt -75.56 -17.65 15.74 Favored 'Isoleucine or valine' 0 C--N 1.37 1.463 0 O-C-N 120.42 -1.425 . . . . 0.0 113.452 175.596 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -77.25 -18.18 78.56 Favored Glycine 0 C--N 1.366 2.225 0 C-N-CA 125.704 1.621 . . . . 0.0 116.166 175.781 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -83.27 -2.17 54.98 Favored 'General case' 0 C--N 1.365 1.28 0 C-N-CA 126.371 1.868 . . . . 0.0 112.109 177.388 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 4.7 t -94.94 -24.34 17.01 Favored 'General case' 0 C--N 1.356 0.88 0 C-N-CA 128.715 2.806 . . . . 0.0 114.449 179.87 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.931 HH12 ' HZ1' ' A' ' 31' ' ' LYS . 0.0 OUTLIER -84.78 -37.91 20.24 Favored 'General case' 0 C--O 1.237 0.419 1 C-N-CA 132.393 4.277 . . . . 0.0 109.398 179.034 . . . . . . . . 4 4 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 28.0 ttmt -71.71 -28.03 63.42 Favored 'General case' 0 C--N 1.351 0.654 0 C-N-CA 129.303 3.041 . . . . 0.0 113.871 -178.285 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.505 ' HD2' ' CD2' ' A' ' 6' ' ' TYR . 27.2 mtmt -101.08 -39.18 7.82 Favored 'General case' 0 C--N 1.358 0.941 0 C-N-CA 125.094 1.358 . . . . 0.0 112.592 178.098 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 99.2 m -126.49 17.22 7.59 Favored 'General case' 0 C--N 1.358 0.951 0 N-CA-C 116.98 2.215 . . . . 0.0 116.98 -170.13 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 22.5 mt -137.15 -23.05 1.15 Allowed 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 122.518 2.417 . . . . 0.0 112.682 168.666 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 86.78 48.74 4.34 Favored Glycine 0 C--N 1.367 2.268 0 C-N-CA 127.134 2.302 . . . . 0.0 111.524 -175.655 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 13.9 ptmt . . . . . 0 C--O 1.261 1.666 0 CA-C-O 118.572 -0.727 . . . . 0.0 110.544 -173.26 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 11.9 t90 . . . . . 0 N--CA 1.434 -1.239 0 CA-C-O 122.748 1.261 . . . . 0.0 109.294 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -135.75 148.91 67.32 Favored Pre-proline 0 C--N 1.351 0.659 1 N-CA-C 100.148 -4.019 . . . . 0.0 100.148 172.737 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 1.4 Cg_endo -77.35 125.38 7.7 Favored 'Trans proline' 0 CA--C 1.554 1.495 0 CA-C-N 124.807 2.753 . . . . 0.0 115.222 -169.026 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . 0.422 ' HG2' ' CD2' ' A' ' 6' ' ' TYR . 38.3 Cg_endo -96.29 -116.09 0.0 OUTLIER 'Trans proline' 0 CA--C 1.549 1.239 1 C-N-CA 126.549 4.833 . . . . 0.0 110.855 -176.473 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . 0.471 ' CE3' ' CD1' ' A' ' 6' ' ' TYR 0.274 35.5 p-90 -85.67 -67.59 0.79 Allowed 'General case' 0 C--N 1.38 1.908 0 C-N-CA 126.496 1.918 . . . . 0.0 115.093 178.395 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.485 ' CD1' ' HD2' ' A' ' 56' ' ' LYS . 0.1 OUTLIER -32.71 -53.06 0.33 Allowed 'General case' 0 N--CA 1.48 1.071 1 C-N-CA 132.277 4.231 . . . . 0.0 119.162 -172.353 . . . . . . . . 4 4 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.7 m -60.51 -38.16 83.46 Favored 'General case' 0 N--CA 1.449 -0.514 0 C-N-CA 128.733 2.813 . . . . 0.0 113.277 -179.488 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 39.8 mtpt -104.16 14.01 31.26 Favored 'General case' 0 C--N 1.363 1.17 0 C-N-CA 129.08 2.952 . . . . 0.0 110.579 -177.71 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -96.67 127.79 38.28 Favored Pre-proline 0 C--N 1.364 1.217 0 O-C-N 119.853 -1.779 . . . . 0.0 112.015 -172.273 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -68.16 120.85 7.81 Favored 'Trans proline' 0 C--N 1.358 1.056 0 C-N-CA 124.167 3.245 . . . . 0.0 115.093 -165.881 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 8.1 p -67.85 133.85 31.03 Favored 'Isoleucine or valine' 0 C--N 1.36 1.057 0 C-N-CA 126.568 1.947 . . . . 0.0 113.934 -179.585 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . 0.287 16.5 mmt-85 -134.49 117.9 16.74 Favored 'General case' 0 C--N 1.36 1.04 0 C-N-CA 126.611 1.964 . . . . 0.0 108.494 -171.772 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 21.1 tt -93.18 -40.25 11.74 Favored 'Isoleucine or valine' 0 C--N 1.369 1.443 0 CA-C-N 120.399 1.454 . . . . 0.0 109.453 173.387 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 98.17 -67.47 0.73 Allowed Glycine 0 C--N 1.36 1.895 0 C-N-CA 124.67 1.129 . . . . 0.0 114.533 175.942 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . 0.322 89.9 p 87.91 28.91 0.03 OUTLIER 'General case' 0 C--N 1.362 1.143 0 C-N-CA 129.303 3.041 . . . . 0.0 110.524 -172.083 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 6.6 t -70.16 -89.95 0.02 OUTLIER 'General case' 0 C--N 1.364 1.221 0 N-CA-C 116.345 1.98 . . . . 0.0 116.345 -176.998 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 63.2 mmtt -88.89 -62.02 1.58 Allowed 'General case' 0 C--N 1.355 0.843 0 C-N-CA 125.074 1.349 . . . . 0.0 113.408 -178.02 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . 0.264 0.0 OUTLIER -148.0 -136.5 0.08 Allowed 'General case' 0 C--N 1.349 0.556 0 N-CA-C 104.472 -2.418 . . . . 0.0 104.472 175.391 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -150.11 123.48 9.0 Favored 'General case' 0 C--N 1.351 0.665 0 N-CA-C 103.643 -2.725 . . . . 0.0 103.643 175.314 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 19.6 m-85 -105.84 158.08 17.01 Favored 'General case' 0 C--N 1.36 1.024 0 C-N-CA 126.46 1.904 . . . . 0.0 106.14 177.662 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 2.6 t -82.31 144.59 30.49 Favored 'General case' 0 C--N 1.367 1.331 0 CA-C-N 122.111 2.232 . . . . 0.0 115.964 -176.247 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 61.1 p -146.77 -170.91 3.64 Favored 'General case' 0 C--N 1.364 1.197 0 C-N-CA 127.767 2.427 . . . . 0.0 112.671 -177.471 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 45.1 m-85 -141.05 152.76 45.1 Favored 'General case' 0 C--N 1.358 0.958 0 C-N-CA 129.984 3.313 . . . . 0.0 109.921 171.384 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . 0.303 2.9 p90 -144.68 158.97 43.56 Favored 'General case' 0 C--N 1.365 1.275 0 C-N-CA 126.999 2.12 . . . . 0.0 110.035 172.832 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 12.6 t80 -104.17 130.31 51.93 Favored 'General case' 0 C--N 1.365 1.263 0 N-CA-C 106.931 -1.507 . . . . 0.0 106.931 179.018 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.521 ' NZ ' ' H ' ' A' ' 28' ' ' THR . 0.0 OUTLIER -96.27 112.57 24.27 Favored 'General case' 0 N--CA 1.446 -0.671 0 C-N-CA 125.099 1.36 . . . . 0.0 110.047 179.222 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . 0.475 ' N ' ' HZ3' ' A' ' 26' ' ' LYS . 38.2 t-105 -50.47 -48.57 56.62 Favored 'General case' 0 C--N 1.355 0.819 0 C-N-CA 129.553 3.141 . . . . 0.0 116.494 175.007 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' THR . . . . . 0.521 ' H ' ' NZ ' ' A' ' 26' ' ' LYS 0.294 39.7 p -82.3 -25.7 33.73 Favored 'General case' 0 C--N 1.36 1.052 0 C-N-CA 124.471 1.109 . . . . 0.0 112.792 178.362 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -78.1 -38.9 43.01 Favored 'General case' 0 C--N 1.378 1.813 0 CA-C-N 120.779 1.627 . . . . 0.0 114.072 172.799 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . 0.301 52.5 mmtt 78.45 21.36 0.8 Allowed 'General case' 0 C--N 1.369 1.418 0 C-N-CA 128.107 2.563 . . . . 0.0 113.547 179.742 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 63.1 tttt -147.6 168.41 22.07 Favored 'General case' 0 C--N 1.355 0.835 0 C-N-CA 126.578 1.951 . . . . 0.0 106.509 -179.931 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 79.1 m -81.21 146.05 30.67 Favored 'General case' 0 C--N 1.358 0.942 0 C-N-CA 126.961 2.104 . . . . 0.0 115.745 179.894 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 12.8 mt -122.83 142.97 39.15 Favored Pre-proline 0 C--N 1.358 0.941 0 C-N-CA 125.75 1.62 . . . . 0.0 109.828 177.086 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 63.7 Cg_endo -85.6 147.32 9.68 Favored 'Trans proline' 0 C--N 1.35 0.645 0 C-N-CA 124.403 3.402 . . . . 0.0 111.077 169.181 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . 0.386 3.4 p90 -145.42 -157.73 0.82 Allowed 'General case' 0 C--N 1.352 0.695 0 CA-C-N 114.95 -1.023 . . . . 0.0 109.41 174.749 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 40.2 mt -140.31 153.85 46.6 Favored 'General case' 0 N--CA 1.436 -1.134 0 C-N-CA 128.31 2.644 . . . . 0.0 104.153 -178.598 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -137.98 127.17 24.42 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 127.817 2.447 . . . . 0.0 108.465 -178.169 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 96.7 p -83.71 4.51 28.42 Favored 'General case' 0 C--N 1.368 1.371 0 N-CA-C 119.714 3.227 . . . . 0.0 119.714 -176.247 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 88.2 -31.25 4.83 Favored Glycine 0 C--N 1.355 1.615 0 C-N-CA 129.252 3.31 . . . . 0.0 120.103 172.58 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -136.22 31.78 2.9 Favored 'General case' 0 CA--C 1.509 -0.597 0 O-C-N 121.441 -1.035 . . . . 0.0 109.931 -175.681 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -150.36 36.91 0.93 Allowed Glycine 0 C--N 1.355 1.599 0 N-CA-C 110.457 -1.057 . . . . 0.0 110.457 176.186 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -101.3 -177.42 28.84 Favored Glycine 0 C--N 1.357 1.739 0 C-N-CA 125.455 1.502 . . . . 0.0 113.99 174.72 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . 0.476 ' H ' ' NH1' ' A' ' 46' ' ' ARG 0.381 42.0 p30 -125.01 -96.0 0.45 Allowed 'General case' 0 C--N 1.356 0.891 0 O-C-N 120.945 -1.327 . . . . 0.0 111.225 174.322 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -145.3 -16.56 0.49 Allowed 'General case' 0 C--N 1.348 0.541 0 C-N-CA 125.205 1.402 . . . . 0.0 112.274 -174.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 50.6 t30 -94.11 74.1 4.05 Favored 'General case' 0 C--N 1.363 1.168 0 O-C-N 120.165 -1.584 . . . . 0.0 111.738 -177.939 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.476 ' NH1' ' H ' ' A' ' 43' ' ' ASN 0.295 0.0 OUTLIER -137.27 130.55 31.03 Favored 'General case' 0 C--N 1.352 0.674 0 CA-C-O 124.271 1.986 . . . . 0.0 108.868 173.638 . . . . . . . . 4 4 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . 0.458 ' CD2' ' HA ' ' A' ' 53' ' ' CYS . 21.7 m-85 -111.31 141.94 44.18 Favored 'General case' 0 CA--C 1.507 -0.685 0 C-N-CA 127.914 2.486 . . . . 0.0 108.598 -174.763 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 31.0 mt-30 -67.35 -64.63 0.82 Allowed 'General case' 0 C--N 1.363 1.167 0 C-N-CA 127.097 2.159 . . . . 0.0 114.609 -175.572 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 31.4 p -121.47 171.9 8.46 Favored 'General case' 0 C--N 1.353 0.743 0 C-N-CA 126.492 1.917 . . . . 0.0 107.499 177.791 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 17.7 tt -59.36 -25.71 31.73 Favored 'Isoleucine or valine' 0 C--N 1.363 1.174 0 C-N-CA 127.802 2.441 . . . . 0.0 117.227 178.78 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -88.48 -17.32 57.25 Favored Glycine 0 C--N 1.353 1.503 0 N-CA-C 116.669 1.427 . . . . 0.0 116.669 174.301 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 15.8 tp10 -70.05 -34.62 73.45 Favored 'General case' 0 C--N 1.378 1.835 0 CA-C-N 120.015 1.908 . . . . 0.0 112.016 174.547 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . 0.458 ' HA ' ' CD2' ' A' ' 47' ' ' PHE . 48.7 t -47.92 -44.17 29.67 Favored 'General case' 0 C--N 1.361 1.108 0 C-N-CA 128.575 2.75 . . . . 0.0 116.024 175.444 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 8.4 mtp85 -74.34 -26.67 60.29 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 130.964 3.705 . . . . 0.0 117.385 -179.174 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 12.5 mttp -80.34 -11.72 59.67 Favored 'General case' 0 C--N 1.364 1.225 0 C-N-CA 125.572 1.549 . . . . 0.0 114.815 -179.634 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.485 ' HD2' ' CD1' ' A' ' 6' ' ' TYR . 9.9 mtmm -103.52 -28.69 11.6 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 126.664 1.986 . . . . 0.0 109.38 175.001 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 53.6 m -125.86 6.68 7.36 Favored 'General case' 0 C--N 1.365 1.265 0 N-CA-C 119.551 3.167 . . . . 0.0 119.551 -170.502 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 16.3 mt -134.54 -15.39 2.14 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 123.435 2.834 . . . . 0.0 113.334 174.826 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 77.49 57.47 3.59 Favored Glycine 0 C--N 1.361 1.931 0 C-N-CA 128.238 2.828 . . . . 0.0 113.02 -171.443 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 16.0 ptpt . . . . . 0 C--O 1.259 1.604 0 N-CA-C 107.889 -1.152 . . . . 0.0 107.889 -176.197 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' TRP . . . . . 0.513 ' CZ2' ' HB3' ' A' ' 3' ' ' PRO . 81.0 t90 . . . . . 0 N--CA 1.434 -1.263 0 N-CA-C 107.099 -1.445 . . . . 0.0 107.099 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 81.2 mt-30 -149.38 149.0 28.02 Favored Pre-proline 0 C--N 1.355 0.829 1 N-CA-C 97.549 -4.982 . . . . 0.0 97.549 174.22 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.513 ' HB3' ' CZ2' ' A' ' 1' ' ' TRP . 60.5 Cg_endo -86.95 118.84 1.48 Allowed 'Trans proline' 0 CA--C 1.557 1.635 0 CA-C-N 125.045 2.838 . . . . 0.0 115.845 -162.997 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 30.0 Cg_exo -76.09 -110.53 0.01 OUTLIER 'Trans proline' 0 C--N 1.362 1.287 1 C-N-CA 126.552 4.834 . . . . 0.0 114.658 178.942 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . 0.487 ' CE3' ' CD2' ' A' ' 6' ' ' TYR 0.316 36.5 p-90 -88.46 -70.47 0.64 Allowed 'General case' 0 C--N 1.379 1.854 0 C-N-CA 126.671 1.988 . . . . 0.0 116.334 -178.695 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.509 ' CD2' ' HD2' ' A' ' 56' ' ' LYS . 0.0 OUTLIER -32.06 -55.76 0.31 Allowed 'General case' 0 C--N 1.36 1.042 1 C-N-CA 135.74 5.616 . . . . 0.0 118.07 -173.338 . . . . . . . . 4 4 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -55.13 -39.78 69.8 Favored 'General case' 0 N--CA 1.444 -0.769 0 C-N-CA 130.287 3.435 . . . . 0.0 114.553 -179.8 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 10.1 mtpp -105.12 13.5 30.65 Favored 'General case' 0 C--N 1.356 0.867 0 C-N-CA 127.559 2.344 . . . . 0.0 110.56 -178.074 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -93.46 132.84 29.35 Favored Pre-proline 0 C--N 1.368 1.385 0 O-C-N 120.012 -1.68 . . . . 0.0 112.458 -171.884 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_exo -66.46 122.71 10.2 Favored 'Trans proline' 0 C--N 1.359 1.091 0 C-N-CA 124.054 3.17 . . . . 0.0 116.88 -165.957 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 8.4 p -72.52 132.53 33.27 Favored 'Isoleucine or valine' 0 C--N 1.36 1.026 0 C-N-CA 125.882 1.673 . . . . 0.0 111.743 175.924 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . 0.251 1.6 mmp_? -146.41 124.43 12.07 Favored 'General case' 0 C--N 1.353 0.751 0 CA-C-O 115.063 -2.399 . . . . 0.0 112.956 -168.822 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.278 6.5 tt -88.44 -35.16 7.63 Favored 'Isoleucine or valine' 0 C--N 1.384 2.097 0 CA-C-N 124.922 3.51 . . . . 0.0 115.179 177.64 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 96.47 -68.4 0.93 Allowed Glycine 0 C--N 1.358 1.764 0 N-CA-C 117.388 1.715 . . . . 0.0 117.388 175.081 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 21.6 m 77.22 70.7 0.06 Allowed 'General case' 0 C--N 1.366 1.313 0 C-N-CA 125.822 1.649 . . . . 0.0 110.649 -171.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 3.0 t -128.72 -72.61 0.6 Allowed 'General case' 0 CA--C 1.506 -0.717 0 CA-C-O 121.687 0.756 . . . . 0.0 111.143 -176.438 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 12.5 mmmm -97.49 -76.29 0.52 Allowed 'General case' 0 C--N 1.349 0.586 0 C-N-CA 125.869 1.668 . . . . 0.0 113.827 -172.464 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.552 ' HG3' ' H ' ' A' ' 19' ' ' GLN . 20.5 tptp -146.71 -152.56 0.44 Allowed 'General case' 0 CA--C 1.509 -0.596 0 N-CA-C 102.025 -3.324 . . . . 0.0 102.025 -176.657 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . 0.552 ' H ' ' HG3' ' A' ' 18' ' ' LYS . 23.4 mp0 -133.75 113.23 12.08 Favored 'General case' 0 N--CA 1.438 -1.068 0 N-CA-C 101.983 -3.34 . . . . 0.0 101.983 170.979 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 33.1 m-85 -107.18 141.66 38.11 Favored 'General case' 0 C--N 1.355 0.845 0 O-C-N 120.484 -1.385 . . . . 0.0 107.921 179.65 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.7 t -66.39 122.65 18.01 Favored 'General case' 0 C--N 1.372 1.573 0 N-CA-C 117.695 2.48 . . . . 0.0 117.695 -176.619 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.403 ' HG ' ' N ' ' A' ' 23' ' ' PHE . 1.2 t -120.73 -175.68 3.08 Favored 'General case' 0 C--N 1.363 1.159 0 C-N-CA 129.157 2.983 . . . . 0.0 109.175 -178.881 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . 0.403 ' N ' ' HG ' ' A' ' 22' ' ' SER . 37.0 m-85 -146.12 141.62 27.71 Favored 'General case' 0 C--N 1.349 0.56 0 C-N-CA 129.854 3.262 . . . . 0.0 104.312 170.716 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 16.0 p90 -124.57 148.87 47.56 Favored 'General case' 0 C--N 1.358 0.967 0 N-CA-C 107.499 -1.297 . . . . 0.0 107.499 172.102 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 10.4 t80 -94.76 126.11 39.86 Favored 'General case' 0 C--N 1.363 1.189 0 N-CA-C 104.129 -2.545 . . . . 0.0 104.129 175.639 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -100.0 113.32 25.82 Favored 'General case' 0 N--CA 1.425 -1.682 0 C-N-CA 125.569 1.548 . . . . 0.0 108.85 -175.232 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 45.8 t-105 -53.54 -46.96 70.38 Favored 'General case' 0 C--N 1.361 1.097 0 C-N-CA 129.544 3.138 . . . . 0.0 117.457 -177.922 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 11.0 p -83.49 -5.54 59.19 Favored 'General case' 0 C--N 1.353 0.749 0 C-N-CA 124.542 1.137 . . . . 0.0 113.604 179.456 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -97.06 -47.93 5.59 Favored 'General case' 0 C--N 1.363 1.188 0 C-N-CA 124.819 1.247 . . . . 0.0 111.868 174.993 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . 0.294 0.7 OUTLIER 83.45 26.38 0.11 Allowed 'General case' 0 C--N 1.366 1.287 0 C-N-CA 127.672 2.389 . . . . 0.0 112.489 -178.333 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.455 ' HZ1' ' HB2' ' A' ' 32' ' ' CYS . 7.8 tmtm? -147.78 164.22 34.3 Favored 'General case' 0 C--N 1.356 0.868 0 C-N-CA 128.008 2.523 . . . . 0.0 107.344 179.197 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.455 ' HB2' ' HZ1' ' A' ' 31' ' ' LYS . 64.6 m -81.98 118.81 23.27 Favored 'General case' 0 C--N 1.363 1.195 0 C-N-CA 129.739 3.216 . . . . 0.0 114.606 178.831 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 29.6 mt -105.26 145.73 31.35 Favored Pre-proline 0 C--N 1.354 0.8 0 O-C-N 119.83 -1.794 . . . . 0.0 111.203 177.924 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 69.2 Cg_endo -86.92 144.28 7.24 Favored 'Trans proline' 0 N--CA 1.46 -0.452 0 C-N-CA 123.129 2.552 . . . . 0.0 112.245 173.481 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -149.03 171.16 16.83 Favored 'General case' 0 N--CA 1.444 -0.755 0 N-CA-C 101.338 -3.579 . . . . 0.0 101.338 170.255 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 8.4 mp -111.72 156.23 22.23 Favored 'General case' 0 N--CA 1.449 -0.519 0 C-N-CA 125.967 1.707 . . . . 0.0 106.882 178.398 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 8.3 t80 -116.95 139.69 50.35 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 127.137 2.175 . . . . 0.0 112.157 -179.104 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.3 t -92.76 -4.97 52.18 Favored 'General case' 0 C--N 1.377 1.786 0 N-CA-C 117.401 2.371 . . . . 0.0 117.401 178.291 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 106.21 -44.04 1.56 Allowed Glycine 0 C--N 1.366 2.197 0 CA-C-N 120.908 1.686 . . . . 0.0 116.541 170.856 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -133.69 139.37 46.38 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 103.634 -2.728 . . . . 0.0 103.634 177.322 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 103.09 -12.2 55.69 Favored Glycine 0 C--N 1.358 1.775 0 O-C-N 121.329 -0.857 . . . . 0.0 113.606 -173.75 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -102.93 177.24 25.27 Favored Glycine 0 C--N 1.361 1.922 0 C-N-CA 127.707 2.575 . . . . 0.0 112.622 177.052 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 15.1 p30 -119.72 -100.13 0.44 Allowed 'General case' 0 C--N 1.365 1.269 0 N-CA-C 115.446 1.647 . . . . 0.0 115.446 179.241 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -158.75 17.87 0.2 Allowed 'General case' 0 C--N 1.363 1.19 0 N-CA-C 114.981 1.475 . . . . 0.0 114.981 -172.155 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 36.6 t30 -106.69 55.64 0.66 Allowed 'General case' 0 C--N 1.366 1.315 0 N-CA-C 104.401 -2.444 . . . . 0.0 104.401 172.47 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 7.0 ptp180 -144.07 105.31 4.24 Favored 'General case' 0 CA--C 1.5 -0.95 0 CA-C-O 124.721 2.201 . . . . 0.0 106.442 -172.08 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 18.4 m-85 -107.14 133.53 51.61 Favored 'General case' 0 N--CA 1.434 -1.241 0 CA-C-N 111.87 -2.423 . . . . 0.0 109.04 -169.849 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 30.9 mt-30 -55.23 -40.0 70.37 Favored 'General case' 0 C--N 1.355 0.845 0 C-N-CA 130.221 3.409 . . . . 0.0 116.605 -177.223 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 81.9 p -136.3 174.08 11.01 Favored 'General case' 0 C--N 1.356 0.862 0 C-N-CA 127.551 2.341 . . . . 0.0 107.656 178.163 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 18.6 tt -68.32 -13.04 16.52 Favored 'Isoleucine or valine' 0 C--N 1.36 1.049 0 C-N-CA 129.36 3.064 . . . . 0.0 116.883 177.58 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -99.61 -25.27 9.36 Favored Glycine 0 C--N 1.353 1.501 0 N-CA-C 116.72 1.448 . . . . 0.0 116.72 176.646 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -68.79 -21.77 64.31 Favored 'General case' 0 N--CA 1.491 1.611 0 CA-C-N 120.254 2.027 . . . . 0.0 113.188 176.509 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 22.7 t -70.84 -23.7 62.38 Favored 'General case' 0 CA--C 1.557 1.222 0 C-N-CA 129.105 2.962 . . . . 0.0 113.593 173.659 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 47.3 mtm180 -86.07 -30.79 22.32 Favored 'General case' 0 C--N 1.354 0.8 0 N-CA-C 116.719 2.118 . . . . 0.0 116.719 -175.102 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 84.1 tttt -77.29 -10.12 59.24 Favored 'General case' 0 C--N 1.369 1.439 0 C-N-CA 126.397 1.879 . . . . 0.0 113.6 -177.509 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.509 ' HD2' ' CD2' ' A' ' 6' ' ' TYR . 31.6 mtmt -102.06 -30.38 11.21 Favored 'General case' 0 N--CA 1.442 -0.856 0 C-N-CA 126.648 1.979 . . . . 0.0 114.132 -178.878 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . 0.419 ' SG ' ' HB2' ' A' ' 6' ' ' TYR . 47.3 m -139.4 25.46 2.43 Favored 'General case' 0 C--N 1.36 1.031 0 O-C-N 120.652 -1.28 . . . . 0.0 114.275 -166.644 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 18.3 mt -145.98 -27.62 0.43 Allowed 'General case' 0 C--N 1.345 0.405 0 O-C-N 120.625 -1.297 . . . . 0.0 111.735 174.436 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 86.61 57.58 2.06 Favored Glycine 0 C--N 1.364 2.094 0 C-N-CA 126.739 2.114 . . . . 0.0 112.706 -173.169 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 15.6 ptmt . . . . . 0 C--O 1.262 1.754 0 N-CA-C 106.433 -1.691 . . . . 0.0 106.433 -176.274 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 84.8 t90 . . . . . 0 N--CA 1.436 -1.166 0 CA-C-O 122.141 0.972 . . . . 0.0 108.496 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 18.6 mm-40 -143.92 149.73 47.08 Favored Pre-proline 0 N--CA 1.442 -0.844 1 N-CA-C 98.596 -4.594 . . . . 0.0 98.596 170.486 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 23.7 Cg_endo -71.88 123.27 9.2 Favored 'Trans proline' 0 CA--C 1.559 1.761 0 C-N-CA 123.655 2.903 . . . . 0.0 114.747 -170.092 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 4' ' ' PRO . . . . . 0.528 ' HG2' ' CD2' ' A' ' 6' ' ' TYR . 43.7 Cg_endo -92.07 -113.93 0.0 OUTLIER 'Trans proline' 0 CA--C 1.543 0.931 1 C-N-CA 127.263 5.309 . . . . 0.0 110.196 -178.006 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 5' ' ' TRP . . . . . 0.443 ' CE3' ' CD1' ' A' ' 6' ' ' TYR . 4.6 p-90 -85.55 -70.46 0.59 Allowed 'General case' 0 C--N 1.38 1.911 0 C-N-CA 126.817 2.047 . . . . 0.0 114.48 177.029 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.528 ' CD2' ' HG2' ' A' ' 4' ' ' PRO . 0.1 OUTLIER -31.18 -52.27 0.19 Allowed 'General case' 0 C--N 1.365 1.24 1 C-N-CA 132.992 4.517 . . . . 0.0 118.411 -170.811 . . . . . . . . 4 4 . 1 . 001 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 2.3 m -58.75 -40.31 83.49 Favored 'General case' 0 C--N 1.35 0.613 0 C-N-CA 127.567 2.347 . . . . 0.0 114.633 -177.334 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 27.8 mtpp -98.24 15.21 25.17 Favored 'General case' 0 C--N 1.359 0.993 0 C-N-CA 125.9 1.68 . . . . 0.0 111.533 177.616 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 16.9 tt0 -92.27 125.42 56.45 Favored Pre-proline 0 C--N 1.364 1.199 0 O-C-N 119.176 -2.202 . . . . 0.0 110.735 -173.518 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_exo -62.21 145.36 96.22 Favored 'Trans proline' 0 CA--C 1.547 1.126 0 C-N-CA 124.28 3.32 . . . . 0.0 117.508 -169.525 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 7.8 p -79.74 130.88 35.37 Favored 'Isoleucine or valine' 0 C--N 1.369 1.417 0 C-N-CA 123.48 0.712 . . . . 0.0 110.673 174.086 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 22.8 mmt85 -128.91 133.4 47.87 Favored 'General case' 0 C--N 1.35 0.617 0 N-CA-C 104.736 -2.32 . . . . 0.0 104.736 -173.543 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.315 19.4 tt -99.02 -45.04 12.18 Favored 'Isoleucine or valine' 0 C--N 1.369 1.414 0 CA-C-N 122.769 2.531 . . . . 0.0 111.355 175.577 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.358 1.761 0 C-N-CA 124.438 1.018 . . . . 0.0 111.348 -170.353 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 25.6 tttp . . . . . 0 N--CA 1.447 -0.589 0 N-CA-C 103.381 -2.822 . . . . 0.0 103.381 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -126.19 134.08 51.36 Favored 'General case' 0 C--N 1.357 0.917 0 CA-C-N 121.746 2.066 . . . . 0.0 107.766 178.386 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 25.8 m-85 -107.29 146.03 32.01 Favored 'General case' 0 C--N 1.356 0.851 0 C-N-CA 128.094 2.558 . . . . 0.0 109.215 177.093 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.8 t -70.4 136.73 49.85 Favored 'General case' 0 C--N 1.371 1.532 0 N-CA-C 117.902 2.556 . . . . 0.0 117.902 -175.717 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 33.9 p -145.63 161.36 40.01 Favored 'General case' 0 C--N 1.359 1.009 0 C-N-CA 124.79 1.236 . . . . 0.0 113.787 -176.577 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' PHE . . . . . 0.408 ' HB2' ' HB2' ' A' ' 47' ' ' PHE . 94.3 m-85 -132.49 134.65 45.29 Favored 'General case' 0 C--N 1.343 0.303 0 C-N-CA 126.121 1.768 . . . . 0.0 107.479 177.048 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 29.2 p90 -114.95 144.18 43.99 Favored 'General case' 0 C--N 1.366 1.294 0 N-CA-C 106.772 -1.566 . . . . 0.0 106.772 175.725 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' PHE . . . . . 0.451 ' HA ' ' HA ' ' A' ' 32' ' ' CYS . 11.9 t80 -89.55 119.12 29.7 Favored 'General case' 0 C--N 1.374 1.646 0 CA-C-N 122.274 2.306 . . . . 0.0 105.692 -179.467 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.542 ' NZ ' ' H ' ' A' ' 28' ' ' THR . 0.5 OUTLIER -89.03 116.41 27.29 Favored 'General case' 0 N--CA 1.429 -1.5 0 C-N-CA 125.303 1.441 . . . . 0.0 109.577 -176.71 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -64.99 -39.63 93.75 Favored 'General case' 0 C--N 1.343 0.317 0 N-CA-C 118.332 2.716 . . . . 0.0 118.332 -172.84 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.542 ' H ' ' NZ ' ' A' ' 26' ' ' LYS . 17.4 p -89.89 -2.86 58.28 Favored 'General case' 0 C--N 1.359 0.98 0 O-C-N 120.523 -1.36 . . . . 0.0 111.496 176.498 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -96.64 -46.88 6.14 Favored 'General case' 0 C--N 1.364 1.22 0 C-N-CA 125.196 1.398 . . . . 0.0 114.183 175.997 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . 0.296 18.8 tptt 89.3 19.42 0.04 OUTLIER 'General case' 0 C--N 1.368 1.385 0 C-N-CA 126.778 2.031 . . . . 0.0 113.333 -178.242 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 8.1 ptpp? -147.86 169.4 19.9 Favored 'General case' 0 C--N 1.352 0.698 0 C-N-CA 126.486 1.914 . . . . 0.0 108.237 176.728 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.451 ' HA ' ' HA ' ' A' ' 25' ' ' PHE . 74.0 m -90.86 141.33 28.93 Favored 'General case' 0 C--N 1.367 1.357 0 O-C-N 120.513 -1.367 . . . . 0.0 111.668 175.941 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.2 mt -110.93 146.03 33.63 Favored Pre-proline 0 C--N 1.347 0.48 0 N-CA-C 107.77 -1.196 . . . . 0.0 107.77 178.913 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 69.3 Cg_endo -86.58 149.52 8.76 Favored 'Trans proline' 0 N--CA 1.458 -0.606 0 C-N-CA 123.882 3.055 . . . . 0.0 112.797 -179.758 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 5.9 p90 -146.0 -161.52 1.33 Allowed 'General case' 0 N--CA 1.444 -0.774 0 N-CA-C 104.462 -2.422 . . . . 0.0 104.462 171.713 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 84.9 mt -141.96 148.23 38.27 Favored 'General case' 0 N--CA 1.433 -1.321 0 N-CA-C 101.048 -3.686 . . . . 0.0 101.048 173.815 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.412 ' CZ ' ' HA2' ' A' ' 39' ' ' GLY . 2.9 t80 -109.77 138.09 46.63 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 127.497 2.319 . . . . 0.0 106.44 176.925 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 51.8 m -78.62 -43.05 27.26 Favored 'General case' 0 C--N 1.373 1.601 0 CA-C-O 122.935 1.35 . . . . 0.0 111.899 178.615 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' GLY . . . . . 0.412 ' HA2' ' CZ ' ' A' ' 37' ' ' PHE . . . 125.12 -51.8 0.82 Allowed Glycine 0 C--N 1.349 1.265 0 C-N-CA 125.953 1.74 . . . . 0.0 109.772 -175.43 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 8.0 m -80.27 65.61 5.49 Favored 'General case' 0 C--N 1.357 0.903 0 N-CA-C 116.758 2.133 . . . . 0.0 116.758 -175.156 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 128.82 57.79 0.11 Allowed Glycine 0 C--N 1.37 2.425 0 N-CA-C 118.812 2.285 . . . . 0.0 118.812 173.325 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -103.2 -159.87 25.26 Favored Glycine 0 C--N 1.37 2.434 0 CA-C-N 119.992 1.896 . . . . 0.0 114.423 174.585 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' ASN . . . . . 0.568 ' H ' ' NH1' ' A' ' 46' ' ' ARG 0.304 46.9 p30 -136.93 -106.6 0.2 Allowed 'General case' 0 C--N 1.356 0.854 0 O-C-N 121.303 -1.116 . . . . 0.0 111.351 -179.809 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -167.75 29.32 0.03 OUTLIER 'General case' 0 C--N 1.355 0.805 0 C-N-CA 124.49 1.116 . . . . 0.0 111.888 -177.734 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 51.9 t-20 -105.94 34.26 3.4 Favored 'General case' 0 C--N 1.37 1.482 0 N-CA-C 105.442 -2.058 . . . . 0.0 105.442 173.523 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.568 ' NH1' ' H ' ' A' ' 43' ' ' ASN . 0.8 OUTLIER -121.91 110.6 16.06 Favored 'General case' 0 C--N 1.358 0.949 0 CA-C-O 125.172 2.415 . . . . 0.0 111.272 -172.554 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 47' ' ' PHE . . . . . 0.41 ' CE1' ' HE3' ' A' ' 56' ' ' LYS . 84.6 m-85 -92.59 127.23 38.01 Favored 'General case' 0 N--CA 1.445 -0.71 0 C-N-CA 129.569 3.148 . . . . 0.0 106.622 179.729 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.92 -17.35 59.79 Favored 'General case' 0 C--N 1.37 1.49 0 N-CA-C 117.025 2.232 . . . . 0.0 117.025 -173.982 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 31.2 p -142.74 171.49 13.98 Favored 'General case' 0 C--N 1.357 0.917 0 N-CA-C 102.649 -3.093 . . . . 0.0 102.649 175.989 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 6.7 tt -85.67 7.43 2.09 Favored 'Isoleucine or valine' 0 C--N 1.363 1.163 0 O-C-N 119.648 -1.907 . . . . 0.0 113.407 176.297 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -97.75 -13.82 42.46 Favored Glycine 0 C--N 1.362 2.012 0 O-C-N 119.596 -1.94 . . . . 0.0 113.498 178.024 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -85.87 -29.8 23.41 Favored 'General case' 0 C--N 1.359 0.99 0 C-N-CA 126.533 1.933 . . . . 0.0 110.114 175.363 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 6.8 t -37.75 -58.4 0.91 Allowed 'General case' 0 C--N 1.372 1.584 1 C-N-CA 133.302 4.641 . . . . 0.0 116.362 179.654 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.69 -12.11 60.9 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 130.399 3.479 . . . . 0.0 116.836 -178.778 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -86.26 -12.04 50.69 Favored 'General case' 0 C--N 1.368 1.392 0 O-C-N 119.8 -1.813 . . . . 0.0 114.458 -176.863 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.41 ' HE3' ' CE1' ' A' ' 47' ' ' PHE . 18.7 mtmt -105.02 -34.13 8.09 Favored 'General case' 0 C--N 1.352 0.68 0 C-N-CA 125.525 1.53 . . . . 0.0 110.53 177.572 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 17.8 m -124.17 15.49 9.12 Favored 'General case' 0 C--N 1.358 0.956 0 N-CA-C 117.236 2.31 . . . . 0.0 117.236 -169.073 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 15.0 mt -137.37 -26.55 0.99 Allowed 'General case' 0 N--CA 1.472 0.656 0 O-C-N 119.349 -2.095 . . . . 0.0 112.981 175.507 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 85.4 55.06 2.67 Favored Glycine 0 C--N 1.363 2.052 0 C-N-CA 127.911 2.672 . . . . 0.0 112.86 -171.922 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 8.6 ptpt . . . . . 0 C--O 1.263 1.774 0 CA-C-O 116.26 -1.828 . . . . 0.0 106.539 -178.229 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 20.8 t90 . . . . . 0 N--CA 1.432 -1.35 0 N-CA-C 106.224 -1.769 . . . . 0.0 106.224 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 37.1 mt-30 -143.42 143.25 23.36 Favored Pre-proline 0 C--N 1.351 0.648 1 N-CA-C 99.034 -4.432 . . . . 0.0 99.034 175.128 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 3' ' ' PRO . . . . . 0.436 ' HA ' ' HD3' ' A' ' 4' ' ' PRO . 28.8 Cg_endo -72.37 114.86 4.12 Favored 'Trans proline' 0 CA--C 1.555 1.528 0 C-N-CA 124.776 3.65 . . . . 0.0 117.846 -165.623 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 4' ' ' PRO . . . . . 0.436 ' HD3' ' HA ' ' A' ' 3' ' ' PRO . 33.3 Cg_exo -77.76 -115.88 0.01 OUTLIER 'Trans proline' 0 C--N 1.371 1.722 1 C-N-CA 127.201 5.267 . . . . 0.0 114.428 177.318 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 5' ' ' TRP . . . . . 0.467 ' CE2' ' CE2' ' A' ' 6' ' ' TYR . 5.0 p-90 -85.44 -68.87 0.7 Allowed 'General case' 0 C--N 1.38 1.902 0 C-N-CA 128.129 2.572 . . . . 0.0 114.874 -178.164 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.467 ' CE2' ' CE2' ' A' ' 5' ' ' TRP . 0.1 OUTLIER -31.67 -56.98 0.28 Allowed 'General case' 0 CA--C 1.492 -1.288 1 C-N-CA 133.717 4.807 . . . . 0.0 116.989 -172.222 . . . . . . . . 4 4 . 1 . 002 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -56.53 -44.52 80.91 Favored 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 129.158 2.983 . . . . 0.0 115.239 -178.109 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 45.8 mttm -93.18 -13.94 27.77 Favored 'General case' 0 C--N 1.358 0.943 0 C-N-CA 128.921 2.889 . . . . 0.0 113.638 -177.662 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.439 ' HA ' ' HD3' ' A' ' 10' ' ' PRO . 0.1 OUTLIER -71.41 135.6 84.14 Favored Pre-proline 0 C--N 1.361 1.074 0 C-N-CA 127.581 2.352 . . . . 0.0 113.25 -175.06 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 10' ' ' PRO . . . . . 0.439 ' HD3' ' HA ' ' A' ' 9' ' ' GLU . 72.0 Cg_exo -65.63 131.01 26.41 Favored 'Trans proline' 0 C--N 1.358 1.077 0 C-N-CA 124.232 3.288 . . . . 0.0 118.959 -167.119 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 8.2 p -77.33 124.39 35.65 Favored 'Isoleucine or valine' 0 C--N 1.368 1.395 0 C-N-CA 127.825 2.45 . . . . 0.0 113.912 175.535 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -147.37 133.12 18.94 Favored 'General case' 0 C--N 1.367 1.344 0 C-N-CA 126.951 2.1 . . . . 0.0 112.906 -174.228 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.287 7.2 tt -88.26 -48.4 15.0 Favored 'Isoleucine or valine' 0 C--N 1.372 1.562 0 N-CA-C 117.619 2.451 . . . . 0.0 117.619 179.795 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.364 2.122 0 N-CA-C 117.411 1.724 . . . . 0.0 117.411 -170.231 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 12.0 ptmm? . . . . . 0 CA--C 1.503 -0.843 0 N-CA-C 102.328 -3.212 . . . . 0.0 102.328 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 5.1 mm100 -126.04 112.35 15.77 Favored 'General case' 0 N--CA 1.438 -1.058 0 N-CA-C 100.475 -3.898 . . . . 0.0 100.475 170.333 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 50.0 m-85 -94.4 144.23 25.73 Favored 'General case' 0 C--N 1.364 1.224 0 C-N-CA 126.385 1.874 . . . . 0.0 108.804 -179.654 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 4.9 t -67.54 112.74 4.87 Favored 'General case' 0 C--N 1.367 1.333 0 C-N-CA 126.723 2.009 . . . . 0.0 115.918 -175.764 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 4.6 p -120.26 -167.11 1.4 Allowed 'General case' 0 C--N 1.365 1.248 0 CA-C-O 123.263 1.506 . . . . 0.0 112.924 177.611 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 14.8 m-85 -148.99 136.82 20.58 Favored 'General case' 0 N--CA 1.446 -0.667 0 C-N-CA 129.236 3.014 . . . . 0.0 103.706 170.846 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 9.9 p90 -119.57 152.06 37.63 Favored 'General case' 0 C--N 1.364 1.216 0 CA-C-N 123.074 2.67 . . . . 0.0 109.684 173.102 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 19.6 t80 -94.01 121.66 35.71 Favored 'General case' 0 C--N 1.363 1.158 0 N-CA-C 106.45 -1.685 . . . . 0.0 106.45 -179.157 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.487 ' HD3' HD11 ' A' ' 33' ' ' LEU . 4.9 ttpp -90.9 108.59 19.94 Favored 'General case' 0 C--N 1.367 1.35 0 C-N-CA 123.48 0.712 . . . . 0.0 109.109 176.235 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 11.1 t-105 -52.09 -38.95 58.96 Favored 'General case' 0 C--N 1.355 0.823 0 C-N-CA 128.68 2.792 . . . . 0.0 117.1 -177.925 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 2.1 p -79.42 -30.09 42.17 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 129.686 3.194 . . . . 0.0 113.486 -179.397 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -86.1 -37.31 18.95 Favored 'General case' 0 C--N 1.365 1.273 0 C-N-CA 124.72 1.208 . . . . 0.0 111.473 177.748 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . 0.326 1.5 tptp 80.01 26.39 0.34 Allowed 'General case' 0 C--N 1.361 1.082 0 C-N-CA 127.693 2.397 . . . . 0.0 112.801 -178.621 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.5 tmtt? -147.52 177.27 9.39 Favored 'General case' 0 C--N 1.363 1.171 0 C-N-CA 125.827 1.651 . . . . 0.0 110.87 175.476 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 61.8 m -93.17 122.53 35.65 Favored 'General case' 0 C--N 1.363 1.161 0 C-N-CA 129.043 2.937 . . . . 0.0 114.394 -175.731 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.487 HD11 ' HD3' ' A' ' 26' ' ' LYS . 19.2 mt -104.42 142.44 24.63 Favored Pre-proline 0 C--N 1.358 0.96 0 CA-C-O 117.83 -1.081 . . . . 0.0 109.971 177.536 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 96.9 Cg_endo -82.12 127.62 5.39 Favored 'Trans proline' 0 CA--C 1.531 0.334 0 C-N-CA 123.878 3.052 . . . . 0.0 112.273 175.541 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . 0.261 0.2 OUTLIER -141.39 177.45 8.1 Favored 'General case' 0 C--N 1.35 0.621 0 N-CA-C 102.325 -3.213 . . . . 0.0 102.325 169.512 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 1.1 mp -117.88 165.56 13.53 Favored 'General case' 0 N--CA 1.44 -0.96 0 C-N-CA 125.27 1.428 . . . . 0.0 107.263 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.429 ' CE2' ' HA2' ' A' ' 39' ' ' GLY . 30.3 t80 -123.01 136.52 54.88 Favored 'General case' 0 CA--C 1.551 1.011 0 C-N-CA 125.578 1.551 . . . . 0.0 112.071 178.882 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.9 t -88.08 -24.6 23.38 Favored 'General case' 0 C--N 1.38 1.9 0 CA-C-N 122.073 2.215 . . . . 0.0 114.315 173.422 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' GLY . . . . . 0.429 ' HA2' ' CE2' ' A' ' 37' ' ' PHE . . . 118.23 -58.66 0.51 Allowed Glycine 0 C--N 1.361 1.93 0 C-N-CA 125.78 1.657 . . . . 0.0 114.166 175.411 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -102.81 115.91 31.52 Favored 'General case' 0 C--N 1.351 0.635 0 C-N-CA 126.307 1.843 . . . . 0.0 106.654 178.721 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 134.46 -45.86 1.09 Allowed Glycine 0 CA--C 1.49 -1.528 0 N-CA-C 109.861 -1.296 . . . . 0.0 109.861 -174.435 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -93.45 -165.93 37.71 Favored Glycine 0 C--N 1.36 1.907 0 O-C-N 121.13 -1.217 . . . . 0.0 113.932 173.263 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . 0.392 3.9 p30 -134.37 -99.81 0.25 Allowed 'General case' 0 C--N 1.353 0.734 0 O-C-N 121.177 -1.19 . . . . 0.0 113.466 179.916 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -150.79 24.4 0.76 Allowed 'General case' 0 C--N 1.374 1.635 0 N-CA-C 117.022 2.23 . . . . 0.0 117.022 -171.059 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' ASN . . . . . 0.581 ' H ' HH11 ' A' ' 46' ' ' ARG . 40.2 t30 -101.7 48.2 0.89 Allowed 'General case' 0 N--CA 1.491 1.587 0 N-CA-C 105.106 -2.183 . . . . 0.0 105.106 171.458 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.581 HH11 ' H ' ' A' ' 45' ' ' ASN . 0.0 OUTLIER -146.3 118.42 8.3 Favored 'General case' 0 CA--C 1.492 -1.276 0 N-CA-C 104.275 -2.491 . . . . 0.0 104.275 -176.131 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 47' ' ' PHE . . . . . 0.446 ' CD2' ' HA ' ' A' ' 53' ' ' CYS . 21.8 m-85 -107.23 129.41 54.87 Favored 'General case' 0 N--CA 1.429 -1.49 0 C-N-CA 127.681 2.392 . . . . 0.0 107.524 -165.261 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 23.4 mp0 -70.06 -30.45 67.71 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 126.249 1.82 . . . . 0.0 115.558 -169.107 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 1.4 p -146.21 168.3 21.37 Favored 'General case' 0 C--N 1.352 0.696 0 N-CA-C 104.272 -2.492 . . . . 0.0 104.272 176.268 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 2.3 tt -84.23 138.31 19.4 Favored 'Isoleucine or valine' 0 C--N 1.37 1.484 0 C-N-CA 125.576 1.55 . . . . 0.0 108.246 176.288 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 117.17 -50.06 0.82 Allowed Glycine 0 C--N 1.364 2.105 0 N-CA-C 107.49 -2.244 . . . . 0.0 107.49 -157.367 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 16.2 tp10 -77.71 -20.03 54.24 Favored 'General case' 0 C--N 1.366 1.324 0 N-CA-C 115.813 1.783 . . . . 0.0 115.813 -178.297 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' CYS . . . . . 0.446 ' HA ' ' CD2' ' A' ' 47' ' ' PHE . 52.7 t -77.57 -42.03 36.75 Favored 'General case' 0 C--N 1.361 1.094 0 C-N-CA 128.509 2.723 . . . . 0.0 112.882 177.923 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 72.5 mtm180 -74.52 -45.73 43.85 Favored 'General case' 0 N--CA 1.447 -0.609 1 C-N-CA 133.732 4.813 . . . . 0.0 112.466 179.96 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 69.8 tttt -82.63 55.03 2.83 Favored 'General case' 0 C--N 1.373 1.609 0 CA-C-O 123.616 1.674 . . . . 0.0 111.852 174.198 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 22.1 mtmt -167.77 -47.03 0.02 OUTLIER 'General case' 0 N--CA 1.444 -0.763 0 C-N-CA 129.977 3.311 . . . . 0.0 105.171 -178.547 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' CYS . . . . . 0.441 ' SG ' ' HB2' ' A' ' 6' ' ' TYR . 56.3 m -121.65 7.87 10.03 Favored 'General case' 0 C--N 1.357 0.914 0 N-CA-C 119.579 3.178 . . . . 0.0 119.579 -172.942 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 18.7 mt -133.83 -8.6 2.75 Favored 'General case' 0 N--CA 1.481 1.115 0 CA-C-N 125.646 3.839 . . . . 0.0 114.066 175.288 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 67.82 59.35 6.61 Favored Glycine 0 C--N 1.359 1.832 0 C-N-CA 128.262 2.839 . . . . 0.0 113.863 -171.449 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 2.5 ptpp? . . . . . 0 C--O 1.264 1.824 0 N-CA-C 102.366 -3.198 . . . . 0.0 102.366 -175.396 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 1' ' ' TRP . . . . . 0.508 ' CZ2' ' HB3' ' A' ' 3' ' ' PRO . 9.6 t90 . . . . . 0 N--CA 1.433 -1.32 0 N-CA-C 108.076 -1.083 . . . . 0.0 108.076 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 16.6 mm-40 -142.02 150.09 54.78 Favored Pre-proline 0 C--N 1.353 0.758 1 N-CA-C 98.382 -4.673 . . . . 0.0 98.382 171.07 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 3' ' ' PRO . . . . . 0.508 ' HB3' ' CZ2' ' A' ' 1' ' ' TRP . 87.5 Cg_endo -80.76 132.79 8.91 Favored 'Trans proline' 0 CA--C 1.563 1.933 0 CA-C-N 124.291 2.568 . . . . 0.0 113.455 -166.8 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 4' ' ' PRO . . . . . 0.508 ' HG2' ' CD2' ' A' ' 6' ' ' TYR . 44.7 Cg_endo -94.46 -113.22 0.0 OUTLIER 'Trans proline' 0 CA--C 1.546 1.119 1 C-N-CA 127.114 5.209 . . . . 0.0 110.784 -178.053 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 5' ' ' TRP . . . . . 0.433 ' CE3' ' CD1' ' A' ' 6' ' ' TYR 0.265 52.7 p-90 -86.98 -69.71 0.66 Allowed 'General case' 0 C--N 1.384 2.103 0 C-N-CA 128.097 2.559 . . . . 0.0 114.926 178.902 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.508 ' CD2' ' HG2' ' A' ' 4' ' ' PRO . 0.0 OUTLIER -32.8 -51.59 0.3 Allowed 'General case' 0 C--N 1.368 1.386 1 C-N-CA 132.472 4.309 . . . . 0.0 117.575 -174.168 . . . . . . . . 4 4 . 1 . 003 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 3.0 m -60.75 -28.7 68.9 Favored 'General case' 0 CA--C 1.507 -0.708 0 C-N-CA 129.275 3.03 . . . . 0.0 118.127 -175.305 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . 0.25 61.2 tttm -118.41 17.72 13.74 Favored 'General case' 0 C--N 1.355 0.81 0 C-N-CA 128.276 2.63 . . . . 0.0 108.487 -178.218 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.478 ' HA ' ' HD3' ' A' ' 10' ' ' PRO . 22.9 tp10 -94.86 127.78 41.9 Favored Pre-proline 0 C--N 1.36 1.041 0 O-C-N 119.263 -2.148 . . . . 0.0 112.722 -173.428 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' PRO . . . . . 0.478 ' HD3' ' HA ' ' A' ' 9' ' ' GLU . 38.2 Cg_exo -72.99 140.9 32.22 Favored 'Trans proline' 0 C--N 1.352 0.746 0 C-N-CA 123.903 3.069 . . . . 0.0 113.45 -169.814 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -81.41 153.07 4.18 Favored 'Isoleucine or valine' 0 C--N 1.362 1.109 0 N-CA-C 115.426 1.639 . . . . 0.0 115.426 178.871 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -147.0 119.8 8.65 Favored 'General case' 0 N--CA 1.438 -1.034 0 C-N-CA 125.369 1.468 . . . . 0.0 111.14 -178.281 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.285 11.7 tt -74.02 -40.7 52.25 Favored 'Isoleucine or valine' 0 C--N 1.357 0.894 0 N-CA-C 115.413 1.634 . . . . 0.0 115.413 175.829 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.352 1.419 0 N-CA-C 109.617 -1.393 . . . . 0.0 109.617 -178.933 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 38.3 ttmt . . . . . 0 CA--C 1.504 -0.823 1 N-CA-C 99.545 -4.243 . . . . 0.0 99.545 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -130.31 128.04 40.71 Favored 'General case' 0 C--N 1.354 0.768 0 C-N-CA 123.873 0.869 . . . . 0.0 112.339 -170.071 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 26.8 m-85 -112.04 135.33 52.82 Favored 'General case' 0 C--N 1.358 0.966 0 C-N-CA 127.294 2.238 . . . . 0.0 107.7 177.184 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' SER . . . . . 0.483 ' HA ' ' HG ' ' A' ' 36' ' ' LEU 0.277 4.0 t -69.26 132.31 46.27 Favored 'General case' 0 C--N 1.375 1.684 0 N-CA-C 116.492 2.034 . . . . 0.0 116.492 -177.133 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 3.2 p -146.06 -172.08 3.85 Favored 'General case' 0 N--CA 1.448 -0.538 0 C-N-CA 127.633 2.373 . . . . 0.0 110.312 -173.029 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 48.6 m-85 -145.27 153.37 41.22 Favored 'General case' 0 C--N 1.35 0.628 0 C-N-CA 128.631 2.772 . . . . 0.0 110.733 177.083 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . 0.251 12.5 p90 -131.98 154.93 48.83 Favored 'General case' 0 C--N 1.373 1.624 0 C-N-CA 125.292 1.437 . . . . 0.0 108.671 168.106 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 16.2 t80 -94.97 111.88 23.63 Favored 'General case' 0 C--N 1.365 1.268 0 O-C-N 119.716 -1.865 . . . . 0.0 107.966 -179.477 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -83.38 107.03 15.62 Favored 'General case' 0 C--N 1.363 1.195 0 O-C-N 120.366 -1.459 . . . . 0.0 111.83 -176.51 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 41.1 t-105 -46.05 -53.59 9.95 Favored 'General case' 0 C--N 1.357 0.931 1 C-N-CA 132.155 4.182 . . . . 0.0 117.746 -171.546 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.5 p -81.27 -15.74 54.63 Favored 'General case' 0 C--N 1.353 0.723 0 C-N-CA 126.657 1.983 . . . . 0.0 113.084 179.686 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -88.79 -37.63 15.27 Favored 'General case' 0 C--N 1.366 1.299 0 C-N-CA 124.175 0.99 . . . . 0.0 112.044 174.304 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . 0.301 12.0 mmmm 77.25 27.03 0.68 Allowed 'General case' 0 C--N 1.366 1.309 0 C-N-CA 129.562 3.145 . . . . 0.0 113.327 -178.519 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 52.1 pttt -146.45 163.97 33.97 Favored 'General case' 0 C--N 1.355 0.811 0 C-N-CA 125.807 1.643 . . . . 0.0 110.502 -179.572 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 89.4 m -80.48 126.34 31.09 Favored 'General case' 0 C--N 1.359 0.991 0 C-N-CA 128.308 2.643 . . . . 0.0 115.222 -177.247 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 13.2 mt -112.19 147.58 37.26 Favored Pre-proline 0 C--N 1.36 1.039 0 O-C-N 120.461 -1.4 . . . . 0.0 108.725 176.298 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -86.57 142.54 7.02 Favored 'Trans proline' 0 C--N 1.344 0.311 1 C-N-CA 125.542 4.161 . . . . 0.0 111.444 170.976 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -145.7 165.12 29.68 Favored 'General case' 0 N--CA 1.439 -0.993 1 N-CA-C 98.313 -4.699 . . . . 0.0 98.313 169.691 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.483 ' HG ' ' HA ' ' A' ' 21' ' ' SER . 7.8 mp -109.72 149.93 29.04 Favored 'General case' 0 N--CA 1.44 -0.942 0 N-CA-C 104.428 -2.434 . . . . 0.0 104.428 174.922 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -100.51 138.15 37.96 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 126.953 2.101 . . . . 0.0 109.129 176.598 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 9.2 t -107.66 119.0 38.21 Favored 'General case' 0 C--N 1.363 1.179 0 N-CA-C 104.585 -2.376 . . . . 0.0 104.585 171.521 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -68.93 19.58 0.43 Allowed Glycine 0 N--CA 1.479 1.515 0 C-N-CA 127.681 2.563 . . . . 0.0 119.134 -178.397 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 78.7 m -114.12 56.22 0.72 Allowed 'General case' 0 C--N 1.354 0.791 0 C-N-CA 128.943 2.897 . . . . 0.0 108.825 172.355 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 118.29 54.77 0.28 Allowed Glycine 0 C--N 1.359 1.842 0 N-CA-C 120.367 2.907 . . . . 0.0 120.367 171.107 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -86.47 -176.72 49.62 Favored Glycine 0 C--N 1.37 2.466 0 CA-C-N 121.48 2.64 . . . . 0.0 116.412 175.12 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' ASN . . . . . 0.5 ' H ' ' CZ ' ' A' ' 46' ' ' ARG 0.355 30.2 p30 -113.07 -112.88 0.34 Allowed 'General case' 0 C--N 1.362 1.136 0 O-C-N 119.923 -1.927 . . . . 0.0 114.435 179.887 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -141.64 -9.31 0.94 Allowed 'General case' 0 C--N 1.354 0.761 0 O-C-N 120.406 -1.434 . . . . 0.0 112.894 -174.814 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 61.7 t30 -101.53 57.2 0.84 Allowed 'General case' 0 C--N 1.365 1.261 0 O-C-N 120.19 -1.568 . . . . 0.0 109.969 -179.409 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.5 ' CZ ' ' H ' ' A' ' 43' ' ' ASN 0.37 0.0 OUTLIER -131.06 130.53 43.35 Favored 'General case' 0 CA--C 1.498 -1.033 0 CA-C-O 124.415 2.055 . . . . 0.0 110.197 178.292 . . . . . . . . 4 4 . 1 . 003 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 10.5 m-85 -114.75 131.42 56.78 Favored 'General case' 0 C--N 1.35 0.593 0 C-N-CA 128.388 2.675 . . . . 0.0 106.894 -177.258 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -85.99 -27.08 25.07 Favored 'General case' 0 C--N 1.371 1.523 0 CA-C-N 121.62 2.009 . . . . 0.0 115.579 -177.311 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 23.9 p -125.19 155.72 39.57 Favored 'General case' 0 C--N 1.351 0.667 0 N-CA-C 104.8 -2.296 . . . . 0.0 104.8 177.497 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 16.4 tt -58.87 -32.17 46.59 Favored 'Isoleucine or valine' 0 C--N 1.36 1.046 0 N-CA-C 117.347 2.351 . . . . 0.0 117.347 -177.621 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' GLY . . . . . 0.404 ' HA2' ' HD3' ' A' ' 54' ' ' ARG . . . -91.37 1.68 76.84 Favored Glycine 0 C--N 1.358 1.782 0 O-C-N 120.187 -1.571 . . . . 0.0 115.795 178.222 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 15.6 tp10 -82.28 -20.23 37.93 Favored 'General case' 0 C--N 1.365 1.248 0 O-C-N 120.896 -1.355 . . . . 0.0 110.67 170.774 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 19.7 t -72.12 -30.19 64.82 Favored 'General case' 0 C--N 1.363 1.162 0 C-N-CA 129.07 2.948 . . . . 0.0 112.86 175.573 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.404 ' HD3' ' HA2' ' A' ' 51' ' ' GLY . 43.8 mtp180 -76.16 -48.56 20.12 Favored 'General case' 0 C--N 1.355 0.81 0 C-N-CA 127.697 2.399 . . . . 0.0 114.875 176.461 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 30.8 ttmt -82.15 59.92 4.67 Favored 'General case' 0 C--N 1.361 1.075 0 C-N-CA 127.809 2.444 . . . . 0.0 111.841 -174.266 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.421 ' HG2' ' CZ ' ' A' ' 6' ' ' TYR . 23.9 mtmt -179.62 -39.81 0.01 OUTLIER 'General case' 0 N--CA 1.439 -0.993 0 C-N-CA 130.854 3.662 . . . . 0.0 106.09 -176.11 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 57' ' ' CYS . . . . . 0.409 ' O ' ' CZ2' ' A' ' 1' ' ' TRP . 67.7 m -125.01 7.38 7.98 Favored 'General case' 0 C--N 1.364 1.238 0 N-CA-C 119.862 3.282 . . . . 0.0 119.862 -170.503 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 14.7 mt -140.58 -8.97 1.09 Allowed 'General case' 0 N--CA 1.476 0.834 0 CA-C-N 124.124 3.147 . . . . 0.0 114.466 169.713 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 71.41 51.32 17.42 Favored Glycine 0 C--N 1.356 1.654 0 C-N-CA 128.107 2.765 . . . . 0.0 113.395 -171.923 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 12.3 ptpt . . . . . 0 C--O 1.26 1.629 0 N-CA-C 103.707 -2.701 . . . . 0.0 103.707 -174.195 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 23.3 t90 . . . . . 0 N--CA 1.433 -1.297 0 N-CA-C 108.254 -1.017 . . . . 0.0 108.254 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 23.5 mm-40 -144.14 144.06 24.7 Favored Pre-proline 0 C--N 1.353 0.726 0 N-CA-C 100.482 -3.895 . . . . 0.0 100.482 174.927 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 19.9 Cg_endo -72.69 122.59 8.34 Favored 'Trans proline' 0 CA--C 1.557 1.631 0 CA-C-N 124.782 2.744 . . . . 0.0 116.441 -169.257 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 4' ' ' PRO . . . . . 0.487 ' HG2' ' CD2' ' A' ' 6' ' ' TYR . 38.2 Cg_endo -91.78 -123.15 0.01 OUTLIER 'Trans proline' 0 CA--C 1.555 1.533 1 C-N-CA 127.034 5.156 . . . . 0.0 111.81 178.694 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 5' ' ' TRP . . . . . 0.469 ' CE3' ' CD1' ' A' ' 6' ' ' TYR 0.336 54.7 p-90 -73.09 -74.14 0.18 Allowed 'General case' 0 C--N 1.384 2.076 0 C-N-CA 126.521 1.928 . . . . 0.0 114.44 178.538 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.487 ' CD2' ' HG2' ' A' ' 4' ' ' PRO . 0.1 OUTLIER -32.04 -51.46 0.24 Allowed 'General case' 0 C--N 1.363 1.169 1 C-N-CA 132.183 4.193 . . . . 0.0 117.469 -175.619 . . . . . . . . 4 4 . 1 . 004 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.428 ' O ' ' HB2' ' A' ' 27' ' ' TRP . 1.1 m -71.5 -8.01 51.19 Favored 'General case' 0 CA--C 1.51 -0.587 0 C-N-CA 129.885 3.274 . . . . 0.0 115.747 -176.902 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 47.8 mttp -134.81 11.63 3.67 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 128.118 2.567 . . . . 0.0 107.242 -179.604 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.408 ' HA ' ' HD3' ' A' ' 10' ' ' PRO . 34.9 tp10 -96.85 134.42 23.08 Favored Pre-proline 0 C--N 1.364 1.228 0 N-CA-C 115.092 1.515 . . . . 0.0 115.092 -167.849 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' PRO . . . . . 0.408 ' HD3' ' HA ' ' A' ' 9' ' ' GLU . 72.0 Cg_exo -66.35 121.1 8.32 Favored 'Trans proline' 0 C--N 1.365 1.433 0 C-N-CA 124.707 3.604 . . . . 0.0 116.182 -169.495 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 14.3 p -69.39 136.46 26.2 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.908 0 C-N-CA 127.642 2.377 . . . . 0.0 112.885 177.584 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 61.6 mtp180 -146.33 126.09 13.46 Favored 'General case' 0 C--N 1.359 1.02 0 C-N-CA 125.237 1.415 . . . . 0.0 111.869 -172.274 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 12.9 tt -103.65 -37.27 4.49 Favored 'Isoleucine or valine' 0 C--N 1.37 1.482 0 C-N-CA 126.334 1.854 . . . . 0.0 112.452 175.593 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.366 2.195 0 C-N-CA 127.171 2.319 . . . . 0.0 116.95 176.722 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 15.0 tppt? . . . . . 0 CA--C 1.5 -0.951 0 N-CA-C 106.547 -1.649 . . . . 0.0 106.547 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . 0.337 4.1 mp0 -93.5 121.15 34.61 Favored 'General case' 0 C--N 1.358 0.946 0 CA-C-O 122.955 1.359 . . . . 0.0 112.075 178.736 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 30.0 m-85 -108.21 150.13 27.66 Favored 'General case' 0 C--N 1.356 0.874 0 C-N-CA 128.148 2.579 . . . . 0.0 106.069 -179.176 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 4.1 t -72.0 143.95 49.01 Favored 'General case' 0 C--N 1.368 1.404 0 N-CA-C 117.127 2.269 . . . . 0.0 117.127 -173.536 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 27.7 p -145.87 -173.28 4.11 Favored 'General case' 0 C--N 1.36 1.062 0 C-N-CA 127.934 2.494 . . . . 0.0 112.458 -177.856 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' PHE . . . . . 0.517 ' HA ' ' HA ' ' A' ' 34' ' ' PRO . 43.0 m-85 -139.69 153.21 47.19 Favored 'General case' 0 C--N 1.361 1.089 0 C-N-CA 129.454 3.102 . . . . 0.0 111.66 174.876 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . 0.282 10.7 p90 -147.93 161.42 41.36 Favored 'General case' 0 C--N 1.367 1.355 0 C-N-CA 126.437 1.895 . . . . 0.0 110.158 172.134 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' PHE . . . . . 0.427 ' CD2' ' HB2' ' A' ' 57' ' ' CYS . 27.5 t80 -100.53 127.44 46.9 Favored 'General case' 0 C--N 1.368 1.387 0 O-C-N 120.54 -1.35 . . . . 0.0 108.274 178.438 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.408 ' HB3' ' HB3' ' A' ' 29' ' ' ALA . 1.7 ttpp -85.77 103.17 14.3 Favored 'General case' 0 C--N 1.364 1.21 0 C-N-CA 124.334 1.054 . . . . 0.0 112.04 177.873 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' TRP . . . . . 0.428 ' HB2' ' O ' ' A' ' 7' ' ' CYS . 35.3 t-105 -50.69 -44.43 57.92 Favored 'General case' 0 C--N 1.35 0.612 0 C-N-CA 129.301 3.04 . . . . 0.0 116.116 179.361 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 3.7 p -87.31 -6.56 58.47 Favored 'General case' 0 C--N 1.36 1.064 0 C-N-CA 125.193 1.397 . . . . 0.0 113.326 178.478 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.408 ' HB3' ' HB3' ' A' ' 26' ' ' LYS . . . -99.51 -38.48 8.76 Favored 'General case' 0 C--N 1.368 1.376 0 CA-C-N 120.561 1.528 . . . . 0.0 112.095 173.701 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . 0.273 30.4 tptt 84.36 23.59 0.11 Allowed 'General case' 0 C--N 1.367 1.351 0 C-N-CA 127.623 2.369 . . . . 0.0 111.616 -176.258 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 55.2 mtmt -145.54 166.43 25.75 Favored 'General case' 0 C--N 1.357 0.92 0 C-N-CA 126.636 1.974 . . . . 0.0 109.55 -177.61 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 75.0 m -89.39 145.8 25.1 Favored 'General case' 0 C--N 1.358 0.938 0 C-N-CA 127.646 2.379 . . . . 0.0 113.293 -178.791 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 44.6 mt -129.09 148.93 71.08 Favored Pre-proline 0 C--N 1.357 0.934 0 C-N-CA 125.296 1.438 . . . . 0.0 109.182 176.298 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.517 ' HA ' ' HA ' ' A' ' 23' ' ' PHE . 18.6 Cg_endo -86.64 162.31 9.34 Favored 'Trans proline' 0 N--CA 1.46 -0.445 0 C-N-CA 123.267 2.645 . . . . 0.0 110.868 165.933 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . 0.352 2.9 p90 -149.55 -159.24 1.01 Allowed 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 113.269 -1.787 . . . . 0.0 108.332 174.775 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 18.8 mt -139.65 144.94 37.88 Favored 'General case' 0 N--CA 1.439 -1.016 0 N-CA-C 103.323 -2.843 . . . . 0.0 103.323 -178.598 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.408 ' CE2' ' HA2' ' A' ' 39' ' ' GLY . 12.3 t80 -121.2 128.97 52.97 Favored 'General case' 0 CA--C 1.551 0.982 0 C-N-CA 128.852 2.861 . . . . 0.0 109.338 -179.792 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 37.7 m -76.52 2.57 13.48 Favored 'General case' 0 C--N 1.388 2.252 0 N-CA-C 115.976 1.843 . . . . 0.0 115.976 -178.318 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' GLY . . . . . 0.408 ' HA2' ' CE2' ' A' ' 37' ' ' PHE . . . 83.85 -39.45 2.85 Favored Glycine 0 C--N 1.358 1.776 0 N-CA-C 118.374 2.11 . . . . 0.0 118.374 176.3 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -125.51 38.06 4.25 Favored 'General case' 0 C--N 1.35 0.595 0 C-N-CA 124.514 1.125 . . . . 0.0 108.591 178.484 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -147.8 28.31 1.44 Allowed Glycine 0 C--N 1.356 1.655 0 N-CA-C 116.762 1.465 . . . . 0.0 116.762 -176.398 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -105.43 178.36 23.31 Favored Glycine 0 C--N 1.356 1.644 0 O-C-N 119.598 -2.119 . . . . 0.0 116.467 177.727 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 43.6 p-10 -127.31 -92.98 0.48 Allowed 'General case' 0 C--N 1.356 0.882 0 C-N-CA 124.615 1.166 . . . . 0.0 112.5 176.425 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -136.52 -30.0 0.93 Allowed 'General case' 0 C--N 1.358 0.972 0 N-CA-C 114.537 1.31 . . . . 0.0 114.537 -172.182 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 45.5 t30 -92.72 72.09 4.93 Favored 'General case' 0 C--N 1.372 1.547 0 O-C-N 119.743 -1.848 . . . . 0.0 111.918 -176.343 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . 0.377 0.0 OUTLIER -135.77 125.59 25.65 Favored 'General case' 0 C--N 1.351 0.673 0 CA-C-O 124.517 2.103 . . . . 0.0 110.238 174.606 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 20.2 m-30 -105.0 137.83 42.15 Favored 'General case' 0 N--CA 1.441 -0.905 0 C-N-CA 128.69 2.796 . . . . 0.0 107.795 -176.526 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 30.9 mt-30 -74.73 -45.65 42.61 Favored 'General case' 0 C--N 1.368 1.41 0 N-CA-C 114.734 1.383 . . . . 0.0 114.734 -177.413 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 30.1 p -129.56 172.23 11.78 Favored 'General case' 0 C--N 1.353 0.744 0 N-CA-C 105.529 -2.026 . . . . 0.0 105.529 175.747 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 18.6 tt -59.55 -28.07 39.08 Favored 'Isoleucine or valine' 0 C--N 1.365 1.281 0 C-N-CA 128.869 2.868 . . . . 0.0 117.05 178.985 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -84.75 -8.9 82.09 Favored Glycine 0 C--N 1.361 1.956 0 N-CA-C 115.961 1.144 . . . . 0.0 115.961 -177.226 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -88.49 -1.93 58.32 Favored 'General case' 0 C--N 1.362 1.123 0 C-N-CA 126.06 1.744 . . . . 0.0 111.248 176.274 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 33.9 t -85.05 -47.79 9.86 Favored 'General case' 0 C--N 1.355 0.821 0 C-N-CA 128.333 2.653 . . . . 0.0 112.983 -178.191 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.442 ' HB2' ' HD2' ' A' ' 60' ' ' LYS 0.338 0.0 OUTLIER -85.79 -25.27 26.45 Favored 'General case' 0 C--O 1.234 0.277 0 C-N-CA 128.64 2.776 . . . . 0.0 111.815 -179.916 . . . . . . . . 4 4 . 1 . 004 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.67 -25.39 63.88 Favored 'General case' 0 C--N 1.373 1.601 0 C-N-CA 125.857 1.663 . . . . 0.0 113.794 171.696 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.423 ' HD2' ' CD1' ' A' ' 6' ' ' TYR . 23.5 mtmt -98.49 -32.1 11.64 Favored 'General case' 0 C--N 1.362 1.116 0 C-N-CA 125.034 1.334 . . . . 0.0 111.636 172.695 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 57' ' ' CYS . . . . . 0.438 ' SG ' ' HB2' ' A' ' 6' ' ' TYR . 87.7 m -124.33 11.46 8.71 Favored 'General case' 0 C--N 1.362 1.132 0 N-CA-C 120.12 3.378 . . . . 0.0 120.12 -172.167 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 17.3 mt -132.15 -17.97 2.65 Favored 'General case' 0 N--CA 1.477 0.879 0 CA-C-N 124.579 3.354 . . . . 0.0 112.102 170.214 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 76.61 56.09 4.34 Favored Glycine 0 C--N 1.359 1.831 0 C-N-CA 128.034 2.73 . . . . 0.0 112.381 -171.601 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' LYS . . . . . 0.442 ' HD2' ' HB2' ' A' ' 54' ' ' ARG . 13.7 ptpt . . . . . 0 C--O 1.258 1.526 0 N-CA-C 102.892 -3.003 . . . . 0.0 102.892 -176.373 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 19.3 t90 . . . . . 0 N--CA 1.436 -1.171 0 CA-C-O 122.706 1.241 . . . . 0.0 109.753 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 35.3 mt-30 -138.75 147.6 55.09 Favored Pre-proline 0 C--N 1.359 1.016 1 N-CA-C 99.91 -4.107 . . . . 0.0 99.91 169.279 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 5.0 Cg_endo -73.76 123.57 8.61 Favored 'Trans proline' 0 CA--C 1.553 1.444 0 CA-C-N 125.556 3.02 . . . . 0.0 116.03 -169.995 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 4' ' ' PRO . . . . . 0.563 ' HG2' ' CD2' ' A' ' 6' ' ' TYR . 49.5 Cg_endo -94.11 -116.92 0.0 OUTLIER 'Trans proline' 0 CA--C 1.548 1.221 1 C-N-CA 126.392 4.728 . . . . 0.0 110.362 179.592 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 5' ' ' TRP . . . . . . . . . . . . 0.264 63.9 p-90 -87.06 -57.09 3.09 Favored 'General case' 0 C--N 1.384 2.093 0 C-N-CA 127.977 2.511 . . . . 0.0 115.234 176.249 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.563 ' CD2' ' HG2' ' A' ' 4' ' ' PRO . 0.1 OUTLIER -48.44 -7.77 0.02 OUTLIER 'General case' 0 C--N 1.363 1.162 1 C-N-CA 132.255 4.222 . . . . 0.0 120.663 -174.683 . . . . . . . . 4 4 . 1 . 005 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.414 ' O ' ' HB2' ' A' ' 27' ' ' TRP . 4.1 m -103.09 -31.67 10.06 Favored 'General case' 0 N--CA 1.442 -0.868 0 N-CA-C 106.829 -1.545 . . . . 0.0 106.829 -177.331 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 26.0 mtmt -98.27 20.77 11.95 Favored 'General case' 0 C--N 1.364 1.231 0 C-N-CA 128.904 2.881 . . . . 0.0 113.206 -175.181 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -104.94 126.36 31.31 Favored Pre-proline 0 C--N 1.362 1.131 0 CA-C-O 115.645 -2.121 . . . . 0.0 108.558 -176.763 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 30.5 Cg_exo -77.19 156.02 33.35 Favored 'Trans proline' 0 C--N 1.374 1.872 0 C-N-CA 125.23 3.954 . . . . 0.0 113.689 -167.22 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 9.4 p -72.52 134.12 30.44 Favored 'Isoleucine or valine' 0 C--N 1.37 1.483 0 N-CA-C 117.966 2.58 . . . . 0.0 117.966 178.379 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.684 ' NE ' HH21 ' A' ' 46' ' ' ARG . 0.0 OUTLIER -106.08 -176.72 3.16 Favored 'General case' 0 C--N 1.355 0.846 0 C-N-CA 129.109 2.964 . . . . 0.0 109.741 179.069 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.451 0.6 OUTLIER -155.49 -55.42 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.355 0.812 0 C-N-CA 126.133 1.773 . . . . 0.0 112.95 162.996 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.366 2.232 0 CA-C-N 119.506 1.048 . . . . 0.0 114.245 -174.152 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 13.6 tptp . . . . . 0 N--CA 1.439 -1.0 1 N-CA-C 99.094 -4.41 . . . . 0.0 99.094 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 3.2 mm100 -93.07 120.22 33.13 Favored 'General case' 0 C--N 1.356 0.866 0 N-CA-C 107.24 -1.392 . . . . 0.0 107.24 178.13 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 29.5 m-85 -109.49 131.27 55.22 Favored 'General case' 0 C--N 1.355 0.806 0 O-C-N 121.033 -1.042 . . . . 0.0 108.271 -179.002 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' SER . . . . . 0.444 ' HA ' ' HG ' ' A' ' 36' ' ' LEU . 8.2 t -68.08 127.43 32.85 Favored 'General case' 0 C--N 1.375 1.701 0 CA-C-N 120.708 1.594 . . . . 0.0 115.121 -176.863 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 90.5 p -125.5 -159.62 0.91 Allowed 'General case' 0 C--N 1.348 0.501 0 C-N-CA 126.188 1.795 . . . . 0.0 112.451 -176.544 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 95.4 m-85 -146.94 132.35 18.59 Favored 'General case' 0 C--N 1.366 1.298 0 C-N-CA 129.646 3.178 . . . . 0.0 108.302 176.663 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 7.7 p90 -130.02 154.63 47.22 Favored 'General case' 0 C--N 1.363 1.183 0 CA-C-N 120.692 1.587 . . . . 0.0 107.746 169.757 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 7.8 t80 -102.94 127.47 50.14 Favored 'General case' 0 C--N 1.36 1.04 0 N-CA-C 105.652 -1.981 . . . . 0.0 105.652 -179.768 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 16.8 tptp -109.12 111.35 22.92 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 120.875 -1.14 . . . . 0.0 110.153 -178.058 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' TRP . . . . . 0.414 ' HB2' ' O ' ' A' ' 7' ' ' CYS . 33.7 t-105 -33.98 -58.08 0.45 Allowed 'General case' 0 C--N 1.369 1.453 0 N-CA-C 120.494 3.516 . . . . 0.0 120.494 176.551 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 2.0 p -80.27 -5.92 57.05 Favored 'General case' 0 C--N 1.363 1.173 0 C-N-CA 126.524 1.93 . . . . 0.0 113.868 -179.564 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -94.88 -39.67 10.11 Favored 'General case' 0 C--N 1.363 1.194 0 C-N-CA 124.663 1.185 . . . . 0.0 109.94 173.924 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 11.7 tptm 78.09 17.95 1.19 Allowed 'General case' 0 C--N 1.373 1.619 0 C-N-CA 128.44 2.696 . . . . 0.0 112.241 179.079 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 56.8 mtmt -138.0 167.27 22.12 Favored 'General case' 0 C--N 1.354 0.789 0 C-N-CA 128.469 2.707 . . . . 0.0 110.637 -175.567 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 87.9 m -93.17 119.29 32.2 Favored 'General case' 0 C--N 1.365 1.249 0 C-N-CA 129.528 3.131 . . . . 0.0 111.291 179.434 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 58.3 mt -110.48 139.31 21.42 Favored Pre-proline 0 C--N 1.35 0.591 0 O-C-N 119.949 -1.72 . . . . 0.0 109.788 -179.882 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -87.89 104.62 0.53 Allowed 'Trans proline' 0 N--CA 1.462 -0.346 0 C-N-CA 124.163 3.242 . . . . 0.0 112.12 -178.92 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 1.1 p90 -98.8 -177.95 3.81 Favored 'General case' 0 C--N 1.359 0.982 0 N-CA-C 107.218 -1.401 . . . . 0.0 107.218 173.782 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.444 ' HG ' ' HA ' ' A' ' 21' ' ' SER . 6.8 mp -118.65 145.04 45.77 Favored 'General case' 0 CA--C 1.507 -0.684 0 O-C-N 119.251 -2.156 . . . . 0.0 105.896 176.092 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 25.9 t80 -106.86 138.67 42.59 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 126.408 1.883 . . . . 0.0 110.164 177.851 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 2.7 m -92.85 -5.33 51.21 Favored 'General case' 0 C--N 1.376 1.724 0 N-CA-C 116.475 2.028 . . . . 0.0 116.475 178.073 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 105.82 -58.18 0.46 Allowed Glycine 0 C--N 1.366 2.245 0 CA-C-N 120.415 1.461 . . . . 0.0 115.71 -176.764 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 3.3 m -116.02 134.64 54.74 Favored 'General case' 0 C--N 1.354 0.781 0 N-CA-C 104.323 -2.473 . . . . 0.0 104.323 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 113.35 -10.61 24.2 Favored Glycine 0 C--N 1.362 2.002 0 CA-C-N 120.591 1.541 . . . . 0.0 112.562 -174.599 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -87.43 126.76 8.14 Favored Glycine 0 C--N 1.361 1.932 0 C-N-CA 125.883 1.706 . . . . 0.0 110.206 168.587 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 42.0 p30 -88.48 -78.49 0.33 Allowed 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 127.272 2.229 . . . . 0.0 115.307 -179.52 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -136.84 -27.11 1.02 Allowed 'General case' 0 C--N 1.362 1.151 0 N-CA-C 117.53 2.419 . . . . 0.0 117.53 -176.165 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 10.5 t-20 -109.45 78.49 1.14 Allowed 'General case' 0 CA--C 1.55 0.958 0 N-CA-C 117.962 2.578 . . . . 0.0 117.962 -170.635 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.684 HH21 ' NE ' ' A' ' 12' ' ' ARG 0.445 0.2 OUTLIER -146.34 147.96 31.88 Favored 'General case' 0 C--N 1.366 1.312 0 CA-C-N 123.902 3.046 . . . . 0.0 112.67 168.007 . . . . . . . . 4 4 . 1 . 005 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 7.2 m-85 -108.05 139.08 43.21 Favored 'General case' 0 C--N 1.368 1.409 0 C-N-CA 127.428 2.291 . . . . 0.0 112.416 -168.458 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -81.96 -24.63 35.42 Favored 'General case' 0 C--N 1.374 1.642 0 C-N-CA 126.311 1.844 . . . . 0.0 115.367 -179.61 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 57.3 p -139.54 163.94 31.22 Favored 'General case' 0 C--N 1.36 1.037 0 N-CA-C 105.599 -2.0 . . . . 0.0 105.599 176.519 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 14.1 tt -64.61 -21.52 29.4 Favored 'Isoleucine or valine' 0 C--N 1.367 1.354 0 C-N-CA 126.817 2.047 . . . . 0.0 116.191 179.489 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -84.43 -13.37 73.58 Favored Glycine 0 C--N 1.365 2.148 0 C-N-CA 126.05 1.786 . . . . 0.0 114.618 -179.997 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -82.76 -12.69 57.33 Favored 'General case' 0 C--N 1.366 1.319 0 O-C-N 120.823 -1.398 . . . . 0.0 111.61 174.577 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 14.9 t -72.71 -48.1 41.54 Favored 'General case' 0 C--N 1.361 1.107 0 C-N-CA 127.628 2.371 . . . . 0.0 112.755 178.045 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 11.0 mtp180 -69.99 -33.16 71.68 Favored 'General case' 0 C--N 1.346 0.424 1 C-N-CA 132.778 4.431 . . . . 0.0 112.994 173.699 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 31.5 ttmt -69.84 -36.94 75.99 Favored 'General case' 0 C--N 1.369 1.421 0 C-N-CA 126.825 2.05 . . . . 0.0 113.213 178.83 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 6.0 mtmm -89.09 -31.64 17.92 Favored 'General case' 0 C--N 1.367 1.366 0 C-N-CA 124.918 1.287 . . . . 0.0 111.91 172.88 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 56.4 m -127.33 8.85 6.59 Favored 'General case' 0 C--N 1.365 1.247 0 N-CA-C 121.558 3.91 . . . . 0.0 121.558 -173.557 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 14.1 mt -136.54 -32.41 0.83 Allowed 'General case' 0 C--N 1.359 1.018 1 CA-C-N 126.984 4.447 . . . . 0.0 115.228 169.392 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 86.46 55.31 2.48 Favored Glycine 0 C--N 1.359 1.827 0 CA-C-N 119.577 1.08 . . . . 0.0 112.279 -169.634 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 1.3 ptpp? . . . . . 0 C--O 1.258 1.527 0 N-CA-C 103.264 -2.865 . . . . 0.0 103.264 -176.594 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 3.4 t90 . . . . . 0 N--CA 1.433 -1.299 0 N-CA-C 105.996 -1.853 . . . . 0.0 105.996 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 30.4 mt-30 -136.38 144.86 49.35 Favored Pre-proline 0 N--CA 1.443 -0.789 0 N-CA-C 100.322 -3.955 . . . . 0.0 100.322 173.585 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 3' ' ' PRO . . . . . 0.41 ' HA ' ' HD3' ' A' ' 4' ' ' PRO . 47.1 Cg_endo -76.0 125.83 8.92 Favored 'Trans proline' 0 CA--C 1.558 1.701 0 C-N-CA 123.369 2.712 . . . . 0.0 114.5 -168.461 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 4' ' ' PRO . . . . . 0.498 ' HG2' ' CD2' ' A' ' 6' ' ' TYR . 40.5 Cg_endo -96.59 -114.38 0.0 OUTLIER 'Trans proline' 0 CA--C 1.547 1.168 1 C-N-CA 126.886 5.058 . . . . 0.0 111.345 -176.395 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 5' ' ' TRP . . . . . 0.506 ' CE3' ' CD1' ' A' ' 6' ' ' TYR 0.29 45.9 p-90 -86.74 -69.71 0.66 Allowed 'General case' 0 C--N 1.382 1.998 0 C-N-CA 127.623 2.369 . . . . 0.0 114.867 178.469 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.506 ' CD1' ' CE3' ' A' ' 5' ' ' TRP . 0.1 OUTLIER -33.14 -45.09 0.13 Allowed 'General case' 0 C--N 1.36 1.046 1 C-N-CA 132.995 4.518 . . . . 0.0 119.137 -173.397 . . . . . . . . 4 4 . 1 . 006 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.6 m -65.84 -41.79 91.31 Favored 'General case' 0 N--CA 1.448 -0.57 0 C-N-CA 128.235 2.614 . . . . 0.0 112.148 -179.827 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 44.2 mtpt -93.95 -7.97 41.42 Favored 'General case' 0 C--N 1.363 1.154 0 C-N-CA 129.073 2.949 . . . . 0.0 112.368 -179.278 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.437 ' HA ' ' HD3' ' A' ' 10' ' ' PRO . 0.6 OUTLIER -80.89 123.44 82.23 Favored Pre-proline 0 C--N 1.363 1.183 0 CA-C-O 116.326 -1.797 . . . . 0.0 112.738 -172.676 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 10' ' ' PRO . . . . . 0.437 ' HD3' ' HA ' ' A' ' 9' ' ' GLU . 50.7 Cg_exo -70.86 147.78 56.5 Favored 'Trans proline' 0 CA--C 1.54 0.779 0 C-N-CA 123.525 2.817 . . . . 0.0 115.479 -163.801 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 3.5 p -78.8 131.99 33.21 Favored 'Isoleucine or valine' 0 C--N 1.363 1.177 0 C-N-CA 125.375 1.47 . . . . 0.0 110.659 176.236 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 38.3 mtt-85 -136.23 152.03 50.31 Favored 'General case' 0 C--N 1.359 0.995 0 N-CA-C 106.408 -1.701 . . . . 0.0 106.408 -173.812 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.385 14.5 tt -125.18 -54.03 2.14 Favored 'Isoleucine or valine' 0 C--N 1.375 1.706 0 CA-C-N 120.988 1.722 . . . . 0.0 112.733 179.209 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.434 ' HA2' ' HA3' ' A' ' 41' ' ' GLY . . . . . . . . 0 C--N 1.357 1.716 0 CA-C-N 119.564 1.074 . . . . 0.0 112.168 173.84 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.491 ' NZ ' ' H ' ' A' ' 19' ' ' GLN . 4.8 tptp . . . . . 0 N--CA 1.45 -0.458 0 N-CA-C 104.898 -2.26 . . . . 0.0 104.898 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' GLN . . . . . 0.491 ' H ' ' NZ ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -145.82 102.22 3.64 Favored 'General case' 0 C--N 1.358 0.949 0 O-C-N 119.433 -2.042 . . . . 0.0 109.721 174.261 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 58.4 m-85 -93.71 147.21 23.25 Favored 'General case' 0 C--N 1.358 0.962 0 C-N-CA 127.644 2.378 . . . . 0.0 108.168 175.304 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 3.8 t -72.88 114.01 10.55 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 126.324 1.85 . . . . 0.0 115.175 -176.703 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 88.0 p -129.96 161.71 30.3 Favored 'General case' 0 C--N 1.367 1.327 0 N-CA-C 114.679 1.363 . . . . 0.0 114.679 -178.952 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' PHE . . . . . 0.413 ' HB2' ' HB2' ' A' ' 47' ' ' PHE . 91.8 m-85 -135.97 148.16 48.34 Favored 'General case' 0 CA--C 1.51 -0.594 0 N-CA-C 107.392 -1.336 . . . . 0.0 107.392 176.224 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 2.6 p90 -137.72 153.8 49.72 Favored 'General case' 0 C--N 1.358 0.945 0 C-N-CA 125.751 1.62 . . . . 0.0 108.996 176.183 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 15.7 t80 -96.32 135.81 37.66 Favored 'General case' 0 C--N 1.362 1.137 0 O-C-N 120.727 -1.233 . . . . 0.0 108.353 178.429 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.63 102.97 14.86 Favored 'General case' 0 N--CA 1.441 -0.914 0 O-C-N 121.799 -0.563 . . . . 0.0 110.813 178.882 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 10.6 t-105 -39.68 -47.02 1.95 Allowed 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 130.061 3.345 . . . . 0.0 118.196 169.484 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . 0.278 4.0 p -86.48 -23.23 26.04 Favored 'General case' 0 C--N 1.363 1.169 0 CA-C-O 118.147 -0.93 . . . . 0.0 112.774 176.875 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -82.07 -37.09 26.92 Favored 'General case' 0 C--N 1.376 1.753 0 CA-C-N 121.884 2.129 . . . . 0.0 114.854 173.705 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . 0.292 0.8 OUTLIER 81.96 22.28 0.27 Allowed 'General case' 0 C--N 1.371 1.503 0 C-N-CA 127.876 2.471 . . . . 0.0 111.8 -177.153 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 53.5 mtmt -143.94 169.68 17.34 Favored 'General case' 0 C--N 1.357 0.897 0 C-N-CA 127.174 2.189 . . . . 0.0 108.712 -177.182 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 80.0 m -91.52 145.24 24.78 Favored 'General case' 0 C--N 1.357 0.899 0 C-N-CA 127.108 2.163 . . . . 0.0 112.414 -179.452 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 31.2 mt -123.65 145.01 45.95 Favored Pre-proline 0 C--N 1.36 1.035 0 C-N-CA 125.374 1.47 . . . . 0.0 111.013 176.667 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -86.55 145.12 7.97 Favored 'Trans proline' 0 C--N 1.348 0.513 0 C-N-CA 124.492 3.462 . . . . 0.0 111.842 169.603 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . 0.273 13.5 p90 -141.27 -160.03 1.03 Allowed 'General case' 0 C--N 1.344 0.332 0 N-CA-C 105.787 -1.931 . . . . 0.0 105.787 170.896 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 58.5 mt -141.56 154.5 45.5 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 104.756 -2.313 . . . . 0.0 104.756 175.97 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 3.3 t80 -115.46 129.11 56.45 Favored 'General case' 0 CA--C 1.567 1.628 0 C-N-CA 125.457 1.503 . . . . 0.0 110.767 177.833 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 49.1 m -98.73 16.06 23.34 Favored 'General case' 0 C--N 1.382 2.01 0 N-CA-C 115.262 1.579 . . . . 0.0 115.262 -178.766 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 76.53 -56.47 3.36 Favored Glycine 0 C--N 1.352 1.469 0 O-C-N 120.133 -1.604 . . . . 0.0 116.257 178.936 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 14.4 m -79.45 34.23 0.26 Allowed 'General case' 0 C--N 1.358 0.954 0 C-N-CA 127.574 2.35 . . . . 0.0 115.666 179.744 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' GLY . . . . . 0.434 ' HA3' ' HA2' ' A' ' 14' ' ' GLY . . . 173.17 49.67 0.05 OUTLIER Glycine 0 CA--C 1.482 -1.976 0 O-C-N 120.556 -1.34 . . . . 0.0 114.078 174.607 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -104.53 128.06 9.32 Favored Glycine 0 C--N 1.354 1.572 0 N-CA-C 109.432 -1.467 . . . . 0.0 109.432 169.797 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 45.6 p30 -77.33 -57.5 3.8 Favored 'General case' 0 C--N 1.361 1.099 0 N-CA-C 116.331 1.974 . . . . 0.0 116.331 -178.668 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -177.35 -21.95 0.01 OUTLIER 'General case' 0 C--N 1.354 0.778 0 C-N-CA 126.886 2.074 . . . . 0.0 111.926 -178.286 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 39.3 t30 -96.96 89.24 4.77 Favored 'General case' 0 CA--C 1.555 1.146 0 O-C-N 119.283 -2.136 . . . . 0.0 116.416 -174.247 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . 0.355 0.0 OUTLIER -150.42 129.64 12.78 Favored 'General case' 0 C--N 1.355 0.833 0 O-C-N 120.689 -1.257 . . . . 0.0 110.42 168.033 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 47' ' ' PHE . . . . . 0.413 ' HB2' ' HB2' ' A' ' 23' ' ' PHE . 27.0 m-85 -99.89 150.98 21.83 Favored 'General case' 0 N--CA 1.447 -0.587 0 C-N-CA 126.46 1.904 . . . . 0.0 106.683 175.807 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -78.33 -38.33 42.46 Favored 'General case' 0 C--N 1.363 1.162 0 C-N-CA 125.718 1.607 . . . . 0.0 113.163 -178.299 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 75.5 p -129.95 165.31 22.36 Favored 'General case' 0 C--N 1.357 0.923 0 C-N-CA 125.189 1.395 . . . . 0.0 107.324 175.518 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 13.0 tt -71.98 -10.16 13.66 Favored 'Isoleucine or valine' 0 C--N 1.363 1.185 0 C-N-CA 126.501 1.92 . . . . 0.0 114.673 175.088 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -91.25 -10.62 62.11 Favored Glycine 0 C--N 1.365 2.181 0 O-C-N 120.178 -1.576 . . . . 0.0 114.101 176.664 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 -86.13 -41.16 14.96 Favored 'General case' 0 C--N 1.364 1.228 0 C-N-CA 125.81 1.644 . . . . 0.0 110.887 174.326 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . 0.258 4.1 t -42.51 -47.45 5.1 Favored 'General case' 0 C--N 1.365 1.267 0 C-N-CA 128.952 2.901 . . . . 0.0 116.306 -175.908 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 10.0 ptt180 -69.42 -19.79 63.79 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 129.646 3.178 . . . . 0.0 117.37 174.671 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 8.6 mptt -79.84 -6.12 56.76 Favored 'General case' 0 C--N 1.375 1.694 0 O-C-N 119.493 -2.005 . . . . 0.0 113.495 178.193 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.423 ' HD3' ' CE1' ' A' ' 6' ' ' TYR . 5.6 mtmm -111.16 -21.78 11.76 Favored 'General case' 0 C--N 1.354 0.773 0 O-C-N 120.32 -1.487 . . . . 0.0 110.38 176.816 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 57.4 m -131.3 8.38 4.66 Favored 'General case' 0 C--N 1.364 1.224 0 N-CA-C 116.736 2.125 . . . . 0.0 116.736 -171.0 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 11.6 mt -130.91 -13.51 3.6 Favored 'General case' 0 N--CA 1.476 0.85 0 CA-C-N 123.64 2.927 . . . . 0.0 111.675 172.528 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 73.52 59.68 4.04 Favored Glycine 0 C--N 1.359 1.828 0 C-N-CA 127.999 2.714 . . . . 0.0 112.863 -169.601 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 19.2 mtpt . . . . . 0 C--O 1.262 1.762 0 C-N-CA 124.721 1.208 . . . . 0.0 107.767 -178.83 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 1' ' ' TRP . . . . . 0.458 ' CZ2' ' HB3' ' A' ' 3' ' ' PRO . 4.4 t90 . . . . . 0 N--CA 1.433 -1.298 0 N-CA-C 107.456 -1.313 . . . . 0.0 107.456 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 25.0 mm-40 -147.57 150.66 37.54 Favored Pre-proline 0 C--N 1.351 0.669 1 N-CA-C 98.281 -4.711 . . . . 0.0 98.281 173.674 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 3' ' ' PRO . . . . . 0.48 ' HB2' ' HD2' ' A' ' 8' ' ' LYS . 66.2 Cg_endo -82.65 123.08 3.65 Favored 'Trans proline' 0 CA--C 1.558 1.717 0 CA-C-N 124.168 2.524 . . . . 0.0 114.906 -165.194 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 4' ' ' PRO . . . . . 0.451 ' HD3' ' HA ' ' A' ' 3' ' ' PRO . 27.7 Cg_exo -73.79 -110.31 0.01 OUTLIER 'Trans proline' 0 C--N 1.365 1.416 1 C-N-CA 126.96 5.107 . . . . 0.0 112.827 173.088 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 5' ' ' TRP . . . . . 0.55 ' CE3' ' CD2' ' A' ' 6' ' ' TYR 0.298 17.5 p-90 -88.91 -76.52 0.4 Allowed 'General case' 0 C--N 1.375 1.687 0 N-CA-C 116.419 2.007 . . . . 0.0 116.419 178.968 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.55 ' CD2' ' CE3' ' A' ' 5' ' ' TRP . 0.0 OUTLIER -29.65 -51.88 0.12 Allowed 'General case' 0 C--N 1.36 1.062 1 C-N-CA 135.173 5.389 . . . . 0.0 118.404 -171.391 . . . . . . . . 4 4 . 1 . 007 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.425 ' O ' ' HB2' ' A' ' 27' ' ' TRP . 0.0 OUTLIER -53.12 -41.65 65.25 Favored 'General case' 0 N--CA 1.443 -0.795 1 C-N-CA 131.732 4.013 . . . . 0.0 112.503 178.739 . . . . . . . . 4 4 . 1 . 007 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.48 ' HD2' ' HB2' ' A' ' 3' ' ' PRO . 0.0 OUTLIER -108.82 17.56 21.7 Favored 'General case' 0 C--N 1.367 1.362 0 C-N-CA 127.366 2.266 . . . . 0.0 111.702 -178.451 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.434 ' HA ' ' HD3' ' A' ' 10' ' ' PRO . 4.4 tp10 -93.61 133.11 28.61 Favored Pre-proline 0 C--N 1.361 1.108 0 CA-C-O 116.488 -1.72 . . . . 0.0 112.041 -173.172 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' PRO . . . . . 0.434 ' HD3' ' HA ' ' A' ' 9' ' ' GLU . 51.9 Cg_exo -70.24 125.95 12.45 Favored 'Trans proline' 0 CA--C 1.54 0.797 0 CA-C-N 125.276 2.92 . . . . 0.0 116.23 -164.73 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 10.1 p -68.9 139.73 20.04 Favored 'Isoleucine or valine' 0 C--N 1.367 1.339 0 C-N-CA 127.453 2.301 . . . . 0.0 114.041 178.582 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 61.8 mtt180 -145.73 120.61 9.97 Favored 'General case' 0 C--N 1.368 1.408 0 C-N-CA 126.297 1.839 . . . . 0.0 111.643 -173.487 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 14.4 tt -88.84 -32.33 5.8 Favored 'Isoleucine or valine' 0 C--N 1.371 1.532 0 CA-C-N 121.245 1.839 . . . . 0.0 113.783 179.691 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.351 1.393 0 C-N-CA 126.139 1.828 . . . . 0.0 115.279 179.902 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 53.8 tptt . . . . . 0 CA--C 1.519 -0.23 0 N-CA-C 101.682 -3.451 . . . . 0.0 101.682 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -118.54 105.52 11.73 Favored 'General case' 0 C--N 1.353 0.734 0 N-CA-C 106.488 -1.671 . . . . 0.0 106.488 173.181 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 22.5 m-85 -96.56 144.35 26.71 Favored 'General case' 0 C--N 1.362 1.116 0 C-N-CA 126.564 1.946 . . . . 0.0 109.77 -177.698 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 7.0 t -69.76 113.31 6.89 Favored 'General case' 0 C--N 1.369 1.441 0 N-CA-C 115.488 1.662 . . . . 0.0 115.488 -178.288 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 78.3 p -120.7 -166.25 1.31 Allowed 'General case' 0 C--N 1.359 0.988 0 C-N-CA 126.321 1.849 . . . . 0.0 113.431 -179.396 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 29.6 m-85 -148.35 149.58 32.05 Favored 'General case' 0 C--N 1.359 0.986 1 C-N-CA 131.877 4.071 . . . . 0.0 109.008 174.487 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 10.5 p90 -144.11 150.8 38.69 Favored 'General case' 0 C--N 1.362 1.113 0 C-N-CA 127.96 2.504 . . . . 0.0 110.986 175.685 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 9.2 t80 -98.24 119.1 36.32 Favored 'General case' 0 C--N 1.381 1.951 0 N-CA-C 106.916 -1.512 . . . . 0.0 106.916 177.071 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 9.4 tptt -103.74 110.44 22.54 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 125.538 1.535 . . . . 0.0 109.124 -179.256 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' TRP . . . . . 0.425 ' HB2' ' O ' ' A' ' 7' ' ' CYS . 33.2 t-105 -44.99 -49.88 10.98 Favored 'General case' 0 C--N 1.362 1.142 0 C-N-CA 131.14 3.776 . . . . 0.0 117.695 176.502 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 10.8 p -82.46 3.75 26.99 Favored 'General case' 0 C--N 1.36 1.059 0 C-N-CA 125.973 1.709 . . . . 0.0 113.617 -179.565 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -107.25 -46.49 3.87 Favored 'General case' 0 C--N 1.357 0.929 0 C-N-CA 125.604 1.562 . . . . 0.0 108.49 173.114 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . 0.309 0.2 OUTLIER 81.11 24.6 0.27 Allowed 'General case' 0 C--N 1.367 1.346 0 C-N-CA 128.845 2.858 . . . . 0.0 112.352 179.098 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 83.0 tttt -149.82 163.83 36.97 Favored 'General case' 0 N--CA 1.441 -0.902 0 N-CA-C 106.178 -1.786 . . . . 0.0 106.178 179.573 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 89.6 m -79.27 130.07 35.09 Favored 'General case' 0 C--N 1.358 0.957 0 C-N-CA 128.169 2.588 . . . . 0.0 113.927 175.805 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 80.8 mt -120.87 147.9 47.25 Favored Pre-proline 0 C--N 1.355 0.807 0 C-N-CA 124.591 1.157 . . . . 0.0 110.172 179.883 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -85.87 125.14 2.7 Favored 'Trans proline' 0 C--N 1.351 0.666 0 C-N-CA 124.454 3.436 . . . . 0.0 111.587 173.248 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -114.87 -168.86 1.44 Allowed 'General case' 0 C--N 1.354 0.764 0 N-CA-C 103.962 -2.607 . . . . 0.0 103.962 167.34 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 19.6 mt -119.25 155.82 31.05 Favored 'General case' 0 N--CA 1.441 -0.922 0 O-C-N 119.324 -2.11 . . . . 0.0 106.493 175.248 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 22.0 t80 -117.69 137.36 52.72 Favored 'General case' 0 N--CA 1.471 0.611 0 O-C-N 121.055 -1.028 . . . . 0.0 110.187 175.295 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 2.8 t -111.78 37.13 3.03 Favored 'General case' 0 C--N 1.375 1.715 0 N-CA-C 114.758 1.392 . . . . 0.0 114.758 175.721 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 72.29 -45.25 0.96 Allowed Glycine 0 C--N 1.36 1.897 0 N-CA-C 121.329 3.292 . . . . 0.0 121.329 161.986 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -116.43 165.94 12.64 Favored 'General case' 0 C--N 1.347 0.487 0 C-N-CA 126.694 1.998 . . . . 0.0 105.654 173.869 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 90.26 -33.63 4.45 Favored Glycine 0 N--CA 1.484 1.89 0 O-C-N 119.565 -1.959 . . . . 0.0 116.027 177.991 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -60.59 -174.51 1.11 Allowed Glycine 0 C--N 1.37 2.43 0 N-CA-C 120.696 3.039 . . . . 0.0 120.696 179.76 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' ASN . . . . . 0.531 ' H ' ' NH1' ' A' ' 46' ' ' ARG 0.272 26.2 p30 -136.39 -103.78 0.21 Allowed 'General case' 0 C--N 1.355 0.813 0 O-C-N 120.779 -1.424 . . . . 0.0 112.818 -179.648 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -155.33 5.03 0.21 Allowed 'General case' 0 C--N 1.35 0.627 0 O-C-N 120.873 -1.142 . . . . 0.0 113.271 -173.672 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 49.3 t30 -95.88 53.55 1.42 Allowed 'General case' 0 C--N 1.365 1.241 0 O-C-N 118.766 -2.459 . . . . 0.0 108.172 175.109 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.531 ' NH1' ' H ' ' A' ' 43' ' ' ASN . 0.0 OUTLIER -139.94 144.25 37.0 Favored 'General case' 0 N--CA 1.443 -0.798 0 N-CA-C 107.862 -1.162 . . . . 0.0 107.862 -177.463 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 52.8 m-85 -131.1 134.01 46.19 Favored 'General case' 0 N--CA 1.449 -0.494 0 C-N-CA 127.705 2.402 . . . . 0.0 107.358 -169.856 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.69 -16.93 61.67 Favored 'General case' 0 C--N 1.373 1.625 0 N-CA-C 116.699 2.111 . . . . 0.0 116.699 -177.35 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 40.9 p -146.29 -176.97 5.38 Favored 'General case' 0 C--N 1.352 0.685 0 N-CA-C 103.752 -2.684 . . . . 0.0 103.752 177.267 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 15.0 tt -76.59 -27.07 16.89 Favored 'Isoleucine or valine' 0 C--N 1.367 1.343 0 O-C-N 120.081 -1.637 . . . . 0.0 114.072 175.794 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -90.4 20.57 36.91 Favored Glycine 0 C--N 1.365 2.185 0 O-C-N 120.598 -1.314 . . . . 0.0 115.486 -171.688 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -112.87 -14.77 13.02 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 126.82 2.048 . . . . 0.0 108.587 171.51 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 15.9 t -87.07 -43.29 12.42 Favored 'General case' 0 C--N 1.361 1.067 0 C-N-CA 126.989 2.116 . . . . 0.0 115.748 -174.775 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . 0.301 0.0 OUTLIER -82.51 -24.75 33.98 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 126.623 1.969 . . . . 0.0 115.07 -175.546 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 28.2 ttmt -71.88 -15.98 62.12 Favored 'General case' 0 C--N 1.357 0.925 0 C-N-CA 127.497 2.319 . . . . 0.0 115.564 176.61 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.444 ' HD2' ' CD2' ' A' ' 6' ' ' TYR . 9.3 mtmm -100.81 -24.9 14.29 Favored 'General case' 0 C--N 1.36 1.058 0 C-N-CA 126.31 1.844 . . . . 0.0 112.357 175.458 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 43.6 m -137.54 26.68 2.82 Favored 'General case' 0 C--N 1.355 0.825 0 N-CA-C 116.935 2.198 . . . . 0.0 116.935 -167.305 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 16.7 mt -146.0 -23.73 0.45 Allowed 'General case' 0 N--CA 1.471 0.625 0 CA-C-N 120.546 1.521 . . . . 0.0 112.396 170.924 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 82.43 63.26 1.79 Allowed Glycine 0 C--N 1.36 1.904 0 C-N-CA 128.561 2.981 . . . . 0.0 112.576 -168.323 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 14.0 ptmt . . . . . 0 C--O 1.258 1.55 0 CA-C-O 116.284 -1.817 . . . . 0.0 106.723 -176.088 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 70.0 t90 . . . . . 0 N--CA 1.433 -1.281 0 N-CA-C 106.541 -1.651 . . . . 0.0 106.541 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 68.1 mt-30 -144.11 152.32 54.34 Favored Pre-proline 0 CA--C 1.512 -0.489 1 N-CA-C 97.996 -4.816 . . . . 0.0 97.996 172.352 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 3' ' ' PRO . . . . . 0.486 ' HA ' ' HD3' ' A' ' 4' ' ' PRO . 1.5 Cg_endo -79.83 122.16 4.8 Favored 'Trans proline' 0 N--CA 1.452 -0.956 0 CA-C-N 124.207 2.538 . . . . 0.0 112.618 -170.351 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 4' ' ' PRO . . . . . 0.486 ' HD3' ' HA ' ' A' ' 3' ' ' PRO . 16.2 Cg_exo -85.25 -116.08 0.01 OUTLIER 'Trans proline' 0 C--N 1.359 1.103 0 C-N-CA 124.913 3.742 . . . . 0.0 111.185 179.677 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 5' ' ' TRP . . . . . 0.501 ' CE2' ' CE2' ' A' ' 6' ' ' TYR . 42.6 p-90 -81.72 -72.53 0.43 Allowed 'General case' 0 C--N 1.375 1.68 0 C-N-CA 124.941 1.296 . . . . 0.0 114.021 -179.746 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.501 ' CE2' ' CE2' ' A' ' 5' ' ' TRP . 0.0 OUTLIER -33.35 -43.89 0.12 Allowed 'General case' 0 C--N 1.361 1.09 1 C-N-CA 134.273 5.029 . . . . 0.0 117.206 -179.853 . . . . . . . . 4 4 . 1 . 008 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.5 m -83.19 -15.72 49.39 Favored 'General case' 0 N--CA 1.44 -0.956 0 C-N-CA 127.636 2.374 . . . . 0.0 114.173 -173.728 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 67.8 mttm -125.52 32.23 5.37 Favored 'General case' 0 C--N 1.357 0.928 0 C-N-CA 126.892 2.077 . . . . 0.0 105.904 178.537 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 5.9 tm-20 -94.15 141.38 23.54 Favored Pre-proline 0 C--N 1.366 1.3 0 C-N-CA 125.106 1.362 . . . . 0.0 109.862 -176.299 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -89.84 142.37 3.97 Favored 'Trans proline' 0 N--CA 1.448 -1.16 0 C-N-CA 124.858 3.706 . . . . 0.0 108.074 177.609 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . 0.397 3.0 p -77.05 122.32 31.33 Favored 'Isoleucine or valine' 0 C--N 1.362 1.141 0 O-C-N 119.21 -2.182 . . . . 0.0 116.559 -173.659 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.476 ' HB2' HH22 ' A' ' 46' ' ' ARG . 11.0 mtm-85 -102.78 117.73 35.29 Favored 'General case' 0 N--CA 1.443 -0.809 0 C-N-CA 129.855 3.262 . . . . 0.0 109.778 -179.454 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 10.2 tt -90.52 -31.82 5.25 Favored 'Isoleucine or valine' 0 C--N 1.366 1.294 0 CA-C-N 121.103 1.774 . . . . 0.0 111.09 171.535 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.358 1.773 0 C-N-CA 123.933 0.778 . . . . 0.0 114.087 -177.621 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.503 -0.852 0 N-CA-C 100.831 -3.766 . . . . 0.0 100.831 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 7.1 mm-40 -92.82 113.25 25.47 Favored 'General case' 0 C--N 1.356 0.873 0 N-CA-C 106.699 -1.593 . . . . 0.0 106.699 -178.21 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 67.2 m-85 -106.98 141.85 37.53 Favored 'General case' 0 C--N 1.355 0.845 0 C-N-CA 125.147 1.379 . . . . 0.0 110.674 -174.435 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 24.6 t -70.5 104.62 2.81 Favored 'General case' 0 C--N 1.368 1.389 0 C-N-CA 125.704 1.602 . . . . 0.0 112.686 177.826 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 64.7 p -99.75 -161.17 0.85 Allowed 'General case' 0 C--N 1.349 0.544 0 C-N-CA 125.802 1.641 . . . . 0.0 112.151 177.866 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' PHE . . . . . 0.453 ' HA ' ' HA ' ' A' ' 34' ' ' PRO . 98.8 m-85 -148.2 132.99 17.96 Favored 'General case' 0 C--N 1.355 0.818 0 C-N-CA 127.237 2.215 . . . . 0.0 105.633 169.69 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 13.2 p90 -125.73 150.36 47.77 Favored 'General case' 0 CA--C 1.516 -0.327 0 C-N-CA 125.676 1.59 . . . . 0.0 109.638 177.414 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 10.8 t80 -91.01 118.97 30.81 Favored 'General case' 0 C--N 1.367 1.369 0 N-CA-C 103.447 -2.797 . . . . 0.0 103.447 176.921 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.94 115.86 27.98 Favored 'General case' 0 N--CA 1.431 -1.413 0 C-N-CA 123.236 0.615 . . . . 0.0 109.727 -176.895 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 48.1 t-105 -51.46 -45.75 62.83 Favored 'General case' 0 C--N 1.366 1.284 0 C-N-CA 128.628 2.771 . . . . 0.0 117.788 -178.324 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 17.3 p -84.75 -3.66 58.69 Favored 'General case' 0 C--N 1.352 0.676 0 C-N-CA 124.64 1.176 . . . . 0.0 113.778 179.922 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -100.79 -45.97 5.3 Favored 'General case' 0 C--N 1.361 1.085 0 C-N-CA 124.641 1.176 . . . . 0.0 113.631 176.675 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . 0.316 67.2 mmtt 85.15 20.55 0.11 Allowed 'General case' 0 C--N 1.368 1.383 0 C-N-CA 128.757 2.823 . . . . 0.0 112.161 -176.312 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.586 ' HZ3' ' H ' ' A' ' 32' ' ' CYS . 2.4 mmmp? -145.64 179.33 7.5 Favored 'General case' 0 C--N 1.355 0.812 0 C-N-CA 128.197 2.599 . . . . 0.0 109.979 -179.771 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.586 ' H ' ' HZ3' ' A' ' 31' ' ' LYS . 73.9 m -105.93 129.51 54.06 Favored 'General case' 0 C--N 1.358 0.977 0 C-N-CA 127.991 2.516 . . . . 0.0 115.085 -171.602 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 59.2 mt -120.37 144.55 38.45 Favored Pre-proline 0 C--N 1.357 0.916 0 O-C-N 119.707 -1.871 . . . . 0.0 110.505 -179.899 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.453 ' HA ' ' HA ' ' A' ' 23' ' ' PHE . 89.3 Cg_endo -81.39 110.19 2.19 Favored 'Trans proline' 0 C--N 1.351 0.677 0 C-N-CA 124.879 3.719 . . . . 0.0 113.797 176.414 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . 0.293 2.8 p90 -102.71 168.59 9.15 Favored 'General case' 0 C--N 1.363 1.175 0 CA-C-O 122.115 0.959 . . . . 0.0 109.751 174.644 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 61.0 mt -94.78 125.3 39.34 Favored 'General case' 0 C--N 1.351 0.634 0 N-CA-C 107.357 -1.349 . . . . 0.0 107.357 174.021 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 5.4 t80 -112.74 137.11 51.54 Favored 'General case' 0 C--N 1.35 0.603 0 C-N-CA 125.333 1.453 . . . . 0.0 109.055 179.31 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -90.77 9.97 27.92 Favored 'General case' 0 C--N 1.371 1.503 0 N-CA-C 116.758 2.132 . . . . 0.0 116.758 -177.318 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 93.4 -44.05 2.47 Favored Glycine 0 C--N 1.361 1.922 0 N-CA-C 119.056 2.383 . . . . 0.0 119.056 168.46 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -124.15 145.7 49.13 Favored 'General case' 0 C--N 1.35 0.603 0 N-CA-C 106.242 -1.762 . . . . 0.0 106.242 175.348 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 117.54 -41.06 2.16 Favored Glycine 0 C--N 1.361 1.932 0 C-N-CA 124.462 1.029 . . . . 0.0 113.744 -179.541 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -67.18 -171.23 4.9 Favored Glycine 0 C--N 1.36 1.878 0 N-CA-C 122.305 3.682 . . . . 0.0 122.305 -176.292 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' ASN . . . . . 0.475 HD22 ' CZ ' ' A' ' 12' ' ' ARG . 6.8 p30 -124.87 -115.75 0.29 Allowed 'General case' 0 C--N 1.359 1.002 0 C-N-CA 125.201 1.4 . . . . 0.0 111.214 -178.921 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -141.49 19.61 2.21 Favored 'General case' 0 C--N 1.364 1.232 0 O-C-N 119.952 -1.717 . . . . 0.0 112.483 178.271 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' ASN . . . . . 0.467 ' H ' HH11 ' A' ' 46' ' ' ARG . 49.9 t30 -91.25 36.59 0.93 Allowed 'General case' 0 CA--C 1.564 1.515 0 O-C-N 119.919 -1.738 . . . . 0.0 108.892 172.318 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.476 HH22 ' HB2' ' A' ' 12' ' ' ARG . 0.0 OUTLIER -137.91 97.81 3.5 Favored 'General case' 0 C--N 1.361 1.091 0 C-N-CA 127.839 2.456 . . . . 0.0 105.982 -178.341 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 47' ' ' PHE . . . . . 0.425 ' HB2' ' HB2' ' A' ' 23' ' ' PHE . 24.7 m-85 -94.24 153.22 18.16 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 111.679 -2.51 . . . . 0.0 111.895 -169.47 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . 0.262 0.0 OUTLIER -68.86 -43.56 75.14 Favored 'General case' 0 C--N 1.376 1.736 0 C-N-CA 125.786 1.635 . . . . 0.0 114.762 -179.806 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 72.2 p -137.88 162.28 34.42 Favored 'General case' 0 C--N 1.351 0.632 0 C-N-CA 127.996 2.518 . . . . 0.0 105.396 177.382 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 15.0 tt -66.45 -11.13 12.64 Favored 'Isoleucine or valine' 0 C--N 1.36 1.054 0 C-N-CA 127.577 2.351 . . . . 0.0 116.324 178.269 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -90.56 -9.09 65.07 Favored Glycine 0 C--N 1.367 2.295 0 C-N-CA 125.532 1.539 . . . . 0.0 114.259 174.385 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 12.8 tt0 -92.72 -14.09 28.45 Favored 'General case' 0 C--N 1.358 0.948 0 C-N-CA 125.304 1.442 . . . . 0.0 112.414 176.875 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 40.6 t -64.97 -41.28 95.58 Favored 'General case' 0 C--N 1.361 1.1 0 C-N-CA 129.137 2.975 . . . . 0.0 114.911 179.791 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 12.0 mtp180 -71.15 -21.41 62.18 Favored 'General case' 0 CA--C 1.532 0.282 1 C-N-CA 134.323 5.049 . . . . 0.0 115.767 178.595 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 49.1 mtmt -82.89 -19.79 36.69 Favored 'General case' 0 C--N 1.36 1.025 0 O-C-N 120.235 -1.541 . . . . 0.0 114.004 -178.796 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 10.6 mtmm -100.4 -30.18 11.98 Favored 'General case' 0 C--N 1.361 1.097 0 C-N-CA 126.711 2.005 . . . . 0.0 109.553 174.241 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' CYS . . . . . 0.48 ' SG ' ' HB2' ' A' ' 6' ' ' TYR . 96.3 m -124.32 10.08 8.6 Favored 'General case' 0 C--N 1.359 0.989 0 N-CA-C 119.737 3.236 . . . . 0.0 119.737 -172.654 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . 0.259 15.6 mt -131.86 -11.13 3.43 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-N 125.081 3.582 . . . . 0.0 113.065 169.233 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 70.61 52.17 17.2 Favored Glycine 0 C--N 1.365 2.179 0 C-N-CA 128.606 3.003 . . . . 0.0 113.43 -172.869 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 13.6 ptpt . . . . . 0 C--O 1.262 1.725 0 N-CA-C 104.959 -2.238 . . . . 0.0 104.959 -175.064 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 83.4 t90 . . . . . 0 N--CA 1.435 -1.182 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 23.6 mm-40 -147.35 154.58 45.68 Favored Pre-proline 0 C--N 1.352 0.683 1 N-CA-C 98.905 -4.48 . . . . 0.0 98.905 171.45 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 3' ' ' PRO . . . . . 0.487 ' HA ' ' HD3' ' A' ' 4' ' ' PRO . 3.2 Cg_exo -79.71 118.34 3.81 Favored 'Trans proline' 0 CA--C 1.541 0.844 0 CA-C-N 124.974 2.812 . . . . 0.0 114.335 -167.174 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 4' ' ' PRO . . . . . 0.487 ' HD3' ' HA ' ' A' ' 3' ' ' PRO . 14.0 Cg_exo -88.63 -109.42 0.0 OUTLIER 'Trans proline' 0 C--N 1.365 1.407 0 C-N-CA 125.045 3.83 . . . . 0.0 110.184 -175.953 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 5' ' ' TRP . . . . . 0.468 ' CE3' ' CD2' ' A' ' 6' ' ' TYR 0.272 45.1 p-90 -88.25 -72.26 0.54 Allowed 'General case' 0 C--N 1.372 1.558 0 N-CA-C 116.188 1.922 . . . . 0.0 116.188 -179.476 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.499 ' CE2' ' HD3' ' A' ' 56' ' ' LYS . 0.0 OUTLIER -30.85 -49.67 0.13 Allowed 'General case' 0 C--N 1.359 0.981 1 C-N-CA 135.672 5.589 . . . . 0.0 118.182 -175.667 . . . . . . . . 4 4 . 1 . 009 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.403 ' O ' ' HB2' ' A' ' 27' ' ' TRP . 1.8 m -57.99 -40.96 82.0 Favored 'General case' 0 C--N 1.349 0.572 0 C-N-CA 127.657 2.383 . . . . 0.0 114.116 -176.811 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 24.4 mtpp -105.55 22.26 15.8 Favored 'General case' 0 C--N 1.363 1.163 0 C-N-CA 126.283 1.833 . . . . 0.0 110.255 177.049 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -93.91 123.1 60.49 Favored Pre-proline 0 C--N 1.369 1.439 0 O-C-N 119.685 -1.885 . . . . 0.0 110.295 -174.709 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 80.3 Cg_exo -59.1 124.48 15.74 Favored 'Trans proline' 0 C--N 1.36 1.155 0 C-N-CA 124.758 3.639 . . . . 0.0 116.766 -165.023 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 9.9 p -88.02 126.66 41.45 Favored 'Isoleucine or valine' 0 C--N 1.37 1.479 0 C-N-CA 124.997 1.319 . . . . 0.0 111.328 -179.818 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.62 ' HB2' HH21 ' A' ' 46' ' ' ARG . 32.6 mtt180 -134.76 135.61 42.01 Favored 'General case' 0 N--CA 1.438 -1.047 0 C-N-CA 128.423 2.689 . . . . 0.0 111.158 -175.436 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 11.9 tt -95.41 -39.25 9.62 Favored 'Isoleucine or valine' 0 C--N 1.37 1.487 0 C-N-CA 127.428 2.291 . . . . 0.0 112.58 175.598 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.364 2.085 0 C-N-CA 128.022 2.725 . . . . 0.0 116.983 -174.229 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 14.5 ptmm? . . . . . 0 CA--C 1.506 -0.745 0 N-CA-C 103.643 -2.725 . . . . 0.0 103.643 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.6 mm100 -93.27 108.81 20.37 Favored 'General case' 0 C--N 1.358 0.941 0 O-C-N 120.397 -1.439 . . . . 0.0 110.985 -176.577 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 83.1 m-85 -95.34 155.06 16.9 Favored 'General case' 0 C--N 1.354 0.803 0 C-N-CA 126.796 2.038 . . . . 0.0 109.638 -176.2 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 11.3 t -71.08 116.3 11.21 Favored 'General case' 0 C--N 1.369 1.416 0 C-N-CA 127.095 2.158 . . . . 0.0 114.35 -178.589 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 51.5 p -141.58 171.33 14.21 Favored 'General case' 0 C--N 1.353 0.749 0 N-CA-C 114.934 1.457 . . . . 0.0 114.934 -175.038 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 82.2 m-85 -135.88 158.11 45.19 Favored 'General case' 0 C--N 1.354 0.77 0 C-N-CA 128.839 2.856 . . . . 0.0 111.853 177.709 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 23.0 p90 -147.47 156.03 42.47 Favored 'General case' 0 C--N 1.368 1.406 0 C-N-CA 126.412 1.885 . . . . 0.0 110.771 176.029 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' PHE . . . . . 0.454 ' CD2' ' HB2' ' A' ' 57' ' ' CYS . 5.4 t80 -94.82 128.53 41.63 Favored 'General case' 0 C--N 1.376 1.728 0 N-CA-C 106.334 -1.728 . . . . 0.0 106.334 172.392 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -107.42 113.66 27.16 Favored 'General case' 0 N--CA 1.426 -1.638 0 C-N-CA 126.844 2.058 . . . . 0.0 108.135 -176.709 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' TRP . . . . . 0.403 ' HB2' ' O ' ' A' ' 7' ' ' CYS . 32.0 t-105 -49.46 -55.74 12.13 Favored 'General case' 0 C--N 1.359 0.998 0 C-N-CA 130.649 3.58 . . . . 0.0 117.942 -178.27 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.9 p -77.41 -14.72 59.64 Favored 'General case' 0 C--N 1.358 0.954 0 C-N-CA 126.327 1.851 . . . . 0.0 113.503 -178.347 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -88.35 -38.59 15.01 Favored 'General case' 0 C--N 1.363 1.17 0 C-N-CA 124.359 1.064 . . . . 0.0 111.732 174.317 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 60.2 mmtt 74.24 21.51 2.44 Favored 'General case' 0 C--N 1.372 1.548 0 C-N-CA 126.964 2.105 . . . . 0.0 112.682 -179.295 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 38.2 ttpt -147.76 166.92 26.06 Favored 'General case' 0 N--CA 1.437 -1.124 0 C-N-CA 126.852 2.061 . . . . 0.0 106.967 -174.433 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 74.9 m -90.94 144.84 25.26 Favored 'General case' 0 C--N 1.361 1.07 0 C-N-CA 126.044 1.738 . . . . 0.0 112.705 178.187 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 89.3 mt -131.87 148.88 71.66 Favored Pre-proline 0 C--N 1.36 1.052 0 C-N-CA 126.855 2.062 . . . . 0.0 109.559 179.238 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -83.98 152.01 12.7 Favored 'Trans proline' 0 C--N 1.352 0.735 0 C-N-CA 124.776 3.65 . . . . 0.0 111.591 166.532 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.424 ' CZ ' ' HD2' ' A' ' 46' ' ' ARG 0.317 0.8 OUTLIER -138.49 -156.22 0.67 Allowed 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 104.085 -2.561 . . . . 0.0 104.085 170.269 . . . . . . . . 4 4 . 1 . 009 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 48.1 mt -141.08 148.75 40.66 Favored 'General case' 0 CA--C 1.502 -0.901 1 N-CA-C 99.761 -4.163 . . . . 0.0 99.761 176.241 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -124.07 135.65 53.71 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 119.705 1.139 . . . . 0.0 109.759 -178.123 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.9 m -79.68 -10.76 59.84 Favored 'General case' 0 C--N 1.369 1.437 0 N-CA-C 119.433 3.124 . . . . 0.0 119.433 -176.592 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 128.79 -59.14 0.69 Allowed Glycine 0 C--N 1.358 1.795 0 CA-C-N 121.803 2.092 . . . . 0.0 114.464 -178.087 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 30.8 p -144.15 56.82 1.32 Allowed 'General case' 0 C--N 1.35 0.594 0 C-N-CA 125.794 1.638 . . . . 0.0 106.856 -179.364 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -121.16 -48.36 0.29 Allowed Glycine 0 C--N 1.356 1.641 0 C-N-CA 125.637 1.589 . . . . 0.0 110.002 -177.936 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -83.2 153.99 31.22 Favored Glycine 0 C--N 1.361 1.928 0 N-CA-C 116.048 1.179 . . . . 0.0 116.048 177.256 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' ASN . . . . . 0.477 ' H ' ' NH2' ' A' ' 46' ' ' ARG 0.422 10.2 p30 -95.3 -101.25 0.16 Allowed 'General case' 0 CA--C 1.55 0.947 0 N-CA-C 115.676 1.732 . . . . 0.0 115.676 179.696 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -129.39 9.08 5.55 Favored 'General case' 0 C--N 1.369 1.421 0 N-CA-C 117.476 2.399 . . . . 0.0 117.476 -170.341 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 33.7 t30 -109.65 30.29 6.79 Favored 'General case' 0 C--N 1.364 1.224 0 O-C-N 119.761 -1.837 . . . . 0.0 106.642 176.223 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.62 HH21 ' HB2' ' A' ' 12' ' ' ARG . 43.2 mmt-85 -111.42 123.2 49.74 Favored 'General case' 0 C--N 1.368 1.4 0 CA-C-O 124.821 2.248 . . . . 0.0 109.702 -177.59 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 15.6 m-85 -113.55 148.28 36.41 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-N 112.207 -2.27 . . . . 0.0 112.167 -172.494 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -82.79 -27.64 30.82 Favored 'General case' 0 C--N 1.37 1.484 0 C-N-CA 125.931 1.692 . . . . 0.0 114.621 -179.85 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 61.9 p -137.65 173.54 11.54 Favored 'General case' 0 C--N 1.356 0.872 0 N-CA-C 106.588 -1.634 . . . . 0.0 106.588 177.827 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 14.0 tt -67.51 -27.96 40.37 Favored 'Isoleucine or valine' 0 C--N 1.365 1.26 0 C-N-CA 128.226 2.61 . . . . 0.0 114.764 179.003 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -94.35 5.3 70.91 Favored Glycine 0 C--N 1.361 1.947 0 O-C-N 121.251 -0.905 . . . . 0.0 114.464 -173.339 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -91.71 -21.96 20.46 Favored 'General case' 0 C--N 1.359 0.981 0 CA-C-O 122.227 1.013 . . . . 0.0 110.213 172.745 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 40.0 t -64.41 -51.75 61.65 Favored 'General case' 0 C--N 1.359 1.012 0 C-N-CA 130.101 3.36 . . . . 0.0 116.593 -178.709 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.405 ' HB3' ' HG3' ' A' ' 60' ' ' LYS . 4.4 mtp180 -68.65 -29.7 68.24 Favored 'General case' 0 C--N 1.344 0.334 1 C-N-CA 132.051 4.14 . . . . 0.0 116.915 -175.883 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 56.9 tttm -78.72 -10.15 59.66 Favored 'General case' 0 C--N 1.357 0.934 0 C-N-CA 126.625 1.97 . . . . 0.0 113.937 -179.759 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.499 ' HD3' ' CE2' ' A' ' 6' ' ' TYR . 31.6 mttt -98.4 -36.42 9.97 Favored 'General case' 0 C--N 1.359 1.004 0 C-N-CA 127.217 2.207 . . . . 0.0 111.39 175.946 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 57' ' ' CYS . . . . . 0.454 ' HB2' ' CD2' ' A' ' 25' ' ' PHE . 27.8 m -126.52 15.43 7.64 Favored 'General case' 0 C--N 1.357 0.902 0 N-CA-C 118.147 2.647 . . . . 0.0 118.147 -168.763 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 18.3 mt -140.47 -20.07 0.85 Allowed 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 122.596 2.453 . . . . 0.0 113.631 174.915 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 82.69 56.58 2.75 Favored Glycine 0 C--N 1.363 2.081 0 C-N-CA 126.794 2.14 . . . . 0.0 112.279 -172.965 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' LYS . . . . . 0.405 ' HG3' ' HB3' ' A' ' 54' ' ' ARG . 15.9 ptmt . . . . . 0 C--O 1.261 1.697 0 CA-C-O 116.62 -1.657 . . . . 0.0 107.394 -175.294 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 21.0 t90 . . . . . 0 N--CA 1.436 -1.165 0 CA-C-O 122.721 1.248 . . . . 0.0 110.397 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 80.7 mt-30 -140.23 151.99 65.94 Favored Pre-proline 0 C--N 1.357 0.896 1 N-CA-C 99.264 -4.347 . . . . 0.0 99.264 172.482 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 3' ' ' PRO . . . . . 0.447 ' HA ' ' HD3' ' A' ' 4' ' ' PRO . 4.8 Cg_exo -81.2 117.69 3.2 Favored 'Trans proline' 0 CA--C 1.551 1.341 0 CA-C-N 126.14 3.228 . . . . 0.0 117.047 -164.275 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 4' ' ' PRO . . . . . 0.447 ' HD3' ' HA ' ' A' ' 3' ' ' PRO . 17.1 Cg_exo -77.56 -117.01 0.01 OUTLIER 'Trans proline' 0 C--N 1.366 1.454 1 C-N-CA 126.003 4.469 . . . . 0.0 114.199 176.931 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 5' ' ' TRP . . . . . 0.483 ' CE2' ' CE1' ' A' ' 6' ' ' TYR . 52.0 p-90 -87.22 -68.01 0.78 Allowed 'General case' 0 C--N 1.374 1.657 0 C-N-CA 126.339 1.856 . . . . 0.0 115.011 -179.565 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.483 ' CE1' ' CE2' ' A' ' 5' ' ' TRP . 0.1 OUTLIER -31.73 -60.53 0.24 Allowed 'General case' 0 C--N 1.359 0.985 1 C-N-CA 134.296 5.038 . . . . 0.0 118.58 -173.818 . . . . . . . . 4 4 . 1 . 010 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.405 ' O ' ' HB2' ' A' ' 27' ' ' TRP . 3.3 m -52.87 -40.24 63.27 Favored 'General case' 0 CA--C 1.497 -1.07 1 C-N-CA 131.987 4.115 . . . . 0.0 116.34 -176.129 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . 0.273 57.0 tttm -113.87 22.11 14.28 Favored 'General case' 0 N--CA 1.428 -1.569 0 C-N-CA 128.385 2.674 . . . . 0.0 108.166 -174.404 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.431 ' HA ' ' HD3' ' A' ' 10' ' ' PRO . 14.6 tp10 -95.36 138.74 21.85 Favored Pre-proline 0 C--N 1.374 1.64 0 O-C-N 120.325 -1.484 . . . . 0.0 112.148 -174.327 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 10' ' ' PRO . . . . . 0.431 ' HD3' ' HA ' ' A' ' 9' ' ' GLU . 46.5 Cg_exo -70.05 110.18 2.55 Favored 'Trans proline' 0 C--N 1.363 1.333 0 C-N-CA 124.227 3.285 . . . . 0.0 112.555 -174.518 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 8.6 p -72.95 132.13 33.86 Favored 'Isoleucine or valine' 0 C--N 1.36 1.031 0 C-N-CA 128.057 2.543 . . . . 0.0 110.519 178.303 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . 0.252 41.1 mmt-85 -132.28 136.54 47.01 Favored 'General case' 0 CA--C 1.496 -1.123 0 C-N-CA 126.16 1.784 . . . . 0.0 106.645 -169.87 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.302 16.7 tt -97.67 -41.01 10.51 Favored 'Isoleucine or valine' 0 C--N 1.37 1.473 0 CA-C-N 119.924 1.238 . . . . 0.0 111.494 175.279 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.362 1.982 0 C-N-CA 124.351 0.977 . . . . 0.0 115.303 172.914 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 1.5 tpmt? . . . . . 0 N--CA 1.445 -0.711 0 CA-C-O 121.381 0.61 . . . . 0.0 109.809 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 13.8 mm-40 -147.06 112.43 5.56 Favored 'General case' 0 N--CA 1.441 -0.907 0 C-N-CA 128.767 2.827 . . . . 0.0 105.104 169.357 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 82.9 m-85 -104.63 133.02 50.18 Favored 'General case' 0 C--N 1.354 0.768 0 O-C-N 119.886 -1.759 . . . . 0.0 107.609 174.424 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' SER . . . . . 0.455 ' HA ' ' HG ' ' A' ' 36' ' ' LEU . 5.1 t -69.49 125.72 27.58 Favored 'General case' 0 C--N 1.377 1.777 0 CA-C-N 122.179 2.263 . . . . 0.0 115.337 179.831 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 4.5 p -138.49 -169.37 2.58 Favored 'General case' 0 C--N 1.352 0.691 0 C-N-CA 128.043 2.537 . . . . 0.0 111.805 -173.297 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 79.9 m-85 -140.3 153.03 46.32 Favored 'General case' 0 C--N 1.359 0.979 0 C-N-CA 129.569 3.148 . . . . 0.0 112.008 176.042 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . 0.288 4.1 p90 -144.18 163.48 33.48 Favored 'General case' 0 C--N 1.376 1.73 0 C-N-CA 127.038 2.135 . . . . 0.0 109.816 170.683 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 16.0 t80 -99.53 128.32 45.63 Favored 'General case' 0 C--N 1.369 1.418 0 C-N-CA 125.693 1.597 . . . . 0.0 108.918 -179.07 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.503 ' NZ ' ' H ' ' A' ' 28' ' ' THR . 0.0 OUTLIER -91.29 112.17 23.97 Favored 'General case' 0 C--N 1.372 1.569 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 175.25 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 27' ' ' TRP . . . . . 0.456 ' N ' ' HZ2' ' A' ' 26' ' ' LYS . 16.9 t-105 -61.29 -40.67 95.01 Favored 'General case' 0 C--N 1.349 0.552 0 C-N-CA 128.918 2.887 . . . . 0.0 115.057 177.813 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.503 ' H ' ' NZ ' ' A' ' 26' ' ' LYS 0.318 46.4 p -83.24 -25.54 31.59 Favored 'General case' 0 C--N 1.36 1.03 0 C-N-CA 123.626 0.771 . . . . 0.0 112.504 176.402 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.4 ' HB3' ' HB3' ' A' ' 26' ' ' LYS . . . -82.19 -39.76 22.69 Favored 'General case' 0 C--N 1.379 1.864 0 CA-C-N 120.826 1.648 . . . . 0.0 114.036 172.351 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . 0.274 24.3 tptt 84.09 25.77 0.1 Allowed 'General case' 0 C--N 1.365 1.269 0 C-N-CA 129.007 2.923 . . . . 0.0 113.417 178.841 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 23.6 tptp -147.39 170.39 17.46 Favored 'General case' 0 C--N 1.357 0.895 0 C-N-CA 126.035 1.734 . . . . 0.0 106.786 179.822 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 78.8 m -85.61 142.16 29.29 Favored 'General case' 0 C--N 1.355 0.824 0 C-N-CA 127.786 2.434 . . . . 0.0 113.458 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 13.8 mt -127.14 149.71 70.24 Favored Pre-proline 0 C--N 1.356 0.879 0 C-N-CA 125.566 1.547 . . . . 0.0 109.388 178.382 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 65.3 Cg_endo -82.36 154.28 16.26 Favored 'Trans proline' 0 C--N 1.348 0.55 0 C-N-CA 123.928 3.085 . . . . 0.0 111.066 164.07 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 1.4 p90 -152.35 171.76 17.52 Favored 'General case' 0 N--CA 1.448 -0.559 1 N-CA-C 99.659 -4.2 . . . . 0.0 99.659 170.899 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.455 ' HG ' ' HA ' ' A' ' 21' ' ' SER . 7.8 mp -110.65 156.98 20.23 Favored 'General case' 0 N--CA 1.44 -0.942 0 N-CA-C 105.436 -2.061 . . . . 0.0 105.436 174.001 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 3.1 t80 -119.5 130.32 55.15 Favored 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 126.609 1.964 . . . . 0.0 108.332 179.603 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 43.2 m -83.78 -33.22 25.04 Favored 'General case' 0 C--N 1.361 1.097 0 N-CA-C 115.842 1.794 . . . . 0.0 115.842 178.891 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 121.37 -67.13 0.45 Allowed Glycine 0 C--N 1.355 1.601 0 C-N-CA 125.286 1.422 . . . . 0.0 113.682 -176.57 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 18.3 p -93.78 124.23 37.64 Favored 'General case' 0 C--N 1.355 0.833 0 O-C-N 120.652 -1.499 . . . . 0.0 110.106 179.096 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 105.53 -16.11 44.95 Favored Glycine 0 C--N 1.361 1.935 0 O-C-N 121.564 -0.71 . . . . 0.0 112.616 -175.904 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -81.19 165.85 47.48 Favored Glycine 0 C--N 1.364 2.126 0 CA-C-N 118.671 1.236 . . . . 0.0 114.722 173.079 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -155.22 118.52 4.42 Favored 'General case' 0 C--N 1.36 1.058 0 N-CA-C 116.24 1.941 . . . . 0.0 116.24 -178.963 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . 41.77 -34.63 0.0 OUTLIER 'General case' 0 C--N 1.368 1.373 2 N-CA-C 124.213 4.894 . . . . 0.0 124.213 170.828 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 53.7 t30 -93.25 72.13 4.53 Favored 'General case' 0 C--N 1.36 1.047 0 C-N-CA 125.715 1.606 . . . . 0.0 109.87 -175.598 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 5.4 ptp180 -148.3 131.38 16.32 Favored 'General case' 0 CA--C 1.508 -0.671 0 CA-C-O 123.916 1.817 . . . . 0.0 108.734 176.636 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' PHE . . . . . 0.422 ' CD2' ' HA ' ' A' ' 53' ' ' CYS . 13.9 m-85 -106.34 142.24 36.33 Favored 'General case' 0 C--N 1.349 0.571 0 C-N-CA 126.696 1.998 . . . . 0.0 109.322 -174.02 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.43 -37.4 60.42 Favored 'General case' 0 C--N 1.372 1.572 0 N-CA-C 114.965 1.468 . . . . 0.0 114.965 -178.332 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 72.8 p -123.29 -179.63 4.38 Favored 'General case' 0 C--N 1.361 1.081 0 C-N-CA 127.079 2.151 . . . . 0.0 107.863 175.561 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 18.6 tt -76.77 -16.28 14.78 Favored 'Isoleucine or valine' 0 C--N 1.364 1.206 0 C-N-CA 127.91 2.484 . . . . 0.0 113.594 174.513 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -96.59 -8.28 57.39 Favored Glycine 0 C--N 1.366 2.241 0 O-C-N 120.454 -1.404 . . . . 0.0 115.252 -178.779 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 14.0 tp10 -85.87 -18.8 31.77 Favored 'General case' 0 C--N 1.362 1.147 0 C-N-CA 125.509 1.524 . . . . 0.0 111.603 175.078 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' CYS . . . . . 0.422 ' HA ' ' CD2' ' A' ' 47' ' ' PHE . 52.9 t -63.51 -61.47 2.31 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 128.312 2.645 . . . . 0.0 114.779 179.99 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 6.7 ptt180 -68.92 -13.41 62.41 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 129.953 3.301 . . . . 0.0 118.632 -177.844 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 17.6 mmtp -68.34 -52.78 29.46 Favored 'General case' 0 C--N 1.366 1.309 0 C-N-CA 126.452 1.901 . . . . 0.0 112.647 176.977 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.455 ' HD2' ' CD1' ' A' ' 6' ' ' TYR . 32.3 mtmt -68.7 -24.63 64.51 Favored 'General case' 0 C--N 1.356 0.858 0 C-N-CA 130.419 3.488 . . . . 0.0 113.623 176.971 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 90.7 m -128.37 5.39 5.73 Favored 'General case' 0 C--N 1.359 0.981 0 N-CA-C 119.166 3.024 . . . . 0.0 119.166 -170.04 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 13.5 mt -134.99 -15.58 1.99 Allowed 'General case' 0 N--CA 1.473 0.696 0 CA-C-N 123.15 2.704 . . . . 0.0 111.267 172.441 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 75.9 63.65 2.39 Favored Glycine 0 C--N 1.363 2.03 0 C-N-CA 128.252 2.834 . . . . 0.0 112.47 -168.391 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 14.2 ptmt . . . . . 0 C--O 1.262 1.724 0 CA-C-O 115.655 -2.117 . . . . 0.0 107.134 -176.442 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 5.5 t90 . . . . . 0 N--CA 1.433 -1.292 0 N-CA-C 106.014 -1.847 . . . . 0.0 106.014 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 32.4 mt-30 -139.45 148.55 56.87 Favored Pre-proline 0 C--N 1.355 0.825 1 N-CA-C 100.008 -4.071 . . . . 0.0 100.008 172.093 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -74.23 124.23 8.85 Favored 'Trans proline' 0 CA--C 1.555 1.533 0 C-N-CA 123.491 2.794 . . . . 0.0 115.516 -169.562 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 4' ' ' PRO . . . . . 0.524 ' HG2' ' CD2' ' A' ' 6' ' ' TYR . 43.2 Cg_endo -93.3 -113.4 0.0 OUTLIER 'Trans proline' 0 CA--C 1.549 1.227 1 C-N-CA 126.569 4.846 . . . . 0.0 111.174 -179.446 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 5' ' ' TRP . . . . . 0.47 ' CE3' ' CD1' ' A' ' 6' ' ' TYR 0.272 47.7 p-90 -86.49 -70.62 0.59 Allowed 'General case' 0 C--N 1.383 2.023 0 C-N-CA 126.929 2.091 . . . . 0.0 114.483 178.591 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.524 ' CD2' ' HG2' ' A' ' 4' ' ' PRO . 0.1 OUTLIER -31.72 -55.66 0.28 Allowed 'General case' 0 C--N 1.36 1.061 1 C-N-CA 133.277 4.631 . . . . 0.0 118.887 -173.663 . . . . . . . . 4 4 . 1 . 011 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 3.2 m -59.52 -33.21 71.09 Favored 'General case' 0 CA--C 1.498 -1.038 0 C-N-CA 130.215 3.406 . . . . 0.0 117.638 -173.95 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . 0.303 65.3 tttm -117.14 18.31 14.59 Favored 'General case' 0 N--CA 1.436 -1.152 0 C-N-CA 128.978 2.911 . . . . 0.0 107.958 -176.232 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.402 ' HA ' ' HD3' ' A' ' 10' ' ' PRO . 23.3 tp10 -93.64 131.46 32.24 Favored Pre-proline 0 C--N 1.366 1.291 0 O-C-N 120.398 -1.439 . . . . 0.0 112.919 -173.419 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 10' ' ' PRO . . . . . 0.402 ' HD3' ' HA ' ' A' ' 9' ' ' GLU . 77.9 Cg_exo -63.63 119.27 6.26 Favored 'Trans proline' 0 C--N 1.362 1.239 0 C-N-CA 124.368 3.379 . . . . 0.0 116.452 -167.348 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 11.1 p -69.11 141.14 17.74 Favored 'Isoleucine or valine' 0 C--N 1.359 0.989 0 C-N-CA 125.308 1.443 . . . . 0.0 114.256 178.815 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.515 ' HB2' HH22 ' A' ' 46' ' ' ARG . 9.5 mmm180 -131.07 -160.56 1.05 Allowed 'General case' 0 N--CA 1.438 -1.045 0 C-N-CA 126.06 1.744 . . . . 0.0 110.969 -174.911 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 11.1 tt -159.07 -35.8 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.427 -1.576 0 C-N-CA 128.283 2.633 . . . . 0.0 109.454 171.663 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.459 ' H ' ' NH2' ' A' ' 12' ' ' ARG . . . . . . . . 0 C--N 1.356 1.682 0 N-CA-C 108.574 -1.811 . . . . 0.0 108.574 -173.054 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 76.0 tttt . . . . . 0 CA--C 1.509 -0.615 0 N-CA-C 108.159 -1.052 . . . . 0.0 108.159 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 10.0 mp0 -100.18 122.7 43.42 Favored 'General case' 0 C--N 1.355 0.809 0 C-N-CA 125.923 1.689 . . . . 0.0 108.218 179.376 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 7.1 m-85 -110.27 134.91 51.79 Favored 'General case' 0 C--N 1.359 0.997 0 N-CA-C 104.62 -2.363 . . . . 0.0 104.62 177.909 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 3.8 t -69.36 141.02 54.29 Favored 'General case' 0 C--N 1.365 1.282 0 CA-C-N 121.809 2.095 . . . . 0.0 116.172 -175.207 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 20.1 p -138.19 -171.15 2.96 Favored 'General case' 0 C--N 1.358 0.976 0 C-N-CA 126.849 2.06 . . . . 0.0 111.108 179.385 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 -139.91 147.06 40.03 Favored 'General case' 0 C--N 1.362 1.109 0 C-N-CA 127.37 2.268 . . . . 0.0 110.709 172.577 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 9.7 p90 -137.85 162.9 32.78 Favored 'General case' 0 C--N 1.373 1.607 0 C-N-CA 126.411 1.884 . . . . 0.0 109.558 172.723 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' PHE . . . . . 0.407 ' CZ ' ' HG ' ' A' ' 58' ' ' LEU . 11.7 t80 -100.19 127.05 46.53 Favored 'General case' 0 C--N 1.362 1.11 0 O-C-N 120.598 -1.314 . . . . 0.0 107.726 179.694 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.648 ' HD2' HD11 ' A' ' 33' ' ' LEU . 36.4 tttm -86.62 104.93 16.51 Favored 'General case' 0 C--N 1.371 1.528 0 O-C-N 121.335 -0.853 . . . . 0.0 111.102 178.126 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 43.3 t-105 -52.01 -46.49 64.96 Favored 'General case' 0 C--N 1.364 1.197 0 C-N-CA 128.863 2.865 . . . . 0.0 116.811 -176.279 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 2.2 p -88.32 1.25 55.0 Favored 'General case' 0 C--N 1.349 0.57 0 C-N-CA 125.53 1.532 . . . . 0.0 113.578 179.567 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -109.87 -40.27 4.83 Favored 'General case' 0 C--N 1.36 1.057 0 O-C-N 120.95 -1.094 . . . . 0.0 111.54 176.402 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . 0.253 26.9 tptt 86.39 27.16 0.05 OUTLIER 'General case' 0 C--N 1.363 1.187 0 C-N-CA 127.953 2.501 . . . . 0.0 113.54 179.523 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 61.4 tttp -146.48 159.55 43.26 Favored 'General case' 0 C--N 1.356 0.886 0 C-N-CA 125.422 1.489 . . . . 0.0 108.102 -178.321 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 76.5 m -79.72 140.77 36.85 Favored 'General case' 0 C--N 1.364 1.214 0 C-N-CA 127.717 2.407 . . . . 0.0 112.449 177.03 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.648 HD11 ' HD2' ' A' ' 26' ' ' LYS . 19.1 mt -128.32 157.38 74.68 Favored Pre-proline 0 C--N 1.355 0.807 0 C-N-CA 126.209 1.804 . . . . 0.0 109.183 177.274 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -88.11 167.77 6.67 Favored 'Trans proline' 0 N--CA 1.455 -0.745 0 C-N-CA 123.815 3.01 . . . . 0.0 111.412 167.976 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 5.4 p90 -163.32 -176.71 4.91 Favored 'General case' 0 N--CA 1.445 -0.683 0 N-CA-C 102.005 -3.331 . . . . 0.0 102.005 172.61 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -125.21 147.01 49.26 Favored 'General case' 0 N--CA 1.423 -1.808 0 N-CA-C 104.929 -2.249 . . . . 0.0 104.929 173.916 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.404 ' CZ ' ' HA2' ' A' ' 39' ' ' GLY . 36.8 t80 -111.1 137.69 48.45 Favored 'General case' 0 CA--C 1.533 0.302 0 N-CA-C 104.607 -2.368 . . . . 0.0 104.607 173.316 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 77.5 p -104.78 -2.3 25.01 Favored 'General case' 0 C--N 1.365 1.266 0 C-N-CA 125.521 1.528 . . . . 0.0 112.386 -178.665 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' GLY . . . . . 0.404 ' HA2' ' CZ ' ' A' ' 37' ' ' PHE . . . 94.11 -59.6 2.0 Favored Glycine 0 C--N 1.356 1.643 0 O-C-N 120.029 -1.669 . . . . 0.0 115.252 170.419 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.9 m -73.09 62.27 0.63 Allowed 'General case' 0 C--N 1.354 0.802 0 C-N-CA 127.876 2.471 . . . . 0.0 116.036 -176.432 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 127.77 34.79 0.54 Allowed Glycine 0 C--N 1.357 1.737 0 N-CA-C 119.344 2.497 . . . . 0.0 119.344 168.687 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -94.31 170.98 30.49 Favored Glycine 0 C--N 1.368 2.316 0 CA-C-N 121.793 2.796 . . . . 0.0 111.524 175.937 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . 0.312 27.2 p30 -88.9 -99.17 0.09 Allowed 'General case' 0 C--N 1.365 1.262 0 N-CA-C 117.297 2.332 . . . . 0.0 117.297 -178.087 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -144.78 -9.38 0.62 Allowed 'General case' 0 C--N 1.353 0.719 0 O-C-N 120.461 -1.399 . . . . 0.0 114.175 -171.989 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 61.3 t30 -94.93 77.44 3.59 Favored 'General case' 0 C--N 1.357 0.895 0 O-C-N 119.97 -1.706 . . . . 0.0 114.313 -177.781 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.515 HH22 ' HB2' ' A' ' 12' ' ' ARG 0.406 0.0 OUTLIER -145.17 145.03 31.19 Favored 'General case' 0 C--N 1.357 0.898 0 CA-C-O 124.542 2.115 . . . . 0.0 113.745 169.229 . . . . . . . . 4 4 . 1 . 011 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 12.0 m-85 -111.32 133.68 53.47 Favored 'General case' 0 C--N 1.353 0.744 0 C-N-CA 128.025 2.53 . . . . 0.0 108.249 -177.386 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 4.2 mp0 -74.44 -55.04 6.41 Favored 'General case' 0 C--N 1.371 1.523 0 C-N-CA 126.492 1.917 . . . . 0.0 113.132 -178.095 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 9.8 p -111.69 160.79 16.93 Favored 'General case' 0 C--N 1.354 0.804 0 N-CA-C 104.958 -2.238 . . . . 0.0 104.958 174.939 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 16.4 tt -59.49 -30.13 43.81 Favored 'Isoleucine or valine' 0 C--N 1.361 1.095 0 N-CA-C 117.42 2.378 . . . . 0.0 117.42 -175.026 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -96.22 13.59 65.6 Favored Glycine 0 C--N 1.357 1.73 0 O-C-N 119.926 -1.734 . . . . 0.0 115.293 -179.168 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 16.1 tp10 -89.84 -4.58 57.52 Favored 'General case' 0 C--N 1.364 1.22 0 CA-C-O 122.899 1.333 . . . . 0.0 109.845 171.107 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 18.7 t -79.78 -39.03 31.8 Favored 'General case' 0 C--N 1.359 1.0 1 C-N-CA 132.687 4.395 . . . . 0.0 112.843 179.668 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 55.2 mtp180 -69.01 -47.31 65.8 Favored 'General case' 0 C--N 1.34 0.17 1 C-N-CA 133.925 4.89 . . . . 0.0 117.486 -178.532 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 87.3 tttt -66.94 -30.88 71.14 Favored 'General case' 0 C--N 1.362 1.13 0 C-N-CA 127.827 2.451 . . . . 0.0 113.727 -178.878 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.412 ' HD2' ' CD1' ' A' ' 6' ' ' TYR . 20.3 mtmm -87.88 -36.05 17.39 Favored 'General case' 0 C--N 1.359 1.02 0 C-N-CA 127.876 2.47 . . . . 0.0 112.192 174.636 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 97.6 m -127.04 2.82 6.52 Favored 'General case' 0 C--N 1.369 1.427 0 N-CA-C 120.725 3.602 . . . . 0.0 120.725 -171.725 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.407 ' HG ' ' CZ ' ' A' ' 25' ' ' PHE . 14.7 mt -130.4 -26.28 2.32 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 122.215 2.28 . . . . 0.0 110.756 170.365 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 88.9 52.64 2.73 Favored Glycine 0 C--N 1.361 1.963 0 C-N-CA 128.646 3.022 . . . . 0.0 111.327 -172.278 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 19.3 ptmt . . . . . 0 C--O 1.259 1.59 0 CA-C-N 118.377 1.089 . . . . 0.0 111.033 -172.934 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 84.7 t90 . . . . . 0 N--CA 1.434 -1.229 0 CA-C-O 122.149 0.976 . . . . 0.0 108.681 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 24.2 mm-40 -144.32 148.48 41.1 Favored Pre-proline 0 C--N 1.349 0.584 1 N-CA-C 98.296 -4.705 . . . . 0.0 98.296 170.733 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 3' ' ' PRO . . . . . 0.426 ' HA ' ' HD3' ' A' ' 4' ' ' PRO . 2.9 Cg_endo -74.47 120.33 6.17 Favored 'Trans proline' 0 CA--C 1.555 1.548 0 CA-C-N 124.701 2.715 . . . . 0.0 116.023 -168.511 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 4' ' ' PRO . . . . . 0.426 ' HD3' ' HA ' ' A' ' 3' ' ' PRO . 24.1 Cg_exo -77.41 -120.22 0.01 OUTLIER 'Trans proline' 0 C--N 1.369 1.657 1 C-N-CA 126.968 5.112 . . . . 0.0 113.587 175.639 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 5' ' ' TRP . . . . . 0.482 ' CE3' ' CD1' ' A' ' 6' ' ' TYR . 0.4 OUTLIER -86.66 -68.16 0.76 Allowed 'General case' 0 C--N 1.379 1.885 0 C-N-CA 126.955 2.102 . . . . 0.0 113.432 177.557 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.482 ' CD1' ' CE3' ' A' ' 5' ' ' TRP . 0.1 OUTLIER -31.13 -51.46 0.17 Allowed 'General case' 0 C--N 1.363 1.191 1 C-N-CA 133.97 4.908 . . . . 0.0 117.591 -172.844 . . . . . . . . 4 4 . 1 . 012 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.41 ' O ' ' HB2' ' A' ' 27' ' ' TRP . 2.9 m -57.87 -43.49 86.04 Favored 'General case' 0 CA--C 1.511 -0.519 0 C-N-CA 129.925 3.29 . . . . 0.0 116.007 -175.708 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 26.7 mtpp -103.8 17.38 24.23 Favored 'General case' 0 C--N 1.357 0.904 0 C-N-CA 127.231 2.212 . . . . 0.0 109.908 177.261 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.462 ' HA ' ' HD3' ' A' ' 10' ' ' PRO . 29.7 tp10 -90.22 127.06 54.76 Favored Pre-proline 0 C--N 1.361 1.072 0 O-C-N 120.468 -1.395 . . . . 0.0 112.234 -170.893 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 10' ' ' PRO . . . . . 0.462 ' HD3' ' HA ' ' A' ' 9' ' ' GLU . 50.0 Cg_exo -67.88 122.51 9.64 Favored 'Trans proline' 0 C--N 1.364 1.371 0 C-N-CA 124.08 3.186 . . . . 0.0 114.43 -165.977 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 7.8 p -69.78 134.06 30.78 Favored 'Isoleucine or valine' 0 C--N 1.357 0.918 0 C-N-CA 126.692 1.997 . . . . 0.0 112.674 -179.767 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 46.8 mtt180 -135.05 125.18 25.99 Favored 'General case' 0 C--N 1.359 0.981 0 CA-C-O 117.134 -1.412 . . . . 0.0 109.109 -175.486 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.267 17.3 tt -96.2 -38.73 8.63 Favored 'Isoleucine or valine' 0 C--N 1.37 1.486 0 CA-C-N 120.16 1.345 . . . . 0.0 112.106 175.398 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.357 1.7 0 C-N-CA 125.805 1.669 . . . . 0.0 113.846 177.348 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 16.6 tppt? . . . . . 0 N--CA 1.439 -1.024 0 N-CA-C 104.192 -2.521 . . . . 0.0 104.192 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 6.5 mp0 -147.94 118.83 7.61 Favored 'General case' 0 N--CA 1.433 -1.303 0 N-CA-C 105.054 -2.202 . . . . 0.0 105.054 171.843 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 73.5 m-85 -103.4 145.07 30.54 Favored 'General case' 0 C--N 1.353 0.723 0 N-CA-C 105.718 -1.956 . . . . 0.0 105.718 171.04 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 3.7 t -72.75 142.65 48.13 Favored 'General case' 0 C--N 1.371 1.534 0 CA-C-N 122.063 2.211 . . . . 0.0 115.146 -177.997 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 80.6 p -146.82 -169.38 3.28 Favored 'General case' 0 C--N 1.361 1.089 0 C-N-CA 125.553 1.541 . . . . 0.0 113.606 -175.948 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 62.0 m-85 -145.63 149.28 34.22 Favored 'General case' 0 C--N 1.361 1.095 0 C-N-CA 130.384 3.474 . . . . 0.0 110.777 175.929 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 9.4 p90 -143.49 154.46 43.67 Favored 'General case' 0 C--N 1.365 1.271 0 C-N-CA 127.44 2.296 . . . . 0.0 109.691 174.456 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 11.5 t80 -94.49 121.87 36.48 Favored 'General case' 0 C--N 1.371 1.523 0 N-CA-C 106.269 -1.752 . . . . 0.0 106.269 177.404 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.11 102.56 14.37 Favored 'General case' 0 N--CA 1.431 -1.383 0 CA-C-O 122.032 0.92 . . . . 0.0 110.282 178.709 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' TRP . . . . . 0.41 ' HB2' ' O ' ' A' ' 7' ' ' CYS . 14.9 t-105 -48.11 -46.36 33.99 Favored 'General case' 0 C--N 1.355 0.824 0 C-N-CA 130.26 3.424 . . . . 0.0 118.266 -174.93 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 3.0 p -79.08 -18.6 53.08 Favored 'General case' 0 C--N 1.358 0.941 0 C-N-CA 125.675 1.59 . . . . 0.0 112.98 179.191 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -87.54 -40.81 13.95 Favored 'General case' 0 C--N 1.366 1.324 0 C-N-CA 124.401 1.08 . . . . 0.0 111.18 172.936 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . 0.297 0.0 OUTLIER 77.45 30.2 0.51 Allowed 'General case' 0 C--N 1.363 1.179 0 C-N-CA 128.94 2.896 . . . . 0.0 113.41 179.349 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 53.2 tptt -148.35 167.39 25.34 Favored 'General case' 0 C--N 1.358 0.971 0 C-N-CA 127.247 2.219 . . . . 0.0 107.204 176.899 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 92.7 m -78.67 138.26 38.21 Favored 'General case' 0 C--N 1.357 0.93 0 C-N-CA 128.481 2.713 . . . . 0.0 114.822 178.971 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 12.0 mt -122.95 148.44 54.06 Favored Pre-proline 0 C--N 1.359 1.013 0 C-N-CA 125.846 1.659 . . . . 0.0 109.328 176.19 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 63.3 Cg_endo -82.8 159.5 16.2 Favored 'Trans proline' 0 CA--C 1.535 0.527 0 C-N-CA 123.115 2.543 . . . . 0.0 111.689 167.311 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . 0.317 2.0 p90 -150.97 -160.27 1.15 Allowed 'General case' 0 C--N 1.347 0.468 0 N-CA-C 104.888 -2.264 . . . . 0.0 104.888 169.796 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 18.8 mt -140.87 153.11 45.58 Favored 'General case' 0 N--CA 1.436 -1.128 0 N-CA-C 101.83 -3.396 . . . . 0.0 101.83 175.472 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -121.95 130.59 53.45 Favored 'General case' 0 N--CA 1.469 0.484 0 N-CA-C 105.071 -2.196 . . . . 0.0 105.071 178.035 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 89.3 p -77.84 -82.54 0.09 Allowed 'General case' 0 C--N 1.37 1.48 0 O-C-N 121.13 -0.981 . . . . 0.0 112.2 179.733 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 176.7 -59.6 0.1 Allowed Glycine 0 CA--C 1.488 -1.597 0 N-CA-C 108.99 -1.644 . . . . 0.0 108.99 173.565 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 20.2 p -83.73 79.42 9.47 Favored 'General case' 0 C--N 1.359 1.018 0 C-N-CA 126.692 1.997 . . . . 0.0 112.963 179.694 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 144.4 19.36 0.19 Allowed Glycine 0 C--N 1.352 1.425 0 N-CA-C 116.933 1.533 . . . . 0.0 116.933 174.557 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -71.14 176.07 38.06 Favored Glycine 0 C--N 1.366 2.204 0 N-CA-C 119.711 2.645 . . . . 0.0 119.711 175.692 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' ASN . . . . . 0.445 ' H ' ' CZ ' ' A' ' 46' ' ' ARG . 36.0 t-20 -136.76 -156.68 0.72 Allowed 'General case' 0 C--N 1.353 0.726 0 C-N-CA 125.392 1.477 . . . . 0.0 109.114 -174.596 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -99.44 -15.87 18.57 Favored 'General case' 0 C--N 1.354 0.784 0 O-C-N 120.256 -1.527 . . . . 0.0 114.261 -176.869 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 63.0 t30 -94.5 73.83 3.79 Favored 'General case' 0 C--N 1.363 1.165 0 O-C-N 119.653 -1.904 . . . . 0.0 110.396 -178.555 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.445 ' CZ ' ' H ' ' A' ' 43' ' ' ASN 0.303 0.0 OUTLIER -137.21 127.59 26.54 Favored 'General case' 0 C--N 1.352 0.704 0 CA-C-O 124.135 1.921 . . . . 0.0 109.759 172.02 . . . . . . . . 4 4 . 1 . 012 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 23.4 m-85 -108.06 142.99 37.4 Favored 'General case' 0 C--N 1.353 0.748 0 C-N-CA 127.364 2.266 . . . . 0.0 109.011 -175.248 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 32.5 mt-30 -66.12 -68.63 0.35 Allowed 'General case' 0 C--N 1.365 1.255 0 C-N-CA 128.57 2.748 . . . . 0.0 113.49 -178.544 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 40.9 p -119.12 170.65 8.88 Favored 'General case' 0 C--N 1.354 0.793 0 C-N-CA 124.955 1.302 . . . . 0.0 108.788 176.901 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 16.0 tt -58.72 -26.78 32.72 Favored 'Isoleucine or valine' 0 C--N 1.361 1.105 0 C-N-CA 128.46 2.704 . . . . 0.0 116.297 178.664 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -86.04 -16.9 62.15 Favored Glycine 0 C--N 1.36 1.88 0 O-C-N 120.282 -1.511 . . . . 0.0 116.088 175.35 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 15.2 tp10 -82.9 -25.58 32.33 Favored 'General case' 0 C--N 1.371 1.52 0 CA-C-N 120.358 2.079 . . . . 0.0 111.349 176.313 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 9.6 t -59.84 -44.6 93.99 Favored 'General case' 0 CA--C 1.559 1.293 0 C-N-CA 127.526 2.33 . . . . 0.0 115.955 177.524 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 5.4 ptt180 -82.24 -18.66 41.72 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 126.509 1.923 . . . . 0.0 113.645 178.087 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 36.1 ttmt -75.46 -16.42 60.32 Favored 'General case' 0 C--N 1.361 1.091 0 C-N-CA 126.797 2.039 . . . . 0.0 114.656 178.552 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.426 ' HD2' ' CD1' ' A' ' 6' ' ' TYR . 5.4 ttmt -103.98 -24.33 13.25 Favored 'General case' 0 C--N 1.361 1.098 0 C-N-CA 126.208 1.803 . . . . 0.0 110.82 175.985 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 57' ' ' CYS . . . . . 0.444 ' SG ' ' HB2' ' A' ' 6' ' ' TYR . 34.4 m -127.21 10.38 6.85 Favored 'General case' 0 C--N 1.364 1.21 0 N-CA-C 118.031 2.604 . . . . 0.0 118.031 -169.14 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 12.1 mt -139.34 -18.67 0.98 Allowed 'General case' 0 C--N 1.35 0.614 0 CA-C-N 121.838 2.108 . . . . 0.0 112.87 172.256 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 82.05 51.53 4.42 Favored Glycine 0 C--N 1.362 1.988 0 C-N-CA 127.589 2.518 . . . . 0.0 111.673 -171.275 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 12.8 mtpt . . . . . 0 C--O 1.262 1.743 0 C-N-CA 124.76 1.224 . . . . 0.0 108.232 -177.024 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 1' ' ' TRP . . . . . 0.5 ' CZ2' ' HB3' ' A' ' 3' ' ' PRO . 83.0 t90 . . . . . 0 N--CA 1.432 -1.338 0 N-CA-C 107.386 -1.339 . . . . 0.0 107.386 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 23.8 mp0 -144.76 148.22 38.6 Favored Pre-proline 0 C--N 1.353 0.728 1 N-CA-C 96.865 -5.235 . . . . 0.0 96.865 172.185 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 3' ' ' PRO . . . . . 0.5 ' HB3' ' CZ2' ' A' ' 1' ' ' TRP . 90.3 Cg_endo -81.08 123.23 4.47 Favored 'Trans proline' 0 CA--C 1.555 1.553 0 CA-C-N 125.702 3.072 . . . . 0.0 115.259 -165.815 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 4' ' ' PRO . . . . . 0.46 ' HD3' ' HA ' ' A' ' 3' ' ' PRO . 43.1 Cg_exo -74.52 -115.48 0.01 OUTLIER 'Trans proline' 0 CA--C 1.55 1.301 1 C-N-CA 126.751 4.967 . . . . 0.0 113.828 174.527 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 5' ' ' TRP . . . . . 0.488 ' CE3' ' CD2' ' A' ' 6' ' ' TYR . 21.7 p-90 -87.75 -72.3 0.53 Allowed 'General case' 0 C--N 1.376 1.729 0 C-N-CA 126.71 2.004 . . . . 0.0 115.01 179.882 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.488 ' CD2' ' CE3' ' A' ' 5' ' ' TRP . 0.0 OUTLIER -31.26 -53.99 0.23 Allowed 'General case' 0 C--N 1.356 0.877 1 C-N-CA 133.868 4.867 . . . . 0.0 118.065 -173.378 . . . . . . . . 4 4 . 1 . 013 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.405 ' O ' ' HB2' ' A' ' 27' ' ' TRP . 1.9 m -54.96 -33.49 62.4 Favored 'General case' 0 CA--C 1.502 -0.901 0 C-N-CA 131.444 3.897 . . . . 0.0 116.488 -176.501 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 11.7 mtpp -113.96 13.73 18.32 Favored 'General case' 0 N--CA 1.439 -0.987 0 C-N-CA 129.978 3.311 . . . . 0.0 109.891 -177.857 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.45 ' HA ' ' HD3' ' A' ' 10' ' ' PRO . 34.7 tp10 -90.67 142.37 27.81 Favored Pre-proline 0 C--N 1.364 1.209 0 O-C-N 120.74 -1.225 . . . . 0.0 114.289 -170.29 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 10' ' ' PRO . . . . . 0.45 ' HD3' ' HA ' ' A' ' 9' ' ' GLU . 51.7 Cg_exo -68.0 117.7 5.09 Favored 'Trans proline' 0 C--N 1.367 1.531 0 C-N-CA 124.682 3.588 . . . . 0.0 115.324 -173.891 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 14.5 p -69.72 128.02 32.48 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.938 0 C-N-CA 128.387 2.675 . . . . 0.0 111.885 176.138 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.433 ' HB2' HH22 ' A' ' 46' ' ' ARG . 2.2 mmp_? -142.36 122.58 13.84 Favored 'General case' 0 C--N 1.366 1.313 0 C-N-CA 125.65 1.58 . . . . 0.0 113.546 -170.708 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 12.9 tt -86.78 -42.22 15.35 Favored 'Isoleucine or valine' 0 C--N 1.376 1.757 0 C-N-CA 127.873 2.469 . . . . 0.0 115.931 -179.692 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.362 2.003 0 O-C-N 121.279 -0.888 . . . . 0.0 114.161 -173.451 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.606 ' HG3' ' H ' ' A' ' 19' ' ' GLN . 14.8 tptp . . . . . 0 CA--C 1.504 -0.811 0 N-CA-C 104.37 -2.456 . . . . 0.0 104.37 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' GLN . . . . . 0.606 ' H ' ' HG3' ' A' ' 18' ' ' LYS . 9.6 mm-40 -131.93 110.02 10.49 Favored 'General case' 0 N--CA 1.432 -1.328 0 N-CA-C 101.183 -3.636 . . . . 0.0 101.183 171.254 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 30.7 m-85 -106.83 138.45 42.98 Favored 'General case' 0 C--N 1.354 0.788 0 C-N-CA 125.794 1.638 . . . . 0.0 108.099 178.234 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' SER . . . . . 0.452 ' HA ' ' HG ' ' A' ' 36' ' ' LEU . 3.9 t -65.71 120.96 13.92 Favored 'General case' 0 C--N 1.371 1.513 0 N-CA-C 117.554 2.427 . . . . 0.0 117.554 -175.053 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -116.53 -168.24 1.42 Allowed 'General case' 0 C--N 1.37 1.487 0 C-N-CA 128.541 2.736 . . . . 0.0 111.232 177.171 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 23.6 m-85 -150.34 150.41 31.41 Favored 'General case' 0 C--N 1.355 0.835 0 C-N-CA 129.494 3.118 . . . . 0.0 108.191 174.258 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 8.9 p90 -145.14 166.14 26.28 Favored 'General case' 0 C--N 1.356 0.889 0 C-N-CA 126.325 1.85 . . . . 0.0 109.684 171.998 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' PHE . . . . . 0.44 ' CD2' ' HB2' ' A' ' 57' ' ' CYS . 19.0 t80 -98.02 125.72 43.11 Favored 'General case' 0 C--N 1.36 1.045 0 O-C-N 120.026 -1.671 . . . . 0.0 108.814 176.655 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 26.7 ttpt -85.05 103.15 13.81 Favored 'General case' 0 C--N 1.379 1.862 0 O-C-N 120.152 -1.593 . . . . 0.0 108.57 173.92 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' TRP . . . . . 0.405 ' HB2' ' O ' ' A' ' 7' ' ' CYS . 26.1 t-105 -46.07 -43.52 14.67 Favored 'General case' 0 C--N 1.358 0.951 0 C-N-CA 129.904 3.282 . . . . 0.0 117.528 -176.917 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 4.0 p -82.36 -29.83 30.71 Favored 'General case' 0 C--N 1.35 0.59 0 C-N-CA 127.787 2.435 . . . . 0.0 113.885 179.727 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -82.63 -23.69 34.18 Favored 'General case' 0 C--N 1.37 1.494 0 CA-C-N 120.935 1.698 . . . . 0.0 113.853 176.608 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . 0.261 30.5 mmmt 73.23 23.01 2.7 Favored 'General case' 0 C--N 1.367 1.328 0 C-N-CA 126.929 2.092 . . . . 0.0 112.246 -176.842 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.519 ' NZ ' HH12 ' A' ' 54' ' ' ARG . 6.8 mmtm -146.21 164.6 31.77 Favored 'General case' 0 C--N 1.365 1.246 0 C-N-CA 125.655 1.582 . . . . 0.0 112.684 -177.06 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 68.5 m -89.9 141.28 28.8 Favored 'General case' 0 C--N 1.359 1.005 0 C-N-CA 127.501 2.32 . . . . 0.0 116.321 -173.863 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 39.3 mt -127.44 145.59 55.14 Favored Pre-proline 0 C--N 1.363 1.183 0 C-N-CA 125.034 1.334 . . . . 0.0 110.741 -179.083 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 62.2 Cg_endo -84.54 143.17 9.66 Favored 'Trans proline' 0 CA--C 1.536 0.606 0 C-N-CA 123.474 2.783 . . . . 0.0 111.07 167.138 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 1.6 p90 -142.35 159.83 41.45 Favored 'General case' 0 C--N 1.349 0.569 0 N-CA-C 101.098 -3.667 . . . . 0.0 101.098 170.964 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.452 ' HG ' ' HA ' ' A' ' 21' ' ' SER . 6.9 mp -104.82 158.5 16.48 Favored 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 125.655 1.582 . . . . 0.0 107.75 178.39 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 9.0 t80 -125.55 144.2 50.67 Favored 'General case' 0 CA--C 1.557 1.228 0 C-N-CA 127.55 2.34 . . . . 0.0 110.088 179.749 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.9 t -84.86 -19.64 32.06 Favored 'General case' 0 C--N 1.376 1.724 0 N-CA-C 117.834 2.531 . . . . 0.0 117.834 -179.722 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 119.3 -30.71 5.7 Favored Glycine 0 C--N 1.361 1.966 0 C-N-CA 126.265 1.888 . . . . 0.0 116.333 172.871 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -137.23 142.85 42.05 Favored 'General case' 0 C--N 1.345 0.405 0 N-CA-C 104.756 -2.313 . . . . 0.0 104.756 173.418 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 100.8 10.53 43.05 Favored Glycine 0 C--N 1.365 2.178 0 O-C-N 121.085 -1.01 . . . . 0.0 115.429 -174.341 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -105.82 -171.33 23.51 Favored Glycine 0 C--N 1.358 1.77 0 C-N-CA 124.888 1.232 . . . . 0.0 114.446 177.012 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' ASN . . . . . 0.489 ' H ' ' CZ ' ' A' ' 46' ' ' ARG 0.311 31.8 p30 -124.3 -106.53 0.34 Allowed 'General case' 0 C--N 1.363 1.168 0 N-CA-C 116.265 1.95 . . . . 0.0 116.265 178.782 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -152.92 6.79 0.39 Allowed 'General case' 0 C--N 1.352 0.711 0 O-C-N 121.256 -0.903 . . . . 0.0 112.686 -172.042 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 55.8 t30 -104.17 46.43 0.92 Allowed 'General case' 0 C--N 1.365 1.28 0 O-C-N 120.574 -1.328 . . . . 0.0 109.406 176.264 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.489 ' CZ ' ' H ' ' A' ' 43' ' ' ASN 0.365 0.0 OUTLIER -132.1 106.93 8.3 Favored 'General case' 0 C--N 1.358 0.971 0 CA-C-O 124.468 2.08 . . . . 0.0 107.508 -179.368 . . . . . . . . 4 4 . 1 . 013 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 13.0 m-30 -93.02 149.62 21.09 Favored 'General case' 0 C--N 1.346 0.427 0 C-N-CA 128.54 2.736 . . . . 0.0 111.762 -165.573 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 35.8 mt-30 -74.73 -41.55 59.93 Favored 'General case' 0 C--N 1.37 1.495 0 N-CA-C 116.746 2.128 . . . . 0.0 116.746 -172.289 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 48.9 p -136.84 179.02 6.63 Favored 'General case' 0 C--N 1.356 0.849 0 C-N-CA 128.584 2.754 . . . . 0.0 105.54 178.55 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 18.1 tt -75.56 -17.65 15.74 Favored 'Isoleucine or valine' 0 C--N 1.37 1.463 0 O-C-N 120.42 -1.425 . . . . 0.0 113.452 175.596 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -77.25 -18.18 78.56 Favored Glycine 0 C--N 1.366 2.225 0 C-N-CA 125.704 1.621 . . . . 0.0 116.166 175.781 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -83.27 -2.17 54.98 Favored 'General case' 0 C--N 1.365 1.28 0 C-N-CA 126.371 1.868 . . . . 0.0 112.109 177.388 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 4.7 t -94.94 -24.34 17.01 Favored 'General case' 0 C--N 1.356 0.88 0 C-N-CA 128.715 2.806 . . . . 0.0 114.449 179.87 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.519 HH12 ' NZ ' ' A' ' 31' ' ' LYS . 0.0 OUTLIER -84.78 -37.91 20.24 Favored 'General case' 0 C--O 1.237 0.419 1 C-N-CA 132.393 4.277 . . . . 0.0 109.398 179.034 . . . . . . . . 4 4 . 1 . 013 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 28.0 ttmt -71.71 -28.03 63.42 Favored 'General case' 0 C--N 1.351 0.654 0 C-N-CA 129.303 3.041 . . . . 0.0 113.871 -178.285 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 27.2 mtmt -101.08 -39.18 7.82 Favored 'General case' 0 C--N 1.358 0.941 0 C-N-CA 125.094 1.358 . . . . 0.0 112.592 178.098 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' CYS . . . . . 0.44 ' HB2' ' CD2' ' A' ' 25' ' ' PHE . 99.2 m -126.49 17.22 7.59 Favored 'General case' 0 C--N 1.358 0.951 0 N-CA-C 116.98 2.215 . . . . 0.0 116.98 -170.13 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 22.5 mt -137.15 -23.05 1.15 Allowed 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 122.518 2.417 . . . . 0.0 112.682 168.666 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 86.78 48.74 4.34 Favored Glycine 0 C--N 1.367 2.268 0 C-N-CA 127.134 2.302 . . . . 0.0 111.524 -175.655 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 13.9 ptmt . . . . . 0 C--O 1.261 1.666 0 CA-C-O 118.572 -0.727 . . . . 0.0 110.544 -173.26 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 11.9 t90 . . . . . 0 N--CA 1.434 -1.239 0 CA-C-O 122.748 1.261 . . . . 0.0 109.294 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -135.75 148.91 67.32 Favored Pre-proline 0 C--N 1.351 0.659 1 N-CA-C 100.148 -4.019 . . . . 0.0 100.148 172.737 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 3' ' ' PRO . . . . . 0.433 ' HA ' ' HD3' ' A' ' 4' ' ' PRO . 1.4 Cg_endo -77.35 125.38 7.7 Favored 'Trans proline' 0 CA--C 1.554 1.495 0 CA-C-N 124.807 2.753 . . . . 0.0 115.222 -169.026 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 4' ' ' PRO . . . . . 0.521 ' HG2' ' CD2' ' A' ' 6' ' ' TYR . 38.3 Cg_endo -96.29 -116.09 0.0 OUTLIER 'Trans proline' 0 CA--C 1.549 1.239 1 C-N-CA 126.549 4.833 . . . . 0.0 110.855 -176.473 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 5' ' ' TRP . . . . . 0.471 ' CE3' ' CD1' ' A' ' 6' ' ' TYR 0.274 35.5 p-90 -85.67 -67.59 0.79 Allowed 'General case' 0 C--N 1.38 1.908 0 C-N-CA 126.496 1.918 . . . . 0.0 115.093 178.395 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.521 ' CD2' ' HG2' ' A' ' 4' ' ' PRO . 0.1 OUTLIER -32.71 -53.06 0.33 Allowed 'General case' 0 N--CA 1.48 1.071 1 C-N-CA 132.277 4.231 . . . . 0.0 119.162 -172.353 . . . . . . . . 4 4 . 1 . 014 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.7 m -60.51 -38.16 83.46 Favored 'General case' 0 N--CA 1.449 -0.514 0 C-N-CA 128.733 2.813 . . . . 0.0 113.277 -179.488 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 39.8 mtpt -104.16 14.01 31.26 Favored 'General case' 0 C--N 1.363 1.17 0 C-N-CA 129.08 2.952 . . . . 0.0 110.579 -177.71 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.425 ' HA ' ' HD3' ' A' ' 10' ' ' PRO . 3.4 tp10 -96.67 127.79 38.28 Favored Pre-proline 0 C--N 1.364 1.217 0 O-C-N 119.853 -1.779 . . . . 0.0 112.015 -172.273 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 10' ' ' PRO . . . . . 0.425 ' HD3' ' HA ' ' A' ' 9' ' ' GLU . 52.4 Cg_exo -68.16 120.85 7.81 Favored 'Trans proline' 0 C--N 1.358 1.056 0 C-N-CA 124.167 3.245 . . . . 0.0 115.093 -165.881 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 8.1 p -67.85 133.85 31.03 Favored 'Isoleucine or valine' 0 C--N 1.36 1.057 0 C-N-CA 126.568 1.947 . . . . 0.0 113.934 -179.585 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . 0.287 16.5 mmt-85 -134.49 117.9 16.74 Favored 'General case' 0 C--N 1.36 1.04 0 C-N-CA 126.611 1.964 . . . . 0.0 108.494 -171.772 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 21.1 tt -93.18 -40.25 11.74 Favored 'Isoleucine or valine' 0 C--N 1.369 1.443 0 CA-C-N 120.399 1.454 . . . . 0.0 109.453 173.387 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.36 1.895 0 C-N-CA 124.67 1.129 . . . . 0.0 114.533 175.942 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . 0.264 0.0 OUTLIER . . . . . 0 N--CA 1.451 -0.409 0 N-CA-C 104.472 -2.418 . . . . 0.0 104.472 . . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -150.11 123.48 9.0 Favored 'General case' 0 C--N 1.351 0.665 0 N-CA-C 103.643 -2.725 . . . . 0.0 103.643 175.314 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 19.6 m-85 -105.84 158.08 17.01 Favored 'General case' 0 C--N 1.36 1.024 0 C-N-CA 126.46 1.904 . . . . 0.0 106.14 177.662 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 2.6 t -82.31 144.59 30.49 Favored 'General case' 0 C--N 1.367 1.331 0 CA-C-N 122.111 2.232 . . . . 0.0 115.964 -176.247 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 61.1 p -146.77 -170.91 3.64 Favored 'General case' 0 C--N 1.364 1.197 0 C-N-CA 127.767 2.427 . . . . 0.0 112.671 -177.471 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 45.1 m-85 -141.05 152.76 45.1 Favored 'General case' 0 C--N 1.358 0.958 0 C-N-CA 129.984 3.313 . . . . 0.0 109.921 171.384 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . 0.303 2.9 p90 -144.68 158.97 43.56 Favored 'General case' 0 C--N 1.365 1.275 0 C-N-CA 126.999 2.12 . . . . 0.0 110.035 172.832 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 12.6 t80 -104.17 130.31 51.93 Favored 'General case' 0 C--N 1.365 1.263 0 N-CA-C 106.931 -1.507 . . . . 0.0 106.931 179.018 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.534 ' NZ ' ' H ' ' A' ' 28' ' ' THR . 0.0 OUTLIER -96.27 112.57 24.27 Favored 'General case' 0 N--CA 1.446 -0.671 0 C-N-CA 125.099 1.36 . . . . 0.0 110.047 179.222 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 27' ' ' TRP . . . . . 0.418 ' N ' ' HZ2' ' A' ' 26' ' ' LYS . 38.2 t-105 -50.47 -48.57 56.62 Favored 'General case' 0 C--N 1.355 0.819 0 C-N-CA 129.553 3.141 . . . . 0.0 116.494 175.007 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.534 ' H ' ' NZ ' ' A' ' 26' ' ' LYS 0.294 39.7 p -82.3 -25.7 33.73 Favored 'General case' 0 C--N 1.36 1.052 0 C-N-CA 124.471 1.109 . . . . 0.0 112.792 178.362 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -78.1 -38.9 43.01 Favored 'General case' 0 C--N 1.378 1.813 0 CA-C-N 120.779 1.627 . . . . 0.0 114.072 172.799 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . 0.301 52.5 mmtt 78.45 21.36 0.8 Allowed 'General case' 0 C--N 1.369 1.418 0 C-N-CA 128.107 2.563 . . . . 0.0 113.547 179.742 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 63.1 tttt -147.6 168.41 22.07 Favored 'General case' 0 C--N 1.355 0.835 0 C-N-CA 126.578 1.951 . . . . 0.0 106.509 -179.931 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 79.1 m -81.21 146.05 30.67 Favored 'General case' 0 C--N 1.358 0.942 0 C-N-CA 126.961 2.104 . . . . 0.0 115.745 179.894 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 12.8 mt -122.83 142.97 39.15 Favored Pre-proline 0 C--N 1.358 0.941 0 C-N-CA 125.75 1.62 . . . . 0.0 109.828 177.086 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 63.7 Cg_endo -85.6 147.32 9.68 Favored 'Trans proline' 0 C--N 1.35 0.645 0 C-N-CA 124.403 3.402 . . . . 0.0 111.077 169.181 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . 0.386 3.4 p90 -145.42 -157.73 0.82 Allowed 'General case' 0 C--N 1.352 0.695 0 CA-C-N 114.95 -1.023 . . . . 0.0 109.41 174.749 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 40.2 mt -140.31 153.85 46.6 Favored 'General case' 0 N--CA 1.436 -1.134 0 C-N-CA 128.31 2.644 . . . . 0.0 104.153 -178.598 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -137.98 127.17 24.42 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 127.817 2.447 . . . . 0.0 108.465 -178.169 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 96.7 p -83.71 4.51 28.42 Favored 'General case' 0 C--N 1.368 1.371 0 N-CA-C 119.714 3.227 . . . . 0.0 119.714 -176.247 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 88.2 -31.25 4.83 Favored Glycine 0 C--N 1.355 1.615 0 C-N-CA 129.252 3.31 . . . . 0.0 120.103 172.58 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -136.22 31.78 2.9 Favored 'General case' 0 CA--C 1.509 -0.597 0 O-C-N 121.441 -1.035 . . . . 0.0 109.931 -175.681 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -150.36 36.91 0.93 Allowed Glycine 0 C--N 1.355 1.599 0 N-CA-C 110.457 -1.057 . . . . 0.0 110.457 176.186 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -101.3 -177.42 28.84 Favored Glycine 0 C--N 1.357 1.739 0 C-N-CA 125.455 1.502 . . . . 0.0 113.99 174.72 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' ASN . . . . . 0.5 ' H ' ' NH1' ' A' ' 46' ' ' ARG 0.381 42.0 p30 -125.01 -96.0 0.45 Allowed 'General case' 0 C--N 1.356 0.891 0 O-C-N 120.945 -1.327 . . . . 0.0 111.225 174.322 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -145.3 -16.56 0.49 Allowed 'General case' 0 C--N 1.348 0.541 0 C-N-CA 125.205 1.402 . . . . 0.0 112.274 -174.984 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 50.6 t30 -94.11 74.1 4.05 Favored 'General case' 0 C--N 1.363 1.168 0 O-C-N 120.165 -1.584 . . . . 0.0 111.738 -177.939 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.5 ' NH1' ' H ' ' A' ' 43' ' ' ASN 0.295 0.0 OUTLIER -137.27 130.55 31.03 Favored 'General case' 0 C--N 1.352 0.674 0 CA-C-O 124.271 1.986 . . . . 0.0 108.868 173.638 . . . . . . . . 4 4 . 1 . 014 nuclear build core ' A' A ' 47' ' ' PHE . . . . . 0.441 ' CD2' ' HA ' ' A' ' 53' ' ' CYS . 21.7 m-85 -111.31 141.94 44.18 Favored 'General case' 0 CA--C 1.507 -0.685 0 C-N-CA 127.914 2.486 . . . . 0.0 108.598 -174.763 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 31.0 mt-30 -67.35 -64.63 0.82 Allowed 'General case' 0 C--N 1.363 1.167 0 C-N-CA 127.097 2.159 . . . . 0.0 114.609 -175.572 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 31.4 p -121.47 171.9 8.46 Favored 'General case' 0 C--N 1.353 0.743 0 C-N-CA 126.492 1.917 . . . . 0.0 107.499 177.791 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 17.7 tt -59.36 -25.71 31.73 Favored 'Isoleucine or valine' 0 C--N 1.363 1.174 0 C-N-CA 127.802 2.441 . . . . 0.0 117.227 178.78 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -88.48 -17.32 57.25 Favored Glycine 0 C--N 1.353 1.503 0 N-CA-C 116.669 1.427 . . . . 0.0 116.669 174.301 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 15.8 tp10 -70.05 -34.62 73.45 Favored 'General case' 0 C--N 1.378 1.835 0 CA-C-N 120.015 1.908 . . . . 0.0 112.016 174.547 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' CYS . . . . . 0.441 ' HA ' ' CD2' ' A' ' 47' ' ' PHE . 48.7 t -47.92 -44.17 29.67 Favored 'General case' 0 C--N 1.361 1.108 0 C-N-CA 128.575 2.75 . . . . 0.0 116.024 175.444 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 8.4 mtp85 -74.34 -26.67 60.29 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 130.964 3.705 . . . . 0.0 117.385 -179.174 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 12.5 mttp -80.34 -11.72 59.67 Favored 'General case' 0 C--N 1.364 1.225 0 C-N-CA 125.572 1.549 . . . . 0.0 114.815 -179.634 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 9.9 mtmm -103.52 -28.69 11.6 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 126.664 1.986 . . . . 0.0 109.38 175.001 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 53.6 m -125.86 6.68 7.36 Favored 'General case' 0 C--N 1.365 1.265 0 N-CA-C 119.551 3.167 . . . . 0.0 119.551 -170.502 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 16.3 mt -134.54 -15.39 2.14 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 123.435 2.834 . . . . 0.0 113.334 174.826 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 77.49 57.47 3.59 Favored Glycine 0 C--N 1.361 1.931 0 C-N-CA 128.238 2.828 . . . . 0.0 113.02 -171.443 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 16.0 ptpt . . . . . 0 C--O 1.259 1.604 0 N-CA-C 107.889 -1.152 . . . . 0.0 107.889 -176.197 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 1' ' ' TRP . . . . . 0.515 ' CZ2' ' HB3' ' A' ' 3' ' ' PRO . 81.0 t90 . . . . . 0 N--CA 1.434 -1.263 0 N-CA-C 107.099 -1.445 . . . . 0.0 107.099 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 81.2 mt-30 -149.38 149.0 28.02 Favored Pre-proline 0 C--N 1.355 0.829 1 N-CA-C 97.549 -4.982 . . . . 0.0 97.549 174.22 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 3' ' ' PRO . . . . . 0.515 ' HB3' ' CZ2' ' A' ' 1' ' ' TRP . 60.5 Cg_endo -86.95 118.84 1.48 Allowed 'Trans proline' 0 CA--C 1.557 1.635 0 CA-C-N 125.045 2.838 . . . . 0.0 115.845 -162.997 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 4' ' ' PRO . . . . . 0.445 ' HD3' ' HA ' ' A' ' 3' ' ' PRO . 30.0 Cg_exo -76.09 -110.53 0.01 OUTLIER 'Trans proline' 0 C--N 1.362 1.287 1 C-N-CA 126.552 4.834 . . . . 0.0 114.658 178.942 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 5' ' ' TRP . . . . . 0.487 ' CE3' ' CD2' ' A' ' 6' ' ' TYR 0.316 36.5 p-90 -88.46 -70.47 0.64 Allowed 'General case' 0 C--N 1.379 1.854 0 C-N-CA 126.671 1.988 . . . . 0.0 116.334 -178.695 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.487 ' CD2' ' CE3' ' A' ' 5' ' ' TRP . 0.0 OUTLIER -32.06 -55.76 0.31 Allowed 'General case' 0 C--N 1.36 1.042 1 C-N-CA 135.74 5.616 . . . . 0.0 118.07 -173.338 . . . . . . . . 4 4 . 1 . 015 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.434 ' O ' ' HB2' ' A' ' 27' ' ' TRP . 0.1 OUTLIER -55.13 -39.78 69.8 Favored 'General case' 0 N--CA 1.444 -0.769 0 C-N-CA 130.287 3.435 . . . . 0.0 114.553 -179.8 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 10.1 mtpp -105.12 13.5 30.65 Favored 'General case' 0 C--N 1.356 0.867 0 C-N-CA 127.559 2.344 . . . . 0.0 110.56 -178.074 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.436 ' HB3' ' HB2' ' A' ' 45' ' ' ASN . 3.7 tp10 -93.46 132.84 29.35 Favored Pre-proline 0 C--N 1.368 1.385 0 O-C-N 120.012 -1.68 . . . . 0.0 112.458 -171.884 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 10' ' ' PRO . . . . . 0.4 ' HD3' ' HA ' ' A' ' 9' ' ' GLU . 53.4 Cg_exo -66.46 122.71 10.2 Favored 'Trans proline' 0 C--N 1.359 1.091 0 C-N-CA 124.054 3.17 . . . . 0.0 116.88 -165.957 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 8.4 p -72.52 132.53 33.27 Favored 'Isoleucine or valine' 0 C--N 1.36 1.026 0 C-N-CA 125.882 1.673 . . . . 0.0 111.743 175.924 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . 0.251 1.6 mmp_? -146.41 124.43 12.07 Favored 'General case' 0 C--N 1.353 0.751 0 CA-C-O 115.063 -2.399 . . . . 0.0 112.956 -168.822 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.278 6.5 tt -88.44 -35.16 7.63 Favored 'Isoleucine or valine' 0 C--N 1.384 2.097 0 CA-C-N 124.922 3.51 . . . . 0.0 115.179 177.64 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.358 1.764 0 N-CA-C 117.388 1.715 . . . . 0.0 117.388 175.081 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.548 ' HG3' ' H ' ' A' ' 19' ' ' GLN . 20.5 tptp . . . . . 0 CA--C 1.509 -0.596 0 N-CA-C 102.025 -3.324 . . . . 0.0 102.025 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' GLN . . . . . 0.548 ' H ' ' HG3' ' A' ' 18' ' ' LYS . 23.4 mp0 -133.75 113.23 12.08 Favored 'General case' 0 N--CA 1.438 -1.068 0 N-CA-C 101.983 -3.34 . . . . 0.0 101.983 170.979 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 33.1 m-85 -107.18 141.66 38.11 Favored 'General case' 0 C--N 1.355 0.845 0 O-C-N 120.484 -1.385 . . . . 0.0 107.921 179.65 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.7 t -66.39 122.65 18.01 Favored 'General case' 0 C--N 1.372 1.573 0 N-CA-C 117.695 2.48 . . . . 0.0 117.695 -176.619 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 1.2 t -120.73 -175.68 3.08 Favored 'General case' 0 C--N 1.363 1.159 0 C-N-CA 129.157 2.983 . . . . 0.0 109.175 -178.881 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 37.0 m-85 -146.12 141.62 27.71 Favored 'General case' 0 C--N 1.349 0.56 0 C-N-CA 129.854 3.262 . . . . 0.0 104.312 170.716 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 16.0 p90 -124.57 148.87 47.56 Favored 'General case' 0 C--N 1.358 0.967 0 N-CA-C 107.499 -1.297 . . . . 0.0 107.499 172.102 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 10.4 t80 -94.76 126.11 39.86 Favored 'General case' 0 C--N 1.363 1.189 0 N-CA-C 104.129 -2.545 . . . . 0.0 104.129 175.639 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -100.0 113.32 25.82 Favored 'General case' 0 N--CA 1.425 -1.682 0 C-N-CA 125.569 1.548 . . . . 0.0 108.85 -175.232 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' TRP . . . . . 0.434 ' HB2' ' O ' ' A' ' 7' ' ' CYS . 45.8 t-105 -53.54 -46.96 70.38 Favored 'General case' 0 C--N 1.361 1.097 0 C-N-CA 129.544 3.138 . . . . 0.0 117.457 -177.922 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 11.0 p -83.49 -5.54 59.19 Favored 'General case' 0 C--N 1.353 0.749 0 C-N-CA 124.542 1.137 . . . . 0.0 113.604 179.456 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -97.06 -47.93 5.59 Favored 'General case' 0 C--N 1.363 1.188 0 C-N-CA 124.819 1.247 . . . . 0.0 111.868 174.993 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . 0.294 0.7 OUTLIER 83.45 26.38 0.11 Allowed 'General case' 0 C--N 1.366 1.287 0 C-N-CA 127.672 2.389 . . . . 0.0 112.489 -178.333 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 7.8 tmtm? -147.78 164.22 34.3 Favored 'General case' 0 C--N 1.356 0.868 0 C-N-CA 128.008 2.523 . . . . 0.0 107.344 179.197 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 64.6 m -81.98 118.81 23.27 Favored 'General case' 0 C--N 1.363 1.195 0 C-N-CA 129.739 3.216 . . . . 0.0 114.606 178.831 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 29.6 mt -105.26 145.73 31.35 Favored Pre-proline 0 C--N 1.354 0.8 0 O-C-N 119.83 -1.794 . . . . 0.0 111.203 177.924 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 69.2 Cg_endo -86.92 144.28 7.24 Favored 'Trans proline' 0 N--CA 1.46 -0.452 0 C-N-CA 123.129 2.552 . . . . 0.0 112.245 173.481 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -149.03 171.16 16.83 Favored 'General case' 0 N--CA 1.444 -0.755 0 N-CA-C 101.338 -3.579 . . . . 0.0 101.338 170.255 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 8.4 mp -111.72 156.23 22.23 Favored 'General case' 0 N--CA 1.449 -0.519 0 C-N-CA 125.967 1.707 . . . . 0.0 106.882 178.398 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 8.3 t80 -116.95 139.69 50.35 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 127.137 2.175 . . . . 0.0 112.157 -179.104 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.3 t -92.76 -4.97 52.18 Favored 'General case' 0 C--N 1.377 1.786 0 N-CA-C 117.401 2.371 . . . . 0.0 117.401 178.291 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 106.21 -44.04 1.56 Allowed Glycine 0 C--N 1.366 2.197 0 CA-C-N 120.908 1.686 . . . . 0.0 116.541 170.856 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -133.69 139.37 46.38 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 103.634 -2.728 . . . . 0.0 103.634 177.322 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 103.09 -12.2 55.69 Favored Glycine 0 C--N 1.358 1.775 0 O-C-N 121.329 -0.857 . . . . 0.0 113.606 -173.75 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -102.93 177.24 25.27 Favored Glycine 0 C--N 1.361 1.922 0 C-N-CA 127.707 2.575 . . . . 0.0 112.622 177.052 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 15.1 p30 -119.72 -100.13 0.44 Allowed 'General case' 0 C--N 1.365 1.269 0 N-CA-C 115.446 1.647 . . . . 0.0 115.446 179.241 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -158.75 17.87 0.2 Allowed 'General case' 0 C--N 1.363 1.19 0 N-CA-C 114.981 1.475 . . . . 0.0 114.981 -172.155 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' ASN . . . . . 0.436 ' HB2' ' HB3' ' A' ' 9' ' ' GLU . 36.6 t30 -106.69 55.64 0.66 Allowed 'General case' 0 C--N 1.366 1.315 0 N-CA-C 104.401 -2.444 . . . . 0.0 104.401 172.47 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 7.0 ptp180 -144.07 105.31 4.24 Favored 'General case' 0 CA--C 1.5 -0.95 0 CA-C-O 124.721 2.201 . . . . 0.0 106.442 -172.08 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 18.4 m-85 -107.14 133.53 51.61 Favored 'General case' 0 N--CA 1.434 -1.241 0 CA-C-N 111.87 -2.423 . . . . 0.0 109.04 -169.849 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 30.9 mt-30 -55.23 -40.0 70.37 Favored 'General case' 0 C--N 1.355 0.845 0 C-N-CA 130.221 3.409 . . . . 0.0 116.605 -177.223 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 81.9 p -136.3 174.08 11.01 Favored 'General case' 0 C--N 1.356 0.862 0 C-N-CA 127.551 2.341 . . . . 0.0 107.656 178.163 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 18.6 tt -68.32 -13.04 16.52 Favored 'Isoleucine or valine' 0 C--N 1.36 1.049 0 C-N-CA 129.36 3.064 . . . . 0.0 116.883 177.58 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -99.61 -25.27 9.36 Favored Glycine 0 C--N 1.353 1.501 0 N-CA-C 116.72 1.448 . . . . 0.0 116.72 176.646 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -68.79 -21.77 64.31 Favored 'General case' 0 N--CA 1.491 1.611 0 CA-C-N 120.254 2.027 . . . . 0.0 113.188 176.509 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 22.7 t -70.84 -23.7 62.38 Favored 'General case' 0 CA--C 1.557 1.222 0 C-N-CA 129.105 2.962 . . . . 0.0 113.593 173.659 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 47.3 mtm180 -86.07 -30.79 22.32 Favored 'General case' 0 C--N 1.354 0.8 0 N-CA-C 116.719 2.118 . . . . 0.0 116.719 -175.102 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 84.1 tttt -77.29 -10.12 59.24 Favored 'General case' 0 C--N 1.369 1.439 0 C-N-CA 126.397 1.879 . . . . 0.0 113.6 -177.509 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 31.6 mtmt -102.06 -30.38 11.21 Favored 'General case' 0 N--CA 1.442 -0.856 0 C-N-CA 126.648 1.979 . . . . 0.0 114.132 -178.878 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' CYS . . . . . 0.43 ' SG ' ' HB2' ' A' ' 6' ' ' TYR . 47.3 m -139.4 25.46 2.43 Favored 'General case' 0 C--N 1.36 1.031 0 O-C-N 120.652 -1.28 . . . . 0.0 114.275 -166.644 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 18.3 mt -145.98 -27.62 0.43 Allowed 'General case' 0 C--N 1.345 0.405 0 O-C-N 120.625 -1.297 . . . . 0.0 111.735 174.436 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 86.61 57.58 2.06 Favored Glycine 0 C--N 1.364 2.094 0 C-N-CA 126.739 2.114 . . . . 0.0 112.706 -173.169 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 15.6 ptmt . . . . . 0 C--O 1.262 1.754 0 N-CA-C 106.433 -1.691 . . . . 0.0 106.433 -176.274 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 84.8 t90 . . . . . 0 N--CA 1.436 -1.166 0 CA-C-O 122.141 0.972 . . . . 0.0 108.496 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 18.6 mm-40 -143.92 149.73 47.08 Favored Pre-proline 0 N--CA 1.442 -0.844 1 N-CA-C 98.596 -4.594 . . . . 0.0 98.596 170.486 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 23.7 Cg_endo -71.88 123.27 9.2 Favored 'Trans proline' 0 CA--C 1.559 1.761 0 C-N-CA 123.655 2.903 . . . . 0.0 114.747 -170.092 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.528 ' HG2' ' CD2' ' A' ' 6' ' ' TYR . 43.7 Cg_endo -92.07 -113.93 0.0 OUTLIER 'Trans proline' 0 CA--C 1.543 0.931 1 C-N-CA 127.263 5.309 . . . . 0.0 110.196 -178.006 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 5' ' ' TRP . . . . . 0.443 ' CE3' ' CD1' ' A' ' 6' ' ' TYR . 4.6 p-90 -85.55 -70.46 0.59 Allowed 'General case' 0 C--N 1.38 1.911 0 C-N-CA 126.817 2.047 . . . . 0.0 114.48 177.029 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.528 ' CD2' ' HG2' ' A' ' 4' ' ' PRO . 0.1 OUTLIER -31.18 -52.27 0.19 Allowed 'General case' 0 C--N 1.365 1.24 1 C-N-CA 132.992 4.517 . . . . 0.0 118.411 -170.811 . . . . . . . . 4 4 . 1 . 001 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 2.3 m -58.75 -40.31 83.49 Favored 'General case' 0 C--N 1.35 0.613 0 C-N-CA 127.567 2.347 . . . . 0.0 114.633 -177.334 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 27.8 mtpp -98.24 15.21 25.17 Favored 'General case' 0 C--N 1.359 0.993 0 C-N-CA 125.9 1.68 . . . . 0.0 111.533 177.616 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 16.9 tt0 -92.27 125.42 56.45 Favored Pre-proline 0 C--N 1.364 1.199 0 O-C-N 119.176 -2.202 . . . . 0.0 110.735 -173.518 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_exo -62.21 145.36 96.22 Favored 'Trans proline' 0 CA--C 1.547 1.126 0 C-N-CA 124.28 3.32 . . . . 0.0 117.508 -169.525 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 7.8 p -79.74 130.88 35.37 Favored 'Isoleucine or valine' 0 C--N 1.369 1.417 0 C-N-CA 123.48 0.712 . . . . 0.0 110.673 174.086 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 22.8 mmt85 -128.91 133.4 47.87 Favored 'General case' 0 C--N 1.35 0.617 0 N-CA-C 104.736 -2.32 . . . . 0.0 104.736 -173.543 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.315 19.4 tt -99.02 -45.04 12.18 Favored 'Isoleucine or valine' 0 C--N 1.369 1.414 0 CA-C-N 122.769 2.531 . . . . 0.0 111.355 175.577 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 93.32 -169.55 30.58 Favored Glycine 0 C--N 1.358 1.761 0 C-N-CA 124.438 1.018 . . . . 0.0 111.348 -170.353 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 57.7 m -156.58 102.75 2.07 Favored 'General case' 0 C--N 1.357 0.904 0 O-C-N 118.257 -2.908 . . . . 0.0 113.418 -178.76 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 2.9 p -168.25 146.53 4.34 Favored 'General case' 0 C--N 1.352 0.677 0 N-CA-C 103.513 -2.773 . . . . 0.0 103.513 175.663 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 41.4 mmtm -77.74 44.36 0.45 Allowed 'General case' 0 C--N 1.359 1.014 0 N-CA-C 121.033 3.716 . . . . 0.0 121.033 -165.035 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 25.6 tttp -149.11 141.7 24.4 Favored 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 103.381 -2.822 . . . . 0.0 103.381 171.598 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -126.19 134.08 51.36 Favored 'General case' 0 C--N 1.357 0.917 0 CA-C-N 121.746 2.066 . . . . 0.0 107.766 178.386 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 25.8 m-85 -107.29 146.03 32.01 Favored 'General case' 0 C--N 1.356 0.851 0 C-N-CA 128.094 2.558 . . . . 0.0 109.215 177.093 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.8 t -70.4 136.73 49.85 Favored 'General case' 0 C--N 1.371 1.532 0 N-CA-C 117.902 2.556 . . . . 0.0 117.902 -175.717 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 33.9 p -145.63 161.36 40.01 Favored 'General case' 0 C--N 1.359 1.009 0 C-N-CA 124.79 1.236 . . . . 0.0 113.787 -176.577 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' PHE . . . . . 0.408 ' HB2' ' HB2' ' A' ' 47' ' ' PHE . 94.3 m-85 -132.49 134.65 45.29 Favored 'General case' 0 C--N 1.343 0.303 0 C-N-CA 126.121 1.768 . . . . 0.0 107.479 177.048 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 29.2 p90 -114.95 144.18 43.99 Favored 'General case' 0 C--N 1.366 1.294 0 N-CA-C 106.772 -1.566 . . . . 0.0 106.772 175.725 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' PHE . . . . . 0.451 ' HA ' ' HA ' ' A' ' 32' ' ' CYS . 11.9 t80 -89.55 119.12 29.7 Favored 'General case' 0 C--N 1.374 1.646 0 CA-C-N 122.274 2.306 . . . . 0.0 105.692 -179.467 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.542 ' NZ ' ' H ' ' A' ' 28' ' ' THR . 0.5 OUTLIER -89.03 116.41 27.29 Favored 'General case' 0 N--CA 1.429 -1.5 0 C-N-CA 125.303 1.441 . . . . 0.0 109.577 -176.71 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -64.99 -39.63 93.75 Favored 'General case' 0 C--N 1.343 0.317 0 N-CA-C 118.332 2.716 . . . . 0.0 118.332 -172.84 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.542 ' H ' ' NZ ' ' A' ' 26' ' ' LYS . 17.4 p -89.89 -2.86 58.28 Favored 'General case' 0 C--N 1.359 0.98 0 O-C-N 120.523 -1.36 . . . . 0.0 111.496 176.498 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -96.64 -46.88 6.14 Favored 'General case' 0 C--N 1.364 1.22 0 C-N-CA 125.196 1.398 . . . . 0.0 114.183 175.997 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . 0.296 18.8 tptt 89.3 19.42 0.04 OUTLIER 'General case' 0 C--N 1.368 1.385 0 C-N-CA 126.778 2.031 . . . . 0.0 113.333 -178.242 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 8.1 ptpp? -147.86 169.4 19.9 Favored 'General case' 0 C--N 1.352 0.698 0 C-N-CA 126.486 1.914 . . . . 0.0 108.237 176.728 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.451 ' HA ' ' HA ' ' A' ' 25' ' ' PHE . 74.0 m -90.86 141.33 28.93 Favored 'General case' 0 C--N 1.367 1.357 0 O-C-N 120.513 -1.367 . . . . 0.0 111.668 175.941 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.2 mt -110.93 146.03 33.63 Favored Pre-proline 0 C--N 1.347 0.48 0 N-CA-C 107.77 -1.196 . . . . 0.0 107.77 178.913 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 69.3 Cg_endo -86.58 149.52 8.76 Favored 'Trans proline' 0 N--CA 1.458 -0.606 0 C-N-CA 123.882 3.055 . . . . 0.0 112.797 -179.758 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 5.9 p90 -146.0 -161.52 1.33 Allowed 'General case' 0 N--CA 1.444 -0.774 0 N-CA-C 104.462 -2.422 . . . . 0.0 104.462 171.713 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 84.9 mt -141.96 148.23 38.27 Favored 'General case' 0 N--CA 1.433 -1.321 0 N-CA-C 101.048 -3.686 . . . . 0.0 101.048 173.815 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.412 ' CZ ' ' HA2' ' A' ' 39' ' ' GLY . 2.9 t80 -109.77 138.09 46.63 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 127.497 2.319 . . . . 0.0 106.44 176.925 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 51.8 m -78.62 -43.05 27.26 Favored 'General case' 0 C--N 1.373 1.601 0 CA-C-O 122.935 1.35 . . . . 0.0 111.899 178.615 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' GLY . . . . . 0.412 ' HA2' ' CZ ' ' A' ' 37' ' ' PHE . . . 125.12 -51.8 0.82 Allowed Glycine 0 C--N 1.349 1.265 0 C-N-CA 125.953 1.74 . . . . 0.0 109.772 -175.43 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 8.0 m -80.27 65.61 5.49 Favored 'General case' 0 C--N 1.357 0.903 0 N-CA-C 116.758 2.133 . . . . 0.0 116.758 -175.156 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 128.82 57.79 0.11 Allowed Glycine 0 C--N 1.37 2.425 0 N-CA-C 118.812 2.285 . . . . 0.0 118.812 173.325 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -103.2 -159.87 25.26 Favored Glycine 0 C--N 1.37 2.434 0 CA-C-N 119.992 1.896 . . . . 0.0 114.423 174.585 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' ASN . . . . . 0.568 ' H ' ' NH1' ' A' ' 46' ' ' ARG 0.304 46.9 p30 -136.93 -106.6 0.2 Allowed 'General case' 0 C--N 1.356 0.854 0 O-C-N 121.303 -1.116 . . . . 0.0 111.351 -179.809 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -167.75 29.32 0.03 OUTLIER 'General case' 0 C--N 1.355 0.805 0 C-N-CA 124.49 1.116 . . . . 0.0 111.888 -177.734 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 51.9 t-20 -105.94 34.26 3.4 Favored 'General case' 0 C--N 1.37 1.482 0 N-CA-C 105.442 -2.058 . . . . 0.0 105.442 173.523 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.568 ' NH1' ' H ' ' A' ' 43' ' ' ASN . 0.8 OUTLIER -121.91 110.6 16.06 Favored 'General case' 0 C--N 1.358 0.949 0 CA-C-O 125.172 2.415 . . . . 0.0 111.272 -172.554 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 47' ' ' PHE . . . . . 0.41 ' CE1' ' HE3' ' A' ' 56' ' ' LYS . 84.6 m-85 -92.59 127.23 38.01 Favored 'General case' 0 N--CA 1.445 -0.71 0 C-N-CA 129.569 3.148 . . . . 0.0 106.622 179.729 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.92 -17.35 59.79 Favored 'General case' 0 C--N 1.37 1.49 0 N-CA-C 117.025 2.232 . . . . 0.0 117.025 -173.982 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 31.2 p -142.74 171.49 13.98 Favored 'General case' 0 C--N 1.357 0.917 0 N-CA-C 102.649 -3.093 . . . . 0.0 102.649 175.989 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 6.7 tt -85.67 7.43 2.09 Favored 'Isoleucine or valine' 0 C--N 1.363 1.163 0 O-C-N 119.648 -1.907 . . . . 0.0 113.407 176.297 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -97.75 -13.82 42.46 Favored Glycine 0 C--N 1.362 2.012 0 O-C-N 119.596 -1.94 . . . . 0.0 113.498 178.024 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -85.87 -29.8 23.41 Favored 'General case' 0 C--N 1.359 0.99 0 C-N-CA 126.533 1.933 . . . . 0.0 110.114 175.363 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 6.8 t -37.75 -58.4 0.91 Allowed 'General case' 0 C--N 1.372 1.584 1 C-N-CA 133.302 4.641 . . . . 0.0 116.362 179.654 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.69 -12.11 60.9 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 130.399 3.479 . . . . 0.0 116.836 -178.778 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -86.26 -12.04 50.69 Favored 'General case' 0 C--N 1.368 1.392 0 O-C-N 119.8 -1.813 . . . . 0.0 114.458 -176.863 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.41 ' HE3' ' CE1' ' A' ' 47' ' ' PHE . 18.7 mtmt -105.02 -34.13 8.09 Favored 'General case' 0 C--N 1.352 0.68 0 C-N-CA 125.525 1.53 . . . . 0.0 110.53 177.572 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 17.8 m -124.17 15.49 9.12 Favored 'General case' 0 C--N 1.358 0.956 0 N-CA-C 117.236 2.31 . . . . 0.0 117.236 -169.073 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 15.0 mt -137.37 -26.55 0.99 Allowed 'General case' 0 N--CA 1.472 0.656 0 O-C-N 119.349 -2.095 . . . . 0.0 112.981 175.507 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 85.4 55.06 2.67 Favored Glycine 0 C--N 1.363 2.052 0 C-N-CA 127.911 2.672 . . . . 0.0 112.86 -171.922 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 8.6 ptpt . . . . . 0 C--O 1.263 1.774 0 CA-C-O 116.26 -1.828 . . . . 0.0 106.539 -178.229 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 20.8 t90 . . . . . 0 N--CA 1.432 -1.35 0 N-CA-C 106.224 -1.769 . . . . 0.0 106.224 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 37.1 mt-30 -143.42 143.25 23.36 Favored Pre-proline 0 C--N 1.351 0.648 1 N-CA-C 99.034 -4.432 . . . . 0.0 99.034 175.128 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.436 ' HA ' ' HD3' ' A' ' 4' ' ' PRO . 28.8 Cg_endo -72.37 114.86 4.12 Favored 'Trans proline' 0 CA--C 1.555 1.528 0 C-N-CA 124.776 3.65 . . . . 0.0 117.846 -165.623 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.436 ' HD3' ' HA ' ' A' ' 3' ' ' PRO . 33.3 Cg_exo -77.76 -115.88 0.01 OUTLIER 'Trans proline' 0 C--N 1.371 1.722 1 C-N-CA 127.201 5.267 . . . . 0.0 114.428 177.318 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 5' ' ' TRP . . . . . 0.467 ' CE2' ' CE2' ' A' ' 6' ' ' TYR . 5.0 p-90 -85.44 -68.87 0.7 Allowed 'General case' 0 C--N 1.38 1.902 0 C-N-CA 128.129 2.572 . . . . 0.0 114.874 -178.164 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.467 ' CE2' ' CE2' ' A' ' 5' ' ' TRP . 0.1 OUTLIER -31.67 -56.98 0.28 Allowed 'General case' 0 CA--C 1.492 -1.288 1 C-N-CA 133.717 4.807 . . . . 0.0 116.989 -172.222 . . . . . . . . 4 4 . 1 . 002 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -56.53 -44.52 80.91 Favored 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 129.158 2.983 . . . . 0.0 115.239 -178.109 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 45.8 mttm -93.18 -13.94 27.77 Favored 'General case' 0 C--N 1.358 0.943 0 C-N-CA 128.921 2.889 . . . . 0.0 113.638 -177.662 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.439 ' HA ' ' HD3' ' A' ' 10' ' ' PRO . 0.1 OUTLIER -71.41 135.6 84.14 Favored Pre-proline 0 C--N 1.361 1.074 0 C-N-CA 127.581 2.352 . . . . 0.0 113.25 -175.06 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.439 ' HD3' ' HA ' ' A' ' 9' ' ' GLU . 72.0 Cg_exo -65.63 131.01 26.41 Favored 'Trans proline' 0 C--N 1.358 1.077 0 C-N-CA 124.232 3.288 . . . . 0.0 118.959 -167.119 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 8.2 p -77.33 124.39 35.65 Favored 'Isoleucine or valine' 0 C--N 1.368 1.395 0 C-N-CA 127.825 2.45 . . . . 0.0 113.912 175.535 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -147.37 133.12 18.94 Favored 'General case' 0 C--N 1.367 1.344 0 C-N-CA 126.951 2.1 . . . . 0.0 112.906 -174.228 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.287 7.2 tt -88.26 -48.4 15.0 Favored 'Isoleucine or valine' 0 C--N 1.372 1.562 0 N-CA-C 117.619 2.451 . . . . 0.0 117.619 179.795 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 83.94 -167.21 43.66 Favored Glycine 0 C--N 1.364 2.122 0 N-CA-C 117.411 1.724 . . . . 0.0 117.411 -170.231 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 17.8 m -171.24 76.03 0.06 Allowed 'General case' 0 C--N 1.361 1.084 0 O-C-N 119.695 -2.062 . . . . 0.0 105.816 179.389 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 2.8 t -125.13 -71.76 0.69 Allowed 'General case' 0 C--N 1.354 0.79 0 CA-C-N 114.677 -1.147 . . . . 0.0 111.869 -174.784 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 31.1 mmmt -96.7 -80.08 0.44 Allowed 'General case' 0 C--N 1.349 0.553 0 C-N-CA 124.179 0.992 . . . . 0.0 112.835 -174.609 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 12.0 ptmm? -146.87 -145.61 0.17 Allowed 'General case' 0 CA--C 1.503 -0.843 0 N-CA-C 102.328 -3.212 . . . . 0.0 102.328 178.608 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 5.1 mm100 -126.04 112.35 15.77 Favored 'General case' 0 N--CA 1.438 -1.058 0 N-CA-C 100.475 -3.898 . . . . 0.0 100.475 170.333 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 50.0 m-85 -94.4 144.23 25.73 Favored 'General case' 0 C--N 1.364 1.224 0 C-N-CA 126.385 1.874 . . . . 0.0 108.804 -179.654 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 4.9 t -67.54 112.74 4.87 Favored 'General case' 0 C--N 1.367 1.333 0 C-N-CA 126.723 2.009 . . . . 0.0 115.918 -175.764 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 4.6 p -120.26 -167.11 1.4 Allowed 'General case' 0 C--N 1.365 1.248 0 CA-C-O 123.263 1.506 . . . . 0.0 112.924 177.611 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 14.8 m-85 -148.99 136.82 20.58 Favored 'General case' 0 N--CA 1.446 -0.667 0 C-N-CA 129.236 3.014 . . . . 0.0 103.706 170.846 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 9.9 p90 -119.57 152.06 37.63 Favored 'General case' 0 C--N 1.364 1.216 0 CA-C-N 123.074 2.67 . . . . 0.0 109.684 173.102 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 19.6 t80 -94.01 121.66 35.71 Favored 'General case' 0 C--N 1.363 1.158 0 N-CA-C 106.45 -1.685 . . . . 0.0 106.45 -179.157 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.487 ' HD3' HD11 ' A' ' 33' ' ' LEU . 4.9 ttpp -90.9 108.59 19.94 Favored 'General case' 0 C--N 1.367 1.35 0 C-N-CA 123.48 0.712 . . . . 0.0 109.109 176.235 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 11.1 t-105 -52.09 -38.95 58.96 Favored 'General case' 0 C--N 1.355 0.823 0 C-N-CA 128.68 2.792 . . . . 0.0 117.1 -177.925 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 2.1 p -79.42 -30.09 42.17 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 129.686 3.194 . . . . 0.0 113.486 -179.397 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -86.1 -37.31 18.95 Favored 'General case' 0 C--N 1.365 1.273 0 C-N-CA 124.72 1.208 . . . . 0.0 111.473 177.748 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . 0.326 1.5 tptp 80.01 26.39 0.34 Allowed 'General case' 0 C--N 1.361 1.082 0 C-N-CA 127.693 2.397 . . . . 0.0 112.801 -178.621 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.5 tmtt? -147.52 177.27 9.39 Favored 'General case' 0 C--N 1.363 1.171 0 C-N-CA 125.827 1.651 . . . . 0.0 110.87 175.476 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 61.8 m -93.17 122.53 35.65 Favored 'General case' 0 C--N 1.363 1.161 0 C-N-CA 129.043 2.937 . . . . 0.0 114.394 -175.731 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.487 HD11 ' HD3' ' A' ' 26' ' ' LYS . 19.2 mt -104.42 142.44 24.63 Favored Pre-proline 0 C--N 1.358 0.96 0 CA-C-O 117.83 -1.081 . . . . 0.0 109.971 177.536 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 96.9 Cg_endo -82.12 127.62 5.39 Favored 'Trans proline' 0 CA--C 1.531 0.334 0 C-N-CA 123.878 3.052 . . . . 0.0 112.273 175.541 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . 0.261 0.2 OUTLIER -141.39 177.45 8.1 Favored 'General case' 0 C--N 1.35 0.621 0 N-CA-C 102.325 -3.213 . . . . 0.0 102.325 169.512 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 1.1 mp -117.88 165.56 13.53 Favored 'General case' 0 N--CA 1.44 -0.96 0 C-N-CA 125.27 1.428 . . . . 0.0 107.263 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.429 ' CE2' ' HA2' ' A' ' 39' ' ' GLY . 30.3 t80 -123.01 136.52 54.88 Favored 'General case' 0 CA--C 1.551 1.011 0 C-N-CA 125.578 1.551 . . . . 0.0 112.071 178.882 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.9 t -88.08 -24.6 23.38 Favored 'General case' 0 C--N 1.38 1.9 0 CA-C-N 122.073 2.215 . . . . 0.0 114.315 173.422 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' GLY . . . . . 0.429 ' HA2' ' CE2' ' A' ' 37' ' ' PHE . . . 118.23 -58.66 0.51 Allowed Glycine 0 C--N 1.361 1.93 0 C-N-CA 125.78 1.657 . . . . 0.0 114.166 175.411 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -102.81 115.91 31.52 Favored 'General case' 0 C--N 1.351 0.635 0 C-N-CA 126.307 1.843 . . . . 0.0 106.654 178.721 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 134.46 -45.86 1.09 Allowed Glycine 0 CA--C 1.49 -1.528 0 N-CA-C 109.861 -1.296 . . . . 0.0 109.861 -174.435 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -93.45 -165.93 37.71 Favored Glycine 0 C--N 1.36 1.907 0 O-C-N 121.13 -1.217 . . . . 0.0 113.932 173.263 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . 0.392 3.9 p30 -134.37 -99.81 0.25 Allowed 'General case' 0 C--N 1.353 0.734 0 O-C-N 121.177 -1.19 . . . . 0.0 113.466 179.916 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -150.79 24.4 0.76 Allowed 'General case' 0 C--N 1.374 1.635 0 N-CA-C 117.022 2.23 . . . . 0.0 117.022 -171.059 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' ASN . . . . . 0.581 ' H ' HH11 ' A' ' 46' ' ' ARG . 40.2 t30 -101.7 48.2 0.89 Allowed 'General case' 0 N--CA 1.491 1.587 0 N-CA-C 105.106 -2.183 . . . . 0.0 105.106 171.458 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.581 HH11 ' H ' ' A' ' 45' ' ' ASN . 0.0 OUTLIER -146.3 118.42 8.3 Favored 'General case' 0 CA--C 1.492 -1.276 0 N-CA-C 104.275 -2.491 . . . . 0.0 104.275 -176.131 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 47' ' ' PHE . . . . . 0.446 ' CD2' ' HA ' ' A' ' 53' ' ' CYS . 21.8 m-85 -107.23 129.41 54.87 Favored 'General case' 0 N--CA 1.429 -1.49 0 C-N-CA 127.681 2.392 . . . . 0.0 107.524 -165.261 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 23.4 mp0 -70.06 -30.45 67.71 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 126.249 1.82 . . . . 0.0 115.558 -169.107 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 1.4 p -146.21 168.3 21.37 Favored 'General case' 0 C--N 1.352 0.696 0 N-CA-C 104.272 -2.492 . . . . 0.0 104.272 176.268 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 2.3 tt -84.23 138.31 19.4 Favored 'Isoleucine or valine' 0 C--N 1.37 1.484 0 C-N-CA 125.576 1.55 . . . . 0.0 108.246 176.288 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 117.17 -50.06 0.82 Allowed Glycine 0 C--N 1.364 2.105 0 N-CA-C 107.49 -2.244 . . . . 0.0 107.49 -157.367 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 16.2 tp10 -77.71 -20.03 54.24 Favored 'General case' 0 C--N 1.366 1.324 0 N-CA-C 115.813 1.783 . . . . 0.0 115.813 -178.297 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' CYS . . . . . 0.446 ' HA ' ' CD2' ' A' ' 47' ' ' PHE . 52.7 t -77.57 -42.03 36.75 Favored 'General case' 0 C--N 1.361 1.094 0 C-N-CA 128.509 2.723 . . . . 0.0 112.882 177.923 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 72.5 mtm180 -74.52 -45.73 43.85 Favored 'General case' 0 N--CA 1.447 -0.609 1 C-N-CA 133.732 4.813 . . . . 0.0 112.466 179.96 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 69.8 tttt -82.63 55.03 2.83 Favored 'General case' 0 C--N 1.373 1.609 0 CA-C-O 123.616 1.674 . . . . 0.0 111.852 174.198 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 22.1 mtmt -167.77 -47.03 0.02 OUTLIER 'General case' 0 N--CA 1.444 -0.763 0 C-N-CA 129.977 3.311 . . . . 0.0 105.171 -178.547 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' CYS . . . . . 0.441 ' SG ' ' HB2' ' A' ' 6' ' ' TYR . 56.3 m -121.65 7.87 10.03 Favored 'General case' 0 C--N 1.357 0.914 0 N-CA-C 119.579 3.178 . . . . 0.0 119.579 -172.942 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 18.7 mt -133.83 -8.6 2.75 Favored 'General case' 0 N--CA 1.481 1.115 0 CA-C-N 125.646 3.839 . . . . 0.0 114.066 175.288 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 67.82 59.35 6.61 Favored Glycine 0 C--N 1.359 1.832 0 C-N-CA 128.262 2.839 . . . . 0.0 113.863 -171.449 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 2.5 ptpp? . . . . . 0 C--O 1.264 1.824 0 N-CA-C 102.366 -3.198 . . . . 0.0 102.366 -175.396 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' TRP . . . . . 0.508 ' CZ2' ' HB3' ' A' ' 3' ' ' PRO . 9.6 t90 . . . . . 0 N--CA 1.433 -1.32 0 N-CA-C 108.076 -1.083 . . . . 0.0 108.076 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 16.6 mm-40 -142.02 150.09 54.78 Favored Pre-proline 0 C--N 1.353 0.758 1 N-CA-C 98.382 -4.673 . . . . 0.0 98.382 171.07 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.508 ' HB3' ' CZ2' ' A' ' 1' ' ' TRP . 87.5 Cg_endo -80.76 132.79 8.91 Favored 'Trans proline' 0 CA--C 1.563 1.933 0 CA-C-N 124.291 2.568 . . . . 0.0 113.455 -166.8 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.508 ' HG2' ' CD2' ' A' ' 6' ' ' TYR . 44.7 Cg_endo -94.46 -113.22 0.0 OUTLIER 'Trans proline' 0 CA--C 1.546 1.119 1 C-N-CA 127.114 5.209 . . . . 0.0 110.784 -178.053 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 5' ' ' TRP . . . . . 0.433 ' CE3' ' CD1' ' A' ' 6' ' ' TYR 0.265 52.7 p-90 -86.98 -69.71 0.66 Allowed 'General case' 0 C--N 1.384 2.103 0 C-N-CA 128.097 2.559 . . . . 0.0 114.926 178.902 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.508 ' CD2' ' HG2' ' A' ' 4' ' ' PRO . 0.0 OUTLIER -32.8 -51.59 0.3 Allowed 'General case' 0 C--N 1.368 1.386 1 C-N-CA 132.472 4.309 . . . . 0.0 117.575 -174.168 . . . . . . . . 4 4 . 1 . 003 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 3.0 m -60.75 -28.7 68.9 Favored 'General case' 0 CA--C 1.507 -0.708 0 C-N-CA 129.275 3.03 . . . . 0.0 118.127 -175.305 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . 0.25 61.2 tttm -118.41 17.72 13.74 Favored 'General case' 0 C--N 1.355 0.81 0 C-N-CA 128.276 2.63 . . . . 0.0 108.487 -178.218 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.478 ' HA ' ' HD3' ' A' ' 10' ' ' PRO . 22.9 tp10 -94.86 127.78 41.9 Favored Pre-proline 0 C--N 1.36 1.041 0 O-C-N 119.263 -2.148 . . . . 0.0 112.722 -173.428 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.478 ' HD3' ' HA ' ' A' ' 9' ' ' GLU . 38.2 Cg_exo -72.99 140.9 32.22 Favored 'Trans proline' 0 C--N 1.352 0.746 0 C-N-CA 123.903 3.069 . . . . 0.0 113.45 -169.814 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -81.41 153.07 4.18 Favored 'Isoleucine or valine' 0 C--N 1.362 1.109 0 N-CA-C 115.426 1.639 . . . . 0.0 115.426 178.871 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -147.0 119.8 8.65 Favored 'General case' 0 N--CA 1.438 -1.034 0 C-N-CA 125.369 1.468 . . . . 0.0 111.14 -178.281 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.285 11.7 tt -74.02 -40.7 52.25 Favored 'Isoleucine or valine' 0 C--N 1.357 0.894 0 N-CA-C 115.413 1.634 . . . . 0.0 115.413 175.829 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 124.21 -166.38 16.81 Favored Glycine 0 C--N 1.352 1.419 0 N-CA-C 109.617 -1.393 . . . . 0.0 109.617 -178.933 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 15.4 m -106.3 -5.32 19.2 Favored 'General case' 0 C--N 1.357 0.925 0 N-CA-C 115.272 1.582 . . . . 0.0 115.272 -179.109 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 81.4 m -111.03 170.48 8.08 Favored 'General case' 0 C--N 1.359 1.008 0 O-C-N 119.871 -1.768 . . . . 0.0 110.355 -178.808 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 4.2 mmmp? -111.05 58.27 0.62 Allowed 'General case' 0 C--N 1.356 0.87 0 C-N-CA 125.432 1.493 . . . . 0.0 110.707 177.007 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 38.3 ttmt -134.25 124.97 26.81 Favored 'General case' 0 CA--C 1.504 -0.823 1 N-CA-C 99.545 -4.243 . . . . 0.0 99.545 174.394 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -130.31 128.04 40.71 Favored 'General case' 0 C--N 1.354 0.768 0 C-N-CA 123.873 0.869 . . . . 0.0 112.339 -170.071 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 26.8 m-85 -112.04 135.33 52.82 Favored 'General case' 0 C--N 1.358 0.966 0 C-N-CA 127.294 2.238 . . . . 0.0 107.7 177.184 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' SER . . . . . 0.483 ' HA ' ' HG ' ' A' ' 36' ' ' LEU 0.277 4.0 t -69.26 132.31 46.27 Favored 'General case' 0 C--N 1.375 1.684 0 N-CA-C 116.492 2.034 . . . . 0.0 116.492 -177.133 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 3.2 p -146.06 -172.08 3.85 Favored 'General case' 0 N--CA 1.448 -0.538 0 C-N-CA 127.633 2.373 . . . . 0.0 110.312 -173.029 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 48.6 m-85 -145.27 153.37 41.22 Favored 'General case' 0 C--N 1.35 0.628 0 C-N-CA 128.631 2.772 . . . . 0.0 110.733 177.083 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . 0.251 12.5 p90 -131.98 154.93 48.83 Favored 'General case' 0 C--N 1.373 1.624 0 C-N-CA 125.292 1.437 . . . . 0.0 108.671 168.106 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 16.2 t80 -94.97 111.88 23.63 Favored 'General case' 0 C--N 1.365 1.268 0 O-C-N 119.716 -1.865 . . . . 0.0 107.966 -179.477 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -83.38 107.03 15.62 Favored 'General case' 0 C--N 1.363 1.195 0 O-C-N 120.366 -1.459 . . . . 0.0 111.83 -176.51 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 41.1 t-105 -46.05 -53.59 9.95 Favored 'General case' 0 C--N 1.357 0.931 1 C-N-CA 132.155 4.182 . . . . 0.0 117.746 -171.546 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.5 p -81.27 -15.74 54.63 Favored 'General case' 0 C--N 1.353 0.723 0 C-N-CA 126.657 1.983 . . . . 0.0 113.084 179.686 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -88.79 -37.63 15.27 Favored 'General case' 0 C--N 1.366 1.299 0 C-N-CA 124.175 0.99 . . . . 0.0 112.044 174.304 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . 0.301 12.0 mmmm 77.25 27.03 0.68 Allowed 'General case' 0 C--N 1.366 1.309 0 C-N-CA 129.562 3.145 . . . . 0.0 113.327 -178.519 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 52.1 pttt -146.45 163.97 33.97 Favored 'General case' 0 C--N 1.355 0.811 0 C-N-CA 125.807 1.643 . . . . 0.0 110.502 -179.572 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 89.4 m -80.48 126.34 31.09 Favored 'General case' 0 C--N 1.359 0.991 0 C-N-CA 128.308 2.643 . . . . 0.0 115.222 -177.247 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 13.2 mt -112.19 147.58 37.26 Favored Pre-proline 0 C--N 1.36 1.039 0 O-C-N 120.461 -1.4 . . . . 0.0 108.725 176.298 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -86.57 142.54 7.02 Favored 'Trans proline' 0 C--N 1.344 0.311 1 C-N-CA 125.542 4.161 . . . . 0.0 111.444 170.976 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -145.7 165.12 29.68 Favored 'General case' 0 N--CA 1.439 -0.993 1 N-CA-C 98.313 -4.699 . . . . 0.0 98.313 169.691 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.483 ' HG ' ' HA ' ' A' ' 21' ' ' SER . 7.8 mp -109.72 149.93 29.04 Favored 'General case' 0 N--CA 1.44 -0.942 0 N-CA-C 104.428 -2.434 . . . . 0.0 104.428 174.922 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -100.51 138.15 37.96 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 126.953 2.101 . . . . 0.0 109.129 176.598 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 9.2 t -107.66 119.0 38.21 Favored 'General case' 0 C--N 1.363 1.179 0 N-CA-C 104.585 -2.376 . . . . 0.0 104.585 171.521 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -68.93 19.58 0.43 Allowed Glycine 0 N--CA 1.479 1.515 0 C-N-CA 127.681 2.563 . . . . 0.0 119.134 -178.397 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 78.7 m -114.12 56.22 0.72 Allowed 'General case' 0 C--N 1.354 0.791 0 C-N-CA 128.943 2.897 . . . . 0.0 108.825 172.355 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 118.29 54.77 0.28 Allowed Glycine 0 C--N 1.359 1.842 0 N-CA-C 120.367 2.907 . . . . 0.0 120.367 171.107 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -86.47 -176.72 49.62 Favored Glycine 0 C--N 1.37 2.466 0 CA-C-N 121.48 2.64 . . . . 0.0 116.412 175.12 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' ASN . . . . . 0.5 ' H ' ' CZ ' ' A' ' 46' ' ' ARG 0.355 30.2 p30 -113.07 -112.88 0.34 Allowed 'General case' 0 C--N 1.362 1.136 0 O-C-N 119.923 -1.927 . . . . 0.0 114.435 179.887 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -141.64 -9.31 0.94 Allowed 'General case' 0 C--N 1.354 0.761 0 O-C-N 120.406 -1.434 . . . . 0.0 112.894 -174.814 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 61.7 t30 -101.53 57.2 0.84 Allowed 'General case' 0 C--N 1.365 1.261 0 O-C-N 120.19 -1.568 . . . . 0.0 109.969 -179.409 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.5 ' CZ ' ' H ' ' A' ' 43' ' ' ASN 0.37 0.0 OUTLIER -131.06 130.53 43.35 Favored 'General case' 0 CA--C 1.498 -1.033 0 CA-C-O 124.415 2.055 . . . . 0.0 110.197 178.292 . . . . . . . . 4 4 . 1 . 003 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 10.5 m-85 -114.75 131.42 56.78 Favored 'General case' 0 C--N 1.35 0.593 0 C-N-CA 128.388 2.675 . . . . 0.0 106.894 -177.258 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -85.99 -27.08 25.07 Favored 'General case' 0 C--N 1.371 1.523 0 CA-C-N 121.62 2.009 . . . . 0.0 115.579 -177.311 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 23.9 p -125.19 155.72 39.57 Favored 'General case' 0 C--N 1.351 0.667 0 N-CA-C 104.8 -2.296 . . . . 0.0 104.8 177.497 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 16.4 tt -58.87 -32.17 46.59 Favored 'Isoleucine or valine' 0 C--N 1.36 1.046 0 N-CA-C 117.347 2.351 . . . . 0.0 117.347 -177.621 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' GLY . . . . . 0.404 ' HA2' ' HD3' ' A' ' 54' ' ' ARG . . . -91.37 1.68 76.84 Favored Glycine 0 C--N 1.358 1.782 0 O-C-N 120.187 -1.571 . . . . 0.0 115.795 178.222 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 15.6 tp10 -82.28 -20.23 37.93 Favored 'General case' 0 C--N 1.365 1.248 0 O-C-N 120.896 -1.355 . . . . 0.0 110.67 170.774 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 19.7 t -72.12 -30.19 64.82 Favored 'General case' 0 C--N 1.363 1.162 0 C-N-CA 129.07 2.948 . . . . 0.0 112.86 175.573 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.404 ' HD3' ' HA2' ' A' ' 51' ' ' GLY . 43.8 mtp180 -76.16 -48.56 20.12 Favored 'General case' 0 C--N 1.355 0.81 0 C-N-CA 127.697 2.399 . . . . 0.0 114.875 176.461 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 30.8 ttmt -82.15 59.92 4.67 Favored 'General case' 0 C--N 1.361 1.075 0 C-N-CA 127.809 2.444 . . . . 0.0 111.841 -174.266 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.421 ' HG2' ' CZ ' ' A' ' 6' ' ' TYR . 23.9 mtmt -179.62 -39.81 0.01 OUTLIER 'General case' 0 N--CA 1.439 -0.993 0 C-N-CA 130.854 3.662 . . . . 0.0 106.09 -176.11 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' CYS . . . . . 0.409 ' O ' ' CZ2' ' A' ' 1' ' ' TRP . 67.7 m -125.01 7.38 7.98 Favored 'General case' 0 C--N 1.364 1.238 0 N-CA-C 119.862 3.282 . . . . 0.0 119.862 -170.503 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 14.7 mt -140.58 -8.97 1.09 Allowed 'General case' 0 N--CA 1.476 0.834 0 CA-C-N 124.124 3.147 . . . . 0.0 114.466 169.713 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 71.41 51.32 17.42 Favored Glycine 0 C--N 1.356 1.654 0 C-N-CA 128.107 2.765 . . . . 0.0 113.395 -171.923 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 12.3 ptpt . . . . . 0 C--O 1.26 1.629 0 N-CA-C 103.707 -2.701 . . . . 0.0 103.707 -174.195 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 23.3 t90 . . . . . 0 N--CA 1.433 -1.297 0 N-CA-C 108.254 -1.017 . . . . 0.0 108.254 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 23.5 mm-40 -144.14 144.06 24.7 Favored Pre-proline 0 C--N 1.353 0.726 0 N-CA-C 100.482 -3.895 . . . . 0.0 100.482 174.927 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 19.9 Cg_endo -72.69 122.59 8.34 Favored 'Trans proline' 0 CA--C 1.557 1.631 0 CA-C-N 124.782 2.744 . . . . 0.0 116.441 -169.257 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.487 ' HG2' ' CD2' ' A' ' 6' ' ' TYR . 38.2 Cg_endo -91.78 -123.15 0.01 OUTLIER 'Trans proline' 0 CA--C 1.555 1.533 1 C-N-CA 127.034 5.156 . . . . 0.0 111.81 178.694 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 5' ' ' TRP . . . . . 0.469 ' CE3' ' CD1' ' A' ' 6' ' ' TYR 0.336 54.7 p-90 -73.09 -74.14 0.18 Allowed 'General case' 0 C--N 1.384 2.076 0 C-N-CA 126.521 1.928 . . . . 0.0 114.44 178.538 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.487 ' CD2' ' HG2' ' A' ' 4' ' ' PRO . 0.1 OUTLIER -32.04 -51.46 0.24 Allowed 'General case' 0 C--N 1.363 1.169 1 C-N-CA 132.183 4.193 . . . . 0.0 117.469 -175.619 . . . . . . . . 4 4 . 1 . 004 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.428 ' O ' ' HB2' ' A' ' 27' ' ' TRP . 1.1 m -71.5 -8.01 51.19 Favored 'General case' 0 CA--C 1.51 -0.587 0 C-N-CA 129.885 3.274 . . . . 0.0 115.747 -176.902 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 47.8 mttp -134.81 11.63 3.67 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 128.118 2.567 . . . . 0.0 107.242 -179.604 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.408 ' HA ' ' HD3' ' A' ' 10' ' ' PRO . 34.9 tp10 -96.85 134.42 23.08 Favored Pre-proline 0 C--N 1.364 1.228 0 N-CA-C 115.092 1.515 . . . . 0.0 115.092 -167.849 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.408 ' HD3' ' HA ' ' A' ' 9' ' ' GLU . 72.0 Cg_exo -66.35 121.1 8.32 Favored 'Trans proline' 0 C--N 1.365 1.433 0 C-N-CA 124.707 3.604 . . . . 0.0 116.182 -169.495 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 14.3 p -69.39 136.46 26.2 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.908 0 C-N-CA 127.642 2.377 . . . . 0.0 112.885 177.584 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 61.6 mtp180 -146.33 126.09 13.46 Favored 'General case' 0 C--N 1.359 1.02 0 C-N-CA 125.237 1.415 . . . . 0.0 111.869 -172.274 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 12.9 tt -103.65 -37.27 4.49 Favored 'Isoleucine or valine' 0 C--N 1.37 1.482 0 C-N-CA 126.334 1.854 . . . . 0.0 112.452 175.593 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 70.38 154.7 1.29 Allowed Glycine 0 C--N 1.366 2.195 0 C-N-CA 127.171 2.319 . . . . 0.0 116.95 176.722 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 58.6 p -93.27 71.53 4.49 Favored 'General case' 0 C--N 1.356 0.886 0 O-C-N 120.456 -1.614 . . . . 0.0 112.693 -178.452 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 4.1 t -125.89 -127.55 0.24 Allowed 'General case' 0 C--N 1.353 0.752 0 C-N-CA 123.518 0.727 . . . . 0.0 112.682 -175.974 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 2.3 mtmp? -79.9 -99.4 0.03 OUTLIER 'General case' 0 C--N 1.356 0.886 0 N-CA-C 120.296 3.443 . . . . 0.0 120.296 -172.548 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 15.0 tppt? -122.32 138.58 54.46 Favored 'General case' 0 C--N 1.359 1.019 0 N-CA-C 106.547 -1.649 . . . . 0.0 106.547 -174.153 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . 0.337 4.1 mp0 -93.5 121.15 34.61 Favored 'General case' 0 C--N 1.358 0.946 0 CA-C-O 122.955 1.359 . . . . 0.0 112.075 178.736 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 30.0 m-85 -108.21 150.13 27.66 Favored 'General case' 0 C--N 1.356 0.874 0 C-N-CA 128.148 2.579 . . . . 0.0 106.069 -179.176 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 4.1 t -72.0 143.95 49.01 Favored 'General case' 0 C--N 1.368 1.404 0 N-CA-C 117.127 2.269 . . . . 0.0 117.127 -173.536 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 27.7 p -145.87 -173.28 4.11 Favored 'General case' 0 C--N 1.36 1.062 0 C-N-CA 127.934 2.494 . . . . 0.0 112.458 -177.856 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' PHE . . . . . 0.517 ' HA ' ' HA ' ' A' ' 34' ' ' PRO . 43.0 m-85 -139.69 153.21 47.19 Favored 'General case' 0 C--N 1.361 1.089 0 C-N-CA 129.454 3.102 . . . . 0.0 111.66 174.876 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . 0.282 10.7 p90 -147.93 161.42 41.36 Favored 'General case' 0 C--N 1.367 1.355 0 C-N-CA 126.437 1.895 . . . . 0.0 110.158 172.134 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' PHE . . . . . 0.427 ' CD2' ' HB2' ' A' ' 57' ' ' CYS . 27.5 t80 -100.53 127.44 46.9 Favored 'General case' 0 C--N 1.368 1.387 0 O-C-N 120.54 -1.35 . . . . 0.0 108.274 178.438 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.408 ' HB3' ' HB3' ' A' ' 29' ' ' ALA . 1.7 ttpp -85.77 103.17 14.3 Favored 'General case' 0 C--N 1.364 1.21 0 C-N-CA 124.334 1.054 . . . . 0.0 112.04 177.873 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' TRP . . . . . 0.428 ' HB2' ' O ' ' A' ' 7' ' ' CYS . 35.3 t-105 -50.69 -44.43 57.92 Favored 'General case' 0 C--N 1.35 0.612 0 C-N-CA 129.301 3.04 . . . . 0.0 116.116 179.361 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 3.7 p -87.31 -6.56 58.47 Favored 'General case' 0 C--N 1.36 1.064 0 C-N-CA 125.193 1.397 . . . . 0.0 113.326 178.478 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.408 ' HB3' ' HB3' ' A' ' 26' ' ' LYS . . . -99.51 -38.48 8.76 Favored 'General case' 0 C--N 1.368 1.376 0 CA-C-N 120.561 1.528 . . . . 0.0 112.095 173.701 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . 0.273 30.4 tptt 84.36 23.59 0.11 Allowed 'General case' 0 C--N 1.367 1.351 0 C-N-CA 127.623 2.369 . . . . 0.0 111.616 -176.258 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 55.2 mtmt -145.54 166.43 25.75 Favored 'General case' 0 C--N 1.357 0.92 0 C-N-CA 126.636 1.974 . . . . 0.0 109.55 -177.61 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 75.0 m -89.39 145.8 25.1 Favored 'General case' 0 C--N 1.358 0.938 0 C-N-CA 127.646 2.379 . . . . 0.0 113.293 -178.791 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 44.6 mt -129.09 148.93 71.08 Favored Pre-proline 0 C--N 1.357 0.934 0 C-N-CA 125.296 1.438 . . . . 0.0 109.182 176.298 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.517 ' HA ' ' HA ' ' A' ' 23' ' ' PHE . 18.6 Cg_endo -86.64 162.31 9.34 Favored 'Trans proline' 0 N--CA 1.46 -0.445 0 C-N-CA 123.267 2.645 . . . . 0.0 110.868 165.933 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . 0.352 2.9 p90 -149.55 -159.24 1.01 Allowed 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 113.269 -1.787 . . . . 0.0 108.332 174.775 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 18.8 mt -139.65 144.94 37.88 Favored 'General case' 0 N--CA 1.439 -1.016 0 N-CA-C 103.323 -2.843 . . . . 0.0 103.323 -178.598 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.408 ' CE2' ' HA2' ' A' ' 39' ' ' GLY . 12.3 t80 -121.2 128.97 52.97 Favored 'General case' 0 CA--C 1.551 0.982 0 C-N-CA 128.852 2.861 . . . . 0.0 109.338 -179.792 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 37.7 m -76.52 2.57 13.48 Favored 'General case' 0 C--N 1.388 2.252 0 N-CA-C 115.976 1.843 . . . . 0.0 115.976 -178.318 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' GLY . . . . . 0.408 ' HA2' ' CE2' ' A' ' 37' ' ' PHE . . . 83.85 -39.45 2.85 Favored Glycine 0 C--N 1.358 1.776 0 N-CA-C 118.374 2.11 . . . . 0.0 118.374 176.3 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -125.51 38.06 4.25 Favored 'General case' 0 C--N 1.35 0.595 0 C-N-CA 124.514 1.125 . . . . 0.0 108.591 178.484 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -147.8 28.31 1.44 Allowed Glycine 0 C--N 1.356 1.655 0 N-CA-C 116.762 1.465 . . . . 0.0 116.762 -176.398 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -105.43 178.36 23.31 Favored Glycine 0 C--N 1.356 1.644 0 O-C-N 119.598 -2.119 . . . . 0.0 116.467 177.727 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 43.6 p-10 -127.31 -92.98 0.48 Allowed 'General case' 0 C--N 1.356 0.882 0 C-N-CA 124.615 1.166 . . . . 0.0 112.5 176.425 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -136.52 -30.0 0.93 Allowed 'General case' 0 C--N 1.358 0.972 0 N-CA-C 114.537 1.31 . . . . 0.0 114.537 -172.182 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 45.5 t30 -92.72 72.09 4.93 Favored 'General case' 0 C--N 1.372 1.547 0 O-C-N 119.743 -1.848 . . . . 0.0 111.918 -176.343 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . 0.377 0.0 OUTLIER -135.77 125.59 25.65 Favored 'General case' 0 C--N 1.351 0.673 0 CA-C-O 124.517 2.103 . . . . 0.0 110.238 174.606 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 20.2 m-30 -105.0 137.83 42.15 Favored 'General case' 0 N--CA 1.441 -0.905 0 C-N-CA 128.69 2.796 . . . . 0.0 107.795 -176.526 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 30.9 mt-30 -74.73 -45.65 42.61 Favored 'General case' 0 C--N 1.368 1.41 0 N-CA-C 114.734 1.383 . . . . 0.0 114.734 -177.413 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 30.1 p -129.56 172.23 11.78 Favored 'General case' 0 C--N 1.353 0.744 0 N-CA-C 105.529 -2.026 . . . . 0.0 105.529 175.747 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 18.6 tt -59.55 -28.07 39.08 Favored 'Isoleucine or valine' 0 C--N 1.365 1.281 0 C-N-CA 128.869 2.868 . . . . 0.0 117.05 178.985 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -84.75 -8.9 82.09 Favored Glycine 0 C--N 1.361 1.956 0 N-CA-C 115.961 1.144 . . . . 0.0 115.961 -177.226 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -88.49 -1.93 58.32 Favored 'General case' 0 C--N 1.362 1.123 0 C-N-CA 126.06 1.744 . . . . 0.0 111.248 176.274 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 33.9 t -85.05 -47.79 9.86 Favored 'General case' 0 C--N 1.355 0.821 0 C-N-CA 128.333 2.653 . . . . 0.0 112.983 -178.191 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.442 ' HB2' ' HD2' ' A' ' 60' ' ' LYS 0.338 0.0 OUTLIER -85.79 -25.27 26.45 Favored 'General case' 0 C--O 1.234 0.277 0 C-N-CA 128.64 2.776 . . . . 0.0 111.815 -179.916 . . . . . . . . 4 4 . 1 . 004 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.67 -25.39 63.88 Favored 'General case' 0 C--N 1.373 1.601 0 C-N-CA 125.857 1.663 . . . . 0.0 113.794 171.696 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.423 ' HD2' ' CD1' ' A' ' 6' ' ' TYR . 23.5 mtmt -98.49 -32.1 11.64 Favored 'General case' 0 C--N 1.362 1.116 0 C-N-CA 125.034 1.334 . . . . 0.0 111.636 172.695 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' CYS . . . . . 0.438 ' SG ' ' HB2' ' A' ' 6' ' ' TYR . 87.7 m -124.33 11.46 8.71 Favored 'General case' 0 C--N 1.362 1.132 0 N-CA-C 120.12 3.378 . . . . 0.0 120.12 -172.167 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 17.3 mt -132.15 -17.97 2.65 Favored 'General case' 0 N--CA 1.477 0.879 0 CA-C-N 124.579 3.354 . . . . 0.0 112.102 170.214 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 76.61 56.09 4.34 Favored Glycine 0 C--N 1.359 1.831 0 C-N-CA 128.034 2.73 . . . . 0.0 112.381 -171.601 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' LYS . . . . . 0.442 ' HD2' ' HB2' ' A' ' 54' ' ' ARG . 13.7 ptpt . . . . . 0 C--O 1.258 1.526 0 N-CA-C 102.892 -3.003 . . . . 0.0 102.892 -176.373 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 19.3 t90 . . . . . 0 N--CA 1.436 -1.171 0 CA-C-O 122.706 1.241 . . . . 0.0 109.753 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 35.3 mt-30 -138.75 147.6 55.09 Favored Pre-proline 0 C--N 1.359 1.016 1 N-CA-C 99.91 -4.107 . . . . 0.0 99.91 169.279 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 5.0 Cg_endo -73.76 123.57 8.61 Favored 'Trans proline' 0 CA--C 1.553 1.444 0 CA-C-N 125.556 3.02 . . . . 0.0 116.03 -169.995 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.563 ' HG2' ' CD2' ' A' ' 6' ' ' TYR . 49.5 Cg_endo -94.11 -116.92 0.0 OUTLIER 'Trans proline' 0 CA--C 1.548 1.221 1 C-N-CA 126.392 4.728 . . . . 0.0 110.362 179.592 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . 0.264 63.9 p-90 -87.06 -57.09 3.09 Favored 'General case' 0 C--N 1.384 2.093 0 C-N-CA 127.977 2.511 . . . . 0.0 115.234 176.249 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.563 ' CD2' ' HG2' ' A' ' 4' ' ' PRO . 0.1 OUTLIER -48.44 -7.77 0.02 OUTLIER 'General case' 0 C--N 1.363 1.162 1 C-N-CA 132.255 4.222 . . . . 0.0 120.663 -174.683 . . . . . . . . 4 4 . 1 . 005 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.414 ' O ' ' HB2' ' A' ' 27' ' ' TRP . 4.1 m -103.09 -31.67 10.06 Favored 'General case' 0 N--CA 1.442 -0.868 0 N-CA-C 106.829 -1.545 . . . . 0.0 106.829 -177.331 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 26.0 mtmt -98.27 20.77 11.95 Favored 'General case' 0 C--N 1.364 1.231 0 C-N-CA 128.904 2.881 . . . . 0.0 113.206 -175.181 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -104.94 126.36 31.31 Favored Pre-proline 0 C--N 1.362 1.131 0 CA-C-O 115.645 -2.121 . . . . 0.0 108.558 -176.763 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 30.5 Cg_exo -77.19 156.02 33.35 Favored 'Trans proline' 0 C--N 1.374 1.872 0 C-N-CA 125.23 3.954 . . . . 0.0 113.689 -167.22 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 9.4 p -72.52 134.12 30.44 Favored 'Isoleucine or valine' 0 C--N 1.37 1.483 0 N-CA-C 117.966 2.58 . . . . 0.0 117.966 178.379 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.684 ' NE ' HH21 ' A' ' 46' ' ' ARG . 0.0 OUTLIER -106.08 -176.72 3.16 Favored 'General case' 0 C--N 1.355 0.846 0 C-N-CA 129.109 2.964 . . . . 0.0 109.741 179.069 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.451 0.6 OUTLIER -155.49 -55.42 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.355 0.812 0 C-N-CA 126.133 1.773 . . . . 0.0 112.95 162.996 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 77.11 -152.26 39.91 Favored Glycine 0 C--N 1.366 2.232 0 CA-C-N 119.506 1.048 . . . . 0.0 114.245 -174.152 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 18.5 m -176.66 134.73 0.22 Allowed 'General case' 0 CA--C 1.504 -0.804 1 N-CA-C 100.163 -4.014 . . . . 0.0 100.163 175.73 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -176.03 -63.77 0.01 OUTLIER 'General case' 0 C--N 1.354 0.775 0 CA-C-O 123.066 1.412 . . . . 0.0 109.401 -175.68 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 29.7 mmmt -105.29 -98.46 0.33 Allowed 'General case' 0 C--N 1.352 0.705 0 CA-C-N 113.653 -1.612 . . . . 0.0 112.051 -173.738 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 13.6 tptp -147.78 166.41 27.62 Favored 'General case' 0 N--CA 1.439 -1.0 1 N-CA-C 99.094 -4.41 . . . . 0.0 99.094 -177.369 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 3.2 mm100 -93.07 120.22 33.13 Favored 'General case' 0 C--N 1.356 0.866 0 N-CA-C 107.24 -1.392 . . . . 0.0 107.24 178.13 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 29.5 m-85 -109.49 131.27 55.22 Favored 'General case' 0 C--N 1.355 0.806 0 O-C-N 121.033 -1.042 . . . . 0.0 108.271 -179.002 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' SER . . . . . 0.444 ' HA ' ' HG ' ' A' ' 36' ' ' LEU . 8.2 t -68.08 127.43 32.85 Favored 'General case' 0 C--N 1.375 1.701 0 CA-C-N 120.708 1.594 . . . . 0.0 115.121 -176.863 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 90.5 p -125.5 -159.62 0.91 Allowed 'General case' 0 C--N 1.348 0.501 0 C-N-CA 126.188 1.795 . . . . 0.0 112.451 -176.544 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 95.4 m-85 -146.94 132.35 18.59 Favored 'General case' 0 C--N 1.366 1.298 0 C-N-CA 129.646 3.178 . . . . 0.0 108.302 176.663 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 7.7 p90 -130.02 154.63 47.22 Favored 'General case' 0 C--N 1.363 1.183 0 CA-C-N 120.692 1.587 . . . . 0.0 107.746 169.757 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 7.8 t80 -102.94 127.47 50.14 Favored 'General case' 0 C--N 1.36 1.04 0 N-CA-C 105.652 -1.981 . . . . 0.0 105.652 -179.768 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 16.8 tptp -109.12 111.35 22.92 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 120.875 -1.14 . . . . 0.0 110.153 -178.058 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' TRP . . . . . 0.414 ' HB2' ' O ' ' A' ' 7' ' ' CYS . 33.7 t-105 -33.98 -58.08 0.45 Allowed 'General case' 0 C--N 1.369 1.453 0 N-CA-C 120.494 3.516 . . . . 0.0 120.494 176.551 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 2.0 p -80.27 -5.92 57.05 Favored 'General case' 0 C--N 1.363 1.173 0 C-N-CA 126.524 1.93 . . . . 0.0 113.868 -179.564 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -94.88 -39.67 10.11 Favored 'General case' 0 C--N 1.363 1.194 0 C-N-CA 124.663 1.185 . . . . 0.0 109.94 173.924 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 11.7 tptm 78.09 17.95 1.19 Allowed 'General case' 0 C--N 1.373 1.619 0 C-N-CA 128.44 2.696 . . . . 0.0 112.241 179.079 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 56.8 mtmt -138.0 167.27 22.12 Favored 'General case' 0 C--N 1.354 0.789 0 C-N-CA 128.469 2.707 . . . . 0.0 110.637 -175.567 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 87.9 m -93.17 119.29 32.2 Favored 'General case' 0 C--N 1.365 1.249 0 C-N-CA 129.528 3.131 . . . . 0.0 111.291 179.434 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 58.3 mt -110.48 139.31 21.42 Favored Pre-proline 0 C--N 1.35 0.591 0 O-C-N 119.949 -1.72 . . . . 0.0 109.788 -179.882 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -87.89 104.62 0.53 Allowed 'Trans proline' 0 N--CA 1.462 -0.346 0 C-N-CA 124.163 3.242 . . . . 0.0 112.12 -178.92 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 1.1 p90 -98.8 -177.95 3.81 Favored 'General case' 0 C--N 1.359 0.982 0 N-CA-C 107.218 -1.401 . . . . 0.0 107.218 173.782 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.444 ' HG ' ' HA ' ' A' ' 21' ' ' SER . 6.8 mp -118.65 145.04 45.77 Favored 'General case' 0 CA--C 1.507 -0.684 0 O-C-N 119.251 -2.156 . . . . 0.0 105.896 176.092 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 25.9 t80 -106.86 138.67 42.59 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 126.408 1.883 . . . . 0.0 110.164 177.851 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 2.7 m -92.85 -5.33 51.21 Favored 'General case' 0 C--N 1.376 1.724 0 N-CA-C 116.475 2.028 . . . . 0.0 116.475 178.073 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 105.82 -58.18 0.46 Allowed Glycine 0 C--N 1.366 2.245 0 CA-C-N 120.415 1.461 . . . . 0.0 115.71 -176.764 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 3.3 m -116.02 134.64 54.74 Favored 'General case' 0 C--N 1.354 0.781 0 N-CA-C 104.323 -2.473 . . . . 0.0 104.323 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 113.35 -10.61 24.2 Favored Glycine 0 C--N 1.362 2.002 0 CA-C-N 120.591 1.541 . . . . 0.0 112.562 -174.599 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -87.43 126.76 8.14 Favored Glycine 0 C--N 1.361 1.932 0 C-N-CA 125.883 1.706 . . . . 0.0 110.206 168.587 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 42.0 p30 -88.48 -78.49 0.33 Allowed 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 127.272 2.229 . . . . 0.0 115.307 -179.52 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -136.84 -27.11 1.02 Allowed 'General case' 0 C--N 1.362 1.151 0 N-CA-C 117.53 2.419 . . . . 0.0 117.53 -176.165 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 10.5 t-20 -109.45 78.49 1.14 Allowed 'General case' 0 CA--C 1.55 0.958 0 N-CA-C 117.962 2.578 . . . . 0.0 117.962 -170.635 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.684 HH21 ' NE ' ' A' ' 12' ' ' ARG 0.445 0.2 OUTLIER -146.34 147.96 31.88 Favored 'General case' 0 C--N 1.366 1.312 0 CA-C-N 123.902 3.046 . . . . 0.0 112.67 168.007 . . . . . . . . 4 4 . 1 . 005 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 7.2 m-85 -108.05 139.08 43.21 Favored 'General case' 0 C--N 1.368 1.409 0 C-N-CA 127.428 2.291 . . . . 0.0 112.416 -168.458 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -81.96 -24.63 35.42 Favored 'General case' 0 C--N 1.374 1.642 0 C-N-CA 126.311 1.844 . . . . 0.0 115.367 -179.61 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 57.3 p -139.54 163.94 31.22 Favored 'General case' 0 C--N 1.36 1.037 0 N-CA-C 105.599 -2.0 . . . . 0.0 105.599 176.519 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 14.1 tt -64.61 -21.52 29.4 Favored 'Isoleucine or valine' 0 C--N 1.367 1.354 0 C-N-CA 126.817 2.047 . . . . 0.0 116.191 179.489 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -84.43 -13.37 73.58 Favored Glycine 0 C--N 1.365 2.148 0 C-N-CA 126.05 1.786 . . . . 0.0 114.618 -179.997 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -82.76 -12.69 57.33 Favored 'General case' 0 C--N 1.366 1.319 0 O-C-N 120.823 -1.398 . . . . 0.0 111.61 174.577 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 14.9 t -72.71 -48.1 41.54 Favored 'General case' 0 C--N 1.361 1.107 0 C-N-CA 127.628 2.371 . . . . 0.0 112.755 178.045 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 11.0 mtp180 -69.99 -33.16 71.68 Favored 'General case' 0 C--N 1.346 0.424 1 C-N-CA 132.778 4.431 . . . . 0.0 112.994 173.699 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 31.5 ttmt -69.84 -36.94 75.99 Favored 'General case' 0 C--N 1.369 1.421 0 C-N-CA 126.825 2.05 . . . . 0.0 113.213 178.83 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 6.0 mtmm -89.09 -31.64 17.92 Favored 'General case' 0 C--N 1.367 1.366 0 C-N-CA 124.918 1.287 . . . . 0.0 111.91 172.88 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 56.4 m -127.33 8.85 6.59 Favored 'General case' 0 C--N 1.365 1.247 0 N-CA-C 121.558 3.91 . . . . 0.0 121.558 -173.557 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 14.1 mt -136.54 -32.41 0.83 Allowed 'General case' 0 C--N 1.359 1.018 1 CA-C-N 126.984 4.447 . . . . 0.0 115.228 169.392 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 86.46 55.31 2.48 Favored Glycine 0 C--N 1.359 1.827 0 CA-C-N 119.577 1.08 . . . . 0.0 112.279 -169.634 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 1.3 ptpp? . . . . . 0 C--O 1.258 1.527 0 N-CA-C 103.264 -2.865 . . . . 0.0 103.264 -176.594 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 3.4 t90 . . . . . 0 N--CA 1.433 -1.299 0 N-CA-C 105.996 -1.853 . . . . 0.0 105.996 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 30.4 mt-30 -136.38 144.86 49.35 Favored Pre-proline 0 N--CA 1.443 -0.789 0 N-CA-C 100.322 -3.955 . . . . 0.0 100.322 173.585 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.41 ' HA ' ' HD3' ' A' ' 4' ' ' PRO . 47.1 Cg_endo -76.0 125.83 8.92 Favored 'Trans proline' 0 CA--C 1.558 1.701 0 C-N-CA 123.369 2.712 . . . . 0.0 114.5 -168.461 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.498 ' HG2' ' CD2' ' A' ' 6' ' ' TYR . 40.5 Cg_endo -96.59 -114.38 0.0 OUTLIER 'Trans proline' 0 CA--C 1.547 1.168 1 C-N-CA 126.886 5.058 . . . . 0.0 111.345 -176.395 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 5' ' ' TRP . . . . . 0.506 ' CE3' ' CD1' ' A' ' 6' ' ' TYR 0.29 45.9 p-90 -86.74 -69.71 0.66 Allowed 'General case' 0 C--N 1.382 1.998 0 C-N-CA 127.623 2.369 . . . . 0.0 114.867 178.469 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.506 ' CD1' ' CE3' ' A' ' 5' ' ' TRP . 0.1 OUTLIER -33.14 -45.09 0.13 Allowed 'General case' 0 C--N 1.36 1.046 1 C-N-CA 132.995 4.518 . . . . 0.0 119.137 -173.397 . . . . . . . . 4 4 . 1 . 006 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.6 m -65.84 -41.79 91.31 Favored 'General case' 0 N--CA 1.448 -0.57 0 C-N-CA 128.235 2.614 . . . . 0.0 112.148 -179.827 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 44.2 mtpt -93.95 -7.97 41.42 Favored 'General case' 0 C--N 1.363 1.154 0 C-N-CA 129.073 2.949 . . . . 0.0 112.368 -179.278 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.437 ' HA ' ' HD3' ' A' ' 10' ' ' PRO . 0.6 OUTLIER -80.89 123.44 82.23 Favored Pre-proline 0 C--N 1.363 1.183 0 CA-C-O 116.326 -1.797 . . . . 0.0 112.738 -172.676 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.437 ' HD3' ' HA ' ' A' ' 9' ' ' GLU . 50.7 Cg_exo -70.86 147.78 56.5 Favored 'Trans proline' 0 CA--C 1.54 0.779 0 C-N-CA 123.525 2.817 . . . . 0.0 115.479 -163.801 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 3.5 p -78.8 131.99 33.21 Favored 'Isoleucine or valine' 0 C--N 1.363 1.177 0 C-N-CA 125.375 1.47 . . . . 0.0 110.659 176.236 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 38.3 mtt-85 -136.23 152.03 50.31 Favored 'General case' 0 C--N 1.359 0.995 0 N-CA-C 106.408 -1.701 . . . . 0.0 106.408 -173.812 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.385 14.5 tt -125.18 -54.03 2.14 Favored 'Isoleucine or valine' 0 C--N 1.375 1.706 0 CA-C-N 120.988 1.722 . . . . 0.0 112.733 179.209 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.434 ' HA2' ' HA3' ' A' ' 41' ' ' GLY . . . 146.31 -163.78 28.4 Favored Glycine 0 C--N 1.357 1.716 0 CA-C-N 119.564 1.074 . . . . 0.0 112.168 173.84 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 75.6 m -150.66 52.65 0.88 Allowed 'General case' 0 C--N 1.355 0.818 0 N-CA-C 105.8 -1.926 . . . . 0.0 105.8 176.806 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 7.6 m -143.35 -172.35 3.68 Favored 'General case' 0 C--N 1.358 0.969 1 C-N-CA 132.253 4.221 . . . . 0.0 103.965 -179.403 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 64.7 mmtt -131.29 80.32 1.93 Allowed 'General case' 0 C--N 1.358 0.953 0 C-N-CA 125.55 1.54 . . . . 0.0 111.851 -177.512 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.491 ' NZ ' ' H ' ' A' ' 19' ' ' GLN . 4.8 tptp -149.91 154.7 38.74 Favored 'General case' 0 C--N 1.347 0.498 0 N-CA-C 104.898 -2.26 . . . . 0.0 104.898 177.957 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' GLN . . . . . 0.491 ' H ' ' NZ ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -145.82 102.22 3.64 Favored 'General case' 0 C--N 1.358 0.949 0 O-C-N 119.433 -2.042 . . . . 0.0 109.721 174.261 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 58.4 m-85 -93.71 147.21 23.25 Favored 'General case' 0 C--N 1.358 0.962 0 C-N-CA 127.644 2.378 . . . . 0.0 108.168 175.304 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 3.8 t -72.88 114.01 10.55 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 126.324 1.85 . . . . 0.0 115.175 -176.703 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 88.0 p -129.96 161.71 30.3 Favored 'General case' 0 C--N 1.367 1.327 0 N-CA-C 114.679 1.363 . . . . 0.0 114.679 -178.952 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' PHE . . . . . 0.413 ' HB2' ' HB2' ' A' ' 47' ' ' PHE . 91.8 m-85 -135.97 148.16 48.34 Favored 'General case' 0 CA--C 1.51 -0.594 0 N-CA-C 107.392 -1.336 . . . . 0.0 107.392 176.224 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 2.6 p90 -137.72 153.8 49.72 Favored 'General case' 0 C--N 1.358 0.945 0 C-N-CA 125.751 1.62 . . . . 0.0 108.996 176.183 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 15.7 t80 -96.32 135.81 37.66 Favored 'General case' 0 C--N 1.362 1.137 0 O-C-N 120.727 -1.233 . . . . 0.0 108.353 178.429 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.63 102.97 14.86 Favored 'General case' 0 N--CA 1.441 -0.914 0 O-C-N 121.799 -0.563 . . . . 0.0 110.813 178.882 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 10.6 t-105 -39.68 -47.02 1.95 Allowed 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 130.061 3.345 . . . . 0.0 118.196 169.484 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . 0.278 4.0 p -86.48 -23.23 26.04 Favored 'General case' 0 C--N 1.363 1.169 0 CA-C-O 118.147 -0.93 . . . . 0.0 112.774 176.875 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -82.07 -37.09 26.92 Favored 'General case' 0 C--N 1.376 1.753 0 CA-C-N 121.884 2.129 . . . . 0.0 114.854 173.705 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . 0.292 0.8 OUTLIER 81.96 22.28 0.27 Allowed 'General case' 0 C--N 1.371 1.503 0 C-N-CA 127.876 2.471 . . . . 0.0 111.8 -177.153 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 53.5 mtmt -143.94 169.68 17.34 Favored 'General case' 0 C--N 1.357 0.897 0 C-N-CA 127.174 2.189 . . . . 0.0 108.712 -177.182 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 80.0 m -91.52 145.24 24.78 Favored 'General case' 0 C--N 1.357 0.899 0 C-N-CA 127.108 2.163 . . . . 0.0 112.414 -179.452 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 31.2 mt -123.65 145.01 45.95 Favored Pre-proline 0 C--N 1.36 1.035 0 C-N-CA 125.374 1.47 . . . . 0.0 111.013 176.667 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -86.55 145.12 7.97 Favored 'Trans proline' 0 C--N 1.348 0.513 0 C-N-CA 124.492 3.462 . . . . 0.0 111.842 169.603 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . 0.273 13.5 p90 -141.27 -160.03 1.03 Allowed 'General case' 0 C--N 1.344 0.332 0 N-CA-C 105.787 -1.931 . . . . 0.0 105.787 170.896 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 58.5 mt -141.56 154.5 45.5 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 104.756 -2.313 . . . . 0.0 104.756 175.97 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 3.3 t80 -115.46 129.11 56.45 Favored 'General case' 0 CA--C 1.567 1.628 0 C-N-CA 125.457 1.503 . . . . 0.0 110.767 177.833 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 49.1 m -98.73 16.06 23.34 Favored 'General case' 0 C--N 1.382 2.01 0 N-CA-C 115.262 1.579 . . . . 0.0 115.262 -178.766 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 76.53 -56.47 3.36 Favored Glycine 0 C--N 1.352 1.469 0 O-C-N 120.133 -1.604 . . . . 0.0 116.257 178.936 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 14.4 m -79.45 34.23 0.26 Allowed 'General case' 0 C--N 1.358 0.954 0 C-N-CA 127.574 2.35 . . . . 0.0 115.666 179.744 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.434 ' HA3' ' HA2' ' A' ' 14' ' ' GLY . . . 173.17 49.67 0.05 OUTLIER Glycine 0 CA--C 1.482 -1.976 0 O-C-N 120.556 -1.34 . . . . 0.0 114.078 174.607 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -104.53 128.06 9.32 Favored Glycine 0 C--N 1.354 1.572 0 N-CA-C 109.432 -1.467 . . . . 0.0 109.432 169.797 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 45.6 p30 -77.33 -57.5 3.8 Favored 'General case' 0 C--N 1.361 1.099 0 N-CA-C 116.331 1.974 . . . . 0.0 116.331 -178.668 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -177.35 -21.95 0.01 OUTLIER 'General case' 0 C--N 1.354 0.778 0 C-N-CA 126.886 2.074 . . . . 0.0 111.926 -178.286 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 39.3 t30 -96.96 89.24 4.77 Favored 'General case' 0 CA--C 1.555 1.146 0 O-C-N 119.283 -2.136 . . . . 0.0 116.416 -174.247 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . 0.355 0.0 OUTLIER -150.42 129.64 12.78 Favored 'General case' 0 C--N 1.355 0.833 0 O-C-N 120.689 -1.257 . . . . 0.0 110.42 168.033 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 47' ' ' PHE . . . . . 0.413 ' HB2' ' HB2' ' A' ' 23' ' ' PHE . 27.0 m-85 -99.89 150.98 21.83 Favored 'General case' 0 N--CA 1.447 -0.587 0 C-N-CA 126.46 1.904 . . . . 0.0 106.683 175.807 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -78.33 -38.33 42.46 Favored 'General case' 0 C--N 1.363 1.162 0 C-N-CA 125.718 1.607 . . . . 0.0 113.163 -178.299 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 75.5 p -129.95 165.31 22.36 Favored 'General case' 0 C--N 1.357 0.923 0 C-N-CA 125.189 1.395 . . . . 0.0 107.324 175.518 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 13.0 tt -71.98 -10.16 13.66 Favored 'Isoleucine or valine' 0 C--N 1.363 1.185 0 C-N-CA 126.501 1.92 . . . . 0.0 114.673 175.088 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -91.25 -10.62 62.11 Favored Glycine 0 C--N 1.365 2.181 0 O-C-N 120.178 -1.576 . . . . 0.0 114.101 176.664 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 -86.13 -41.16 14.96 Favored 'General case' 0 C--N 1.364 1.228 0 C-N-CA 125.81 1.644 . . . . 0.0 110.887 174.326 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . 0.258 4.1 t -42.51 -47.45 5.1 Favored 'General case' 0 C--N 1.365 1.267 0 C-N-CA 128.952 2.901 . . . . 0.0 116.306 -175.908 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 10.0 ptt180 -69.42 -19.79 63.79 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 129.646 3.178 . . . . 0.0 117.37 174.671 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 8.6 mptt -79.84 -6.12 56.76 Favored 'General case' 0 C--N 1.375 1.694 0 O-C-N 119.493 -2.005 . . . . 0.0 113.495 178.193 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.423 ' HD3' ' CE1' ' A' ' 6' ' ' TYR . 5.6 mtmm -111.16 -21.78 11.76 Favored 'General case' 0 C--N 1.354 0.773 0 O-C-N 120.32 -1.487 . . . . 0.0 110.38 176.816 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 57.4 m -131.3 8.38 4.66 Favored 'General case' 0 C--N 1.364 1.224 0 N-CA-C 116.736 2.125 . . . . 0.0 116.736 -171.0 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 11.6 mt -130.91 -13.51 3.6 Favored 'General case' 0 N--CA 1.476 0.85 0 CA-C-N 123.64 2.927 . . . . 0.0 111.675 172.528 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 73.52 59.68 4.04 Favored Glycine 0 C--N 1.359 1.828 0 C-N-CA 127.999 2.714 . . . . 0.0 112.863 -169.601 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 19.2 mtpt . . . . . 0 C--O 1.262 1.762 0 C-N-CA 124.721 1.208 . . . . 0.0 107.767 -178.83 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' TRP . . . . . 0.458 ' CZ2' ' HB3' ' A' ' 3' ' ' PRO . 4.4 t90 . . . . . 0 N--CA 1.433 -1.298 0 N-CA-C 107.456 -1.313 . . . . 0.0 107.456 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 25.0 mm-40 -147.57 150.66 37.54 Favored Pre-proline 0 C--N 1.351 0.669 1 N-CA-C 98.281 -4.711 . . . . 0.0 98.281 173.674 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.48 ' HB2' ' HD2' ' A' ' 8' ' ' LYS . 66.2 Cg_endo -82.65 123.08 3.65 Favored 'Trans proline' 0 CA--C 1.558 1.717 0 CA-C-N 124.168 2.524 . . . . 0.0 114.906 -165.194 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.451 ' HD3' ' HA ' ' A' ' 3' ' ' PRO . 27.7 Cg_exo -73.79 -110.31 0.01 OUTLIER 'Trans proline' 0 C--N 1.365 1.416 1 C-N-CA 126.96 5.107 . . . . 0.0 112.827 173.088 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 5' ' ' TRP . . . . . 0.55 ' CE3' ' CD2' ' A' ' 6' ' ' TYR 0.298 17.5 p-90 -88.91 -76.52 0.4 Allowed 'General case' 0 C--N 1.375 1.687 0 N-CA-C 116.419 2.007 . . . . 0.0 116.419 178.968 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.55 ' CD2' ' CE3' ' A' ' 5' ' ' TRP . 0.0 OUTLIER -29.65 -51.88 0.12 Allowed 'General case' 0 C--N 1.36 1.062 1 C-N-CA 135.173 5.389 . . . . 0.0 118.404 -171.391 . . . . . . . . 4 4 . 1 . 007 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.425 ' O ' ' HB2' ' A' ' 27' ' ' TRP . 0.0 OUTLIER -53.12 -41.65 65.25 Favored 'General case' 0 N--CA 1.443 -0.795 1 C-N-CA 131.732 4.013 . . . . 0.0 112.503 178.739 . . . . . . . . 4 4 . 1 . 007 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.48 ' HD2' ' HB2' ' A' ' 3' ' ' PRO . 0.0 OUTLIER -108.82 17.56 21.7 Favored 'General case' 0 C--N 1.367 1.362 0 C-N-CA 127.366 2.266 . . . . 0.0 111.702 -178.451 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.434 ' HA ' ' HD3' ' A' ' 10' ' ' PRO . 4.4 tp10 -93.61 133.11 28.61 Favored Pre-proline 0 C--N 1.361 1.108 0 CA-C-O 116.488 -1.72 . . . . 0.0 112.041 -173.172 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.434 ' HD3' ' HA ' ' A' ' 9' ' ' GLU . 51.9 Cg_exo -70.24 125.95 12.45 Favored 'Trans proline' 0 CA--C 1.54 0.797 0 CA-C-N 125.276 2.92 . . . . 0.0 116.23 -164.73 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 10.1 p -68.9 139.73 20.04 Favored 'Isoleucine or valine' 0 C--N 1.367 1.339 0 C-N-CA 127.453 2.301 . . . . 0.0 114.041 178.582 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 61.8 mtt180 -145.73 120.61 9.97 Favored 'General case' 0 C--N 1.368 1.408 0 C-N-CA 126.297 1.839 . . . . 0.0 111.643 -173.487 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 14.4 tt -88.84 -32.33 5.8 Favored 'Isoleucine or valine' 0 C--N 1.371 1.532 0 CA-C-N 121.245 1.839 . . . . 0.0 113.783 179.691 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 92.89 -69.48 1.64 Allowed Glycine 0 C--N 1.351 1.393 0 C-N-CA 126.139 1.828 . . . . 0.0 115.279 179.902 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.457 ' H ' ' HB3' ' A' ' 38' ' ' SER . 70.8 m 76.12 67.6 0.06 Allowed 'General case' 0 C--N 1.366 1.313 0 C-N-CA 127.714 2.405 . . . . 0.0 110.525 -173.118 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 60.4 m -125.26 -63.05 1.17 Allowed 'General case' 0 N--CA 1.442 -0.838 0 CA-C-O 122.449 1.118 . . . . 0.0 109.92 -178.446 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 34.3 mmtm -90.79 -86.27 0.21 Allowed 'General case' 0 C--N 1.349 0.546 0 C-N-CA 127.342 2.257 . . . . 0.0 116.064 -170.307 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 53.8 tptt -147.87 -169.34 3.31 Favored 'General case' 0 C--N 1.35 0.597 0 N-CA-C 101.682 -3.451 . . . . 0.0 101.682 -177.718 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -118.54 105.52 11.73 Favored 'General case' 0 C--N 1.353 0.734 0 N-CA-C 106.488 -1.671 . . . . 0.0 106.488 173.181 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 22.5 m-85 -96.56 144.35 26.71 Favored 'General case' 0 C--N 1.362 1.116 0 C-N-CA 126.564 1.946 . . . . 0.0 109.77 -177.698 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 7.0 t -69.76 113.31 6.89 Favored 'General case' 0 C--N 1.369 1.441 0 N-CA-C 115.488 1.662 . . . . 0.0 115.488 -178.288 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 78.3 p -120.7 -166.25 1.31 Allowed 'General case' 0 C--N 1.359 0.988 0 C-N-CA 126.321 1.849 . . . . 0.0 113.431 -179.396 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 29.6 m-85 -148.35 149.58 32.05 Favored 'General case' 0 C--N 1.359 0.986 1 C-N-CA 131.877 4.071 . . . . 0.0 109.008 174.487 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 10.5 p90 -144.11 150.8 38.69 Favored 'General case' 0 C--N 1.362 1.113 0 C-N-CA 127.96 2.504 . . . . 0.0 110.986 175.685 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 9.2 t80 -98.24 119.1 36.32 Favored 'General case' 0 C--N 1.381 1.951 0 N-CA-C 106.916 -1.512 . . . . 0.0 106.916 177.071 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 9.4 tptt -103.74 110.44 22.54 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 125.538 1.535 . . . . 0.0 109.124 -179.256 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' TRP . . . . . 0.425 ' HB2' ' O ' ' A' ' 7' ' ' CYS . 33.2 t-105 -44.99 -49.88 10.98 Favored 'General case' 0 C--N 1.362 1.142 0 C-N-CA 131.14 3.776 . . . . 0.0 117.695 176.502 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 10.8 p -82.46 3.75 26.99 Favored 'General case' 0 C--N 1.36 1.059 0 C-N-CA 125.973 1.709 . . . . 0.0 113.617 -179.565 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -107.25 -46.49 3.87 Favored 'General case' 0 C--N 1.357 0.929 0 C-N-CA 125.604 1.562 . . . . 0.0 108.49 173.114 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . 0.309 0.2 OUTLIER 81.11 24.6 0.27 Allowed 'General case' 0 C--N 1.367 1.346 0 C-N-CA 128.845 2.858 . . . . 0.0 112.352 179.098 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 83.0 tttt -149.82 163.83 36.97 Favored 'General case' 0 N--CA 1.441 -0.902 0 N-CA-C 106.178 -1.786 . . . . 0.0 106.178 179.573 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 89.6 m -79.27 130.07 35.09 Favored 'General case' 0 C--N 1.358 0.957 0 C-N-CA 128.169 2.588 . . . . 0.0 113.927 175.805 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 80.8 mt -120.87 147.9 47.25 Favored Pre-proline 0 C--N 1.355 0.807 0 C-N-CA 124.591 1.157 . . . . 0.0 110.172 179.883 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -85.87 125.14 2.7 Favored 'Trans proline' 0 C--N 1.351 0.666 0 C-N-CA 124.454 3.436 . . . . 0.0 111.587 173.248 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -114.87 -168.86 1.44 Allowed 'General case' 0 C--N 1.354 0.764 0 N-CA-C 103.962 -2.607 . . . . 0.0 103.962 167.34 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 19.6 mt -119.25 155.82 31.05 Favored 'General case' 0 N--CA 1.441 -0.922 0 O-C-N 119.324 -2.11 . . . . 0.0 106.493 175.248 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 22.0 t80 -117.69 137.36 52.72 Favored 'General case' 0 N--CA 1.471 0.611 0 O-C-N 121.055 -1.028 . . . . 0.0 110.187 175.295 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' SER . . . . . 0.457 ' HB3' ' H ' ' A' ' 15' ' ' SER . 2.8 t -111.78 37.13 3.03 Favored 'General case' 0 C--N 1.375 1.715 0 N-CA-C 114.758 1.392 . . . . 0.0 114.758 175.721 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 72.29 -45.25 0.96 Allowed Glycine 0 C--N 1.36 1.897 0 N-CA-C 121.329 3.292 . . . . 0.0 121.329 161.986 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -116.43 165.94 12.64 Favored 'General case' 0 C--N 1.347 0.487 0 C-N-CA 126.694 1.998 . . . . 0.0 105.654 173.869 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 90.26 -33.63 4.45 Favored Glycine 0 N--CA 1.484 1.89 0 O-C-N 119.565 -1.959 . . . . 0.0 116.027 177.991 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -60.59 -174.51 1.11 Allowed Glycine 0 C--N 1.37 2.43 0 N-CA-C 120.696 3.039 . . . . 0.0 120.696 179.76 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' ASN . . . . . 0.531 ' H ' ' NH1' ' A' ' 46' ' ' ARG 0.272 26.2 p30 -136.39 -103.78 0.21 Allowed 'General case' 0 C--N 1.355 0.813 0 O-C-N 120.779 -1.424 . . . . 0.0 112.818 -179.648 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -155.33 5.03 0.21 Allowed 'General case' 0 C--N 1.35 0.627 0 O-C-N 120.873 -1.142 . . . . 0.0 113.271 -173.672 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 49.3 t30 -95.88 53.55 1.42 Allowed 'General case' 0 C--N 1.365 1.241 0 O-C-N 118.766 -2.459 . . . . 0.0 108.172 175.109 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.531 ' NH1' ' H ' ' A' ' 43' ' ' ASN . 0.0 OUTLIER -139.94 144.25 37.0 Favored 'General case' 0 N--CA 1.443 -0.798 0 N-CA-C 107.862 -1.162 . . . . 0.0 107.862 -177.463 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 52.8 m-85 -131.1 134.01 46.19 Favored 'General case' 0 N--CA 1.449 -0.494 0 C-N-CA 127.705 2.402 . . . . 0.0 107.358 -169.856 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.69 -16.93 61.67 Favored 'General case' 0 C--N 1.373 1.625 0 N-CA-C 116.699 2.111 . . . . 0.0 116.699 -177.35 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 40.9 p -146.29 -176.97 5.38 Favored 'General case' 0 C--N 1.352 0.685 0 N-CA-C 103.752 -2.684 . . . . 0.0 103.752 177.267 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 15.0 tt -76.59 -27.07 16.89 Favored 'Isoleucine or valine' 0 C--N 1.367 1.343 0 O-C-N 120.081 -1.637 . . . . 0.0 114.072 175.794 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -90.4 20.57 36.91 Favored Glycine 0 C--N 1.365 2.185 0 O-C-N 120.598 -1.314 . . . . 0.0 115.486 -171.688 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -112.87 -14.77 13.02 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 126.82 2.048 . . . . 0.0 108.587 171.51 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 15.9 t -87.07 -43.29 12.42 Favored 'General case' 0 C--N 1.361 1.067 0 C-N-CA 126.989 2.116 . . . . 0.0 115.748 -174.775 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . 0.301 0.0 OUTLIER -82.51 -24.75 33.98 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 126.623 1.969 . . . . 0.0 115.07 -175.546 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 28.2 ttmt -71.88 -15.98 62.12 Favored 'General case' 0 C--N 1.357 0.925 0 C-N-CA 127.497 2.319 . . . . 0.0 115.564 176.61 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.444 ' HD2' ' CD2' ' A' ' 6' ' ' TYR . 9.3 mtmm -100.81 -24.9 14.29 Favored 'General case' 0 C--N 1.36 1.058 0 C-N-CA 126.31 1.844 . . . . 0.0 112.357 175.458 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 43.6 m -137.54 26.68 2.82 Favored 'General case' 0 C--N 1.355 0.825 0 N-CA-C 116.935 2.198 . . . . 0.0 116.935 -167.305 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 16.7 mt -146.0 -23.73 0.45 Allowed 'General case' 0 N--CA 1.471 0.625 0 CA-C-N 120.546 1.521 . . . . 0.0 112.396 170.924 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 82.43 63.26 1.79 Allowed Glycine 0 C--N 1.36 1.904 0 C-N-CA 128.561 2.981 . . . . 0.0 112.576 -168.323 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 14.0 ptmt . . . . . 0 C--O 1.258 1.55 0 CA-C-O 116.284 -1.817 . . . . 0.0 106.723 -176.088 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 70.0 t90 . . . . . 0 N--CA 1.433 -1.281 0 N-CA-C 106.541 -1.651 . . . . 0.0 106.541 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 68.1 mt-30 -144.11 152.32 54.34 Favored Pre-proline 0 CA--C 1.512 -0.489 1 N-CA-C 97.996 -4.816 . . . . 0.0 97.996 172.352 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.486 ' HA ' ' HD3' ' A' ' 4' ' ' PRO . 1.5 Cg_endo -79.83 122.16 4.8 Favored 'Trans proline' 0 N--CA 1.452 -0.956 0 CA-C-N 124.207 2.538 . . . . 0.0 112.618 -170.351 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.486 ' HD3' ' HA ' ' A' ' 3' ' ' PRO . 16.2 Cg_exo -85.25 -116.08 0.01 OUTLIER 'Trans proline' 0 C--N 1.359 1.103 0 C-N-CA 124.913 3.742 . . . . 0.0 111.185 179.677 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' TRP . . . . . 0.501 ' CE2' ' CE2' ' A' ' 6' ' ' TYR . 42.6 p-90 -81.72 -72.53 0.43 Allowed 'General case' 0 C--N 1.375 1.68 0 C-N-CA 124.941 1.296 . . . . 0.0 114.021 -179.746 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.501 ' CE2' ' CE2' ' A' ' 5' ' ' TRP . 0.0 OUTLIER -33.35 -43.89 0.12 Allowed 'General case' 0 C--N 1.361 1.09 1 C-N-CA 134.273 5.029 . . . . 0.0 117.206 -179.853 . . . . . . . . 4 4 . 1 . 008 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.5 m -83.19 -15.72 49.39 Favored 'General case' 0 N--CA 1.44 -0.956 0 C-N-CA 127.636 2.374 . . . . 0.0 114.173 -173.728 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 67.8 mttm -125.52 32.23 5.37 Favored 'General case' 0 C--N 1.357 0.928 0 C-N-CA 126.892 2.077 . . . . 0.0 105.904 178.537 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 5.9 tm-20 -94.15 141.38 23.54 Favored Pre-proline 0 C--N 1.366 1.3 0 C-N-CA 125.106 1.362 . . . . 0.0 109.862 -176.299 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -89.84 142.37 3.97 Favored 'Trans proline' 0 N--CA 1.448 -1.16 0 C-N-CA 124.858 3.706 . . . . 0.0 108.074 177.609 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . 0.397 3.0 p -77.05 122.32 31.33 Favored 'Isoleucine or valine' 0 C--N 1.362 1.141 0 O-C-N 119.21 -2.182 . . . . 0.0 116.559 -173.659 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.476 ' HB2' HH22 ' A' ' 46' ' ' ARG . 11.0 mtm-85 -102.78 117.73 35.29 Favored 'General case' 0 N--CA 1.443 -0.809 0 C-N-CA 129.855 3.262 . . . . 0.0 109.778 -179.454 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 10.2 tt -90.52 -31.82 5.25 Favored 'Isoleucine or valine' 0 C--N 1.366 1.294 0 CA-C-N 121.103 1.774 . . . . 0.0 111.09 171.535 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 89.09 -64.43 3.33 Favored Glycine 0 C--N 1.358 1.773 0 C-N-CA 123.933 0.778 . . . . 0.0 114.087 -177.621 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . 0.358 86.1 p 78.0 81.73 0.07 Allowed 'General case' 0 C--N 1.359 0.983 0 C-N-CA 127.438 2.295 . . . . 0.0 110.928 -175.479 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 49.2 t -143.77 -80.74 0.19 Allowed 'General case' 0 C--N 1.357 0.898 0 O-C-N 121.263 -0.898 . . . . 0.0 112.863 -171.463 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 38.6 mmtm -86.74 -104.69 0.07 Allowed 'General case' 0 C--N 1.352 0.711 0 C-N-CA 127.104 2.162 . . . . 0.0 115.673 -171.084 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -126.88 151.41 48.44 Favored 'General case' 0 CA--C 1.503 -0.852 0 N-CA-C 100.831 -3.766 . . . . 0.0 100.831 179.245 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 7.1 mm-40 -92.82 113.25 25.47 Favored 'General case' 0 C--N 1.356 0.873 0 N-CA-C 106.699 -1.593 . . . . 0.0 106.699 -178.21 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 67.2 m-85 -106.98 141.85 37.53 Favored 'General case' 0 C--N 1.355 0.845 0 C-N-CA 125.147 1.379 . . . . 0.0 110.674 -174.435 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 24.6 t -70.5 104.62 2.81 Favored 'General case' 0 C--N 1.368 1.389 0 C-N-CA 125.704 1.602 . . . . 0.0 112.686 177.826 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 64.7 p -99.75 -161.17 0.85 Allowed 'General case' 0 C--N 1.349 0.544 0 C-N-CA 125.802 1.641 . . . . 0.0 112.151 177.866 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' PHE . . . . . 0.453 ' HA ' ' HA ' ' A' ' 34' ' ' PRO . 98.8 m-85 -148.2 132.99 17.96 Favored 'General case' 0 C--N 1.355 0.818 0 C-N-CA 127.237 2.215 . . . . 0.0 105.633 169.69 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 13.2 p90 -125.73 150.36 47.77 Favored 'General case' 0 CA--C 1.516 -0.327 0 C-N-CA 125.676 1.59 . . . . 0.0 109.638 177.414 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 10.8 t80 -91.01 118.97 30.81 Favored 'General case' 0 C--N 1.367 1.369 0 N-CA-C 103.447 -2.797 . . . . 0.0 103.447 176.921 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.94 115.86 27.98 Favored 'General case' 0 N--CA 1.431 -1.413 0 C-N-CA 123.236 0.615 . . . . 0.0 109.727 -176.895 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 48.1 t-105 -51.46 -45.75 62.83 Favored 'General case' 0 C--N 1.366 1.284 0 C-N-CA 128.628 2.771 . . . . 0.0 117.788 -178.324 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 17.3 p -84.75 -3.66 58.69 Favored 'General case' 0 C--N 1.352 0.676 0 C-N-CA 124.64 1.176 . . . . 0.0 113.778 179.922 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -100.79 -45.97 5.3 Favored 'General case' 0 C--N 1.361 1.085 0 C-N-CA 124.641 1.176 . . . . 0.0 113.631 176.675 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . 0.316 67.2 mmtt 85.15 20.55 0.11 Allowed 'General case' 0 C--N 1.368 1.383 0 C-N-CA 128.757 2.823 . . . . 0.0 112.161 -176.312 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.586 ' HZ3' ' H ' ' A' ' 32' ' ' CYS . 2.4 mmmp? -145.64 179.33 7.5 Favored 'General case' 0 C--N 1.355 0.812 0 C-N-CA 128.197 2.599 . . . . 0.0 109.979 -179.771 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.586 ' H ' ' HZ3' ' A' ' 31' ' ' LYS . 73.9 m -105.93 129.51 54.06 Favored 'General case' 0 C--N 1.358 0.977 0 C-N-CA 127.991 2.516 . . . . 0.0 115.085 -171.602 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 59.2 mt -120.37 144.55 38.45 Favored Pre-proline 0 C--N 1.357 0.916 0 O-C-N 119.707 -1.871 . . . . 0.0 110.505 -179.899 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.453 ' HA ' ' HA ' ' A' ' 23' ' ' PHE . 89.3 Cg_endo -81.39 110.19 2.19 Favored 'Trans proline' 0 C--N 1.351 0.677 0 C-N-CA 124.879 3.719 . . . . 0.0 113.797 176.414 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . 0.293 2.8 p90 -102.71 168.59 9.15 Favored 'General case' 0 C--N 1.363 1.175 0 CA-C-O 122.115 0.959 . . . . 0.0 109.751 174.644 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 61.0 mt -94.78 125.3 39.34 Favored 'General case' 0 C--N 1.351 0.634 0 N-CA-C 107.357 -1.349 . . . . 0.0 107.357 174.021 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 5.4 t80 -112.74 137.11 51.54 Favored 'General case' 0 C--N 1.35 0.603 0 C-N-CA 125.333 1.453 . . . . 0.0 109.055 179.31 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -90.77 9.97 27.92 Favored 'General case' 0 C--N 1.371 1.503 0 N-CA-C 116.758 2.132 . . . . 0.0 116.758 -177.318 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 93.4 -44.05 2.47 Favored Glycine 0 C--N 1.361 1.922 0 N-CA-C 119.056 2.383 . . . . 0.0 119.056 168.46 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -124.15 145.7 49.13 Favored 'General case' 0 C--N 1.35 0.603 0 N-CA-C 106.242 -1.762 . . . . 0.0 106.242 175.348 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 117.54 -41.06 2.16 Favored Glycine 0 C--N 1.361 1.932 0 C-N-CA 124.462 1.029 . . . . 0.0 113.744 -179.541 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -67.18 -171.23 4.9 Favored Glycine 0 C--N 1.36 1.878 0 N-CA-C 122.305 3.682 . . . . 0.0 122.305 -176.292 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' ASN . . . . . 0.475 HD22 ' CZ ' ' A' ' 12' ' ' ARG . 6.8 p30 -124.87 -115.75 0.29 Allowed 'General case' 0 C--N 1.359 1.002 0 C-N-CA 125.201 1.4 . . . . 0.0 111.214 -178.921 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -141.49 19.61 2.21 Favored 'General case' 0 C--N 1.364 1.232 0 O-C-N 119.952 -1.717 . . . . 0.0 112.483 178.271 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' ASN . . . . . 0.467 ' H ' HH11 ' A' ' 46' ' ' ARG . 49.9 t30 -91.25 36.59 0.93 Allowed 'General case' 0 CA--C 1.564 1.515 0 O-C-N 119.919 -1.738 . . . . 0.0 108.892 172.318 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.476 HH22 ' HB2' ' A' ' 12' ' ' ARG . 0.0 OUTLIER -137.91 97.81 3.5 Favored 'General case' 0 C--N 1.361 1.091 0 C-N-CA 127.839 2.456 . . . . 0.0 105.982 -178.341 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 47' ' ' PHE . . . . . 0.425 ' HB2' ' HB2' ' A' ' 23' ' ' PHE . 24.7 m-85 -94.24 153.22 18.16 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 111.679 -2.51 . . . . 0.0 111.895 -169.47 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . 0.262 0.0 OUTLIER -68.86 -43.56 75.14 Favored 'General case' 0 C--N 1.376 1.736 0 C-N-CA 125.786 1.635 . . . . 0.0 114.762 -179.806 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 72.2 p -137.88 162.28 34.42 Favored 'General case' 0 C--N 1.351 0.632 0 C-N-CA 127.996 2.518 . . . . 0.0 105.396 177.382 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 15.0 tt -66.45 -11.13 12.64 Favored 'Isoleucine or valine' 0 C--N 1.36 1.054 0 C-N-CA 127.577 2.351 . . . . 0.0 116.324 178.269 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -90.56 -9.09 65.07 Favored Glycine 0 C--N 1.367 2.295 0 C-N-CA 125.532 1.539 . . . . 0.0 114.259 174.385 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 12.8 tt0 -92.72 -14.09 28.45 Favored 'General case' 0 C--N 1.358 0.948 0 C-N-CA 125.304 1.442 . . . . 0.0 112.414 176.875 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 40.6 t -64.97 -41.28 95.58 Favored 'General case' 0 C--N 1.361 1.1 0 C-N-CA 129.137 2.975 . . . . 0.0 114.911 179.791 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 12.0 mtp180 -71.15 -21.41 62.18 Favored 'General case' 0 CA--C 1.532 0.282 1 C-N-CA 134.323 5.049 . . . . 0.0 115.767 178.595 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 49.1 mtmt -82.89 -19.79 36.69 Favored 'General case' 0 C--N 1.36 1.025 0 O-C-N 120.235 -1.541 . . . . 0.0 114.004 -178.796 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 10.6 mtmm -100.4 -30.18 11.98 Favored 'General case' 0 C--N 1.361 1.097 0 C-N-CA 126.711 2.005 . . . . 0.0 109.553 174.241 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' CYS . . . . . 0.48 ' SG ' ' HB2' ' A' ' 6' ' ' TYR . 96.3 m -124.32 10.08 8.6 Favored 'General case' 0 C--N 1.359 0.989 0 N-CA-C 119.737 3.236 . . . . 0.0 119.737 -172.654 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . 0.259 15.6 mt -131.86 -11.13 3.43 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-N 125.081 3.582 . . . . 0.0 113.065 169.233 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 70.61 52.17 17.2 Favored Glycine 0 C--N 1.365 2.179 0 C-N-CA 128.606 3.003 . . . . 0.0 113.43 -172.869 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 13.6 ptpt . . . . . 0 C--O 1.262 1.725 0 N-CA-C 104.959 -2.238 . . . . 0.0 104.959 -175.064 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 83.4 t90 . . . . . 0 N--CA 1.435 -1.182 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 23.6 mm-40 -147.35 154.58 45.68 Favored Pre-proline 0 C--N 1.352 0.683 1 N-CA-C 98.905 -4.48 . . . . 0.0 98.905 171.45 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.487 ' HA ' ' HD3' ' A' ' 4' ' ' PRO . 3.2 Cg_exo -79.71 118.34 3.81 Favored 'Trans proline' 0 CA--C 1.541 0.844 0 CA-C-N 124.974 2.812 . . . . 0.0 114.335 -167.174 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.487 ' HD3' ' HA ' ' A' ' 3' ' ' PRO . 14.0 Cg_exo -88.63 -109.42 0.0 OUTLIER 'Trans proline' 0 C--N 1.365 1.407 0 C-N-CA 125.045 3.83 . . . . 0.0 110.184 -175.953 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' TRP . . . . . 0.468 ' CE3' ' CD2' ' A' ' 6' ' ' TYR 0.272 45.1 p-90 -88.25 -72.26 0.54 Allowed 'General case' 0 C--N 1.372 1.558 0 N-CA-C 116.188 1.922 . . . . 0.0 116.188 -179.476 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.499 ' CE2' ' HD3' ' A' ' 56' ' ' LYS . 0.0 OUTLIER -30.85 -49.67 0.13 Allowed 'General case' 0 C--N 1.359 0.981 1 C-N-CA 135.672 5.589 . . . . 0.0 118.182 -175.667 . . . . . . . . 4 4 . 1 . 009 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.403 ' O ' ' HB2' ' A' ' 27' ' ' TRP . 1.8 m -57.99 -40.96 82.0 Favored 'General case' 0 C--N 1.349 0.572 0 C-N-CA 127.657 2.383 . . . . 0.0 114.116 -176.811 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 24.4 mtpp -105.55 22.26 15.8 Favored 'General case' 0 C--N 1.363 1.163 0 C-N-CA 126.283 1.833 . . . . 0.0 110.255 177.049 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -93.91 123.1 60.49 Favored Pre-proline 0 C--N 1.369 1.439 0 O-C-N 119.685 -1.885 . . . . 0.0 110.295 -174.709 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 80.3 Cg_exo -59.1 124.48 15.74 Favored 'Trans proline' 0 C--N 1.36 1.155 0 C-N-CA 124.758 3.639 . . . . 0.0 116.766 -165.023 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 9.9 p -88.02 126.66 41.45 Favored 'Isoleucine or valine' 0 C--N 1.37 1.479 0 C-N-CA 124.997 1.319 . . . . 0.0 111.328 -179.818 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.62 ' HB2' HH21 ' A' ' 46' ' ' ARG . 32.6 mtt180 -134.76 135.61 42.01 Favored 'General case' 0 N--CA 1.438 -1.047 0 C-N-CA 128.423 2.689 . . . . 0.0 111.158 -175.436 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 11.9 tt -95.41 -39.25 9.62 Favored 'Isoleucine or valine' 0 C--N 1.37 1.487 0 C-N-CA 127.428 2.291 . . . . 0.0 112.58 175.598 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 56.07 -133.85 50.56 Favored Glycine 0 C--N 1.364 2.085 0 C-N-CA 128.022 2.725 . . . . 0.0 116.983 -174.229 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 21.0 m -173.39 134.24 0.52 Allowed 'General case' 0 C--N 1.357 0.919 0 N-CA-C 100.662 -3.829 . . . . 0.0 100.662 179.209 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 31.3 t -167.86 -63.06 0.03 OUTLIER 'General case' 0 C--N 1.352 0.688 0 CA-C-N 120.336 1.425 . . . . 0.0 111.191 -174.867 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt -118.86 -89.18 0.6 Allowed 'General case' 0 C--N 1.347 0.488 0 C-N-CA 125.175 1.39 . . . . 0.0 111.458 -177.082 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 14.5 ptmm? -149.41 170.98 17.32 Favored 'General case' 0 CA--C 1.506 -0.745 0 N-CA-C 103.643 -2.725 . . . . 0.0 103.643 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.6 mm100 -93.27 108.81 20.37 Favored 'General case' 0 C--N 1.358 0.941 0 O-C-N 120.397 -1.439 . . . . 0.0 110.985 -176.577 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 83.1 m-85 -95.34 155.06 16.9 Favored 'General case' 0 C--N 1.354 0.803 0 C-N-CA 126.796 2.038 . . . . 0.0 109.638 -176.2 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 11.3 t -71.08 116.3 11.21 Favored 'General case' 0 C--N 1.369 1.416 0 C-N-CA 127.095 2.158 . . . . 0.0 114.35 -178.589 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 51.5 p -141.58 171.33 14.21 Favored 'General case' 0 C--N 1.353 0.749 0 N-CA-C 114.934 1.457 . . . . 0.0 114.934 -175.038 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 82.2 m-85 -135.88 158.11 45.19 Favored 'General case' 0 C--N 1.354 0.77 0 C-N-CA 128.839 2.856 . . . . 0.0 111.853 177.709 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 23.0 p90 -147.47 156.03 42.47 Favored 'General case' 0 C--N 1.368 1.406 0 C-N-CA 126.412 1.885 . . . . 0.0 110.771 176.029 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' PHE . . . . . 0.454 ' CD2' ' HB2' ' A' ' 57' ' ' CYS . 5.4 t80 -94.82 128.53 41.63 Favored 'General case' 0 C--N 1.376 1.728 0 N-CA-C 106.334 -1.728 . . . . 0.0 106.334 172.392 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -107.42 113.66 27.16 Favored 'General case' 0 N--CA 1.426 -1.638 0 C-N-CA 126.844 2.058 . . . . 0.0 108.135 -176.709 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' TRP . . . . . 0.403 ' HB2' ' O ' ' A' ' 7' ' ' CYS . 32.0 t-105 -49.46 -55.74 12.13 Favored 'General case' 0 C--N 1.359 0.998 0 C-N-CA 130.649 3.58 . . . . 0.0 117.942 -178.27 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.9 p -77.41 -14.72 59.64 Favored 'General case' 0 C--N 1.358 0.954 0 C-N-CA 126.327 1.851 . . . . 0.0 113.503 -178.347 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -88.35 -38.59 15.01 Favored 'General case' 0 C--N 1.363 1.17 0 C-N-CA 124.359 1.064 . . . . 0.0 111.732 174.317 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 60.2 mmtt 74.24 21.51 2.44 Favored 'General case' 0 C--N 1.372 1.548 0 C-N-CA 126.964 2.105 . . . . 0.0 112.682 -179.295 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 38.2 ttpt -147.76 166.92 26.06 Favored 'General case' 0 N--CA 1.437 -1.124 0 C-N-CA 126.852 2.061 . . . . 0.0 106.967 -174.433 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 74.9 m -90.94 144.84 25.26 Favored 'General case' 0 C--N 1.361 1.07 0 C-N-CA 126.044 1.738 . . . . 0.0 112.705 178.187 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 89.3 mt -131.87 148.88 71.66 Favored Pre-proline 0 C--N 1.36 1.052 0 C-N-CA 126.855 2.062 . . . . 0.0 109.559 179.238 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -83.98 152.01 12.7 Favored 'Trans proline' 0 C--N 1.352 0.735 0 C-N-CA 124.776 3.65 . . . . 0.0 111.591 166.532 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.424 ' CZ ' ' HD2' ' A' ' 46' ' ' ARG 0.317 0.8 OUTLIER -138.49 -156.22 0.67 Allowed 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 104.085 -2.561 . . . . 0.0 104.085 170.269 . . . . . . . . 4 4 . 1 . 009 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 48.1 mt -141.08 148.75 40.66 Favored 'General case' 0 CA--C 1.502 -0.901 1 N-CA-C 99.761 -4.163 . . . . 0.0 99.761 176.241 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -124.07 135.65 53.71 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 119.705 1.139 . . . . 0.0 109.759 -178.123 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.9 m -79.68 -10.76 59.84 Favored 'General case' 0 C--N 1.369 1.437 0 N-CA-C 119.433 3.124 . . . . 0.0 119.433 -176.592 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 128.79 -59.14 0.69 Allowed Glycine 0 C--N 1.358 1.795 0 CA-C-N 121.803 2.092 . . . . 0.0 114.464 -178.087 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 30.8 p -144.15 56.82 1.32 Allowed 'General case' 0 C--N 1.35 0.594 0 C-N-CA 125.794 1.638 . . . . 0.0 106.856 -179.364 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -121.16 -48.36 0.29 Allowed Glycine 0 C--N 1.356 1.641 0 C-N-CA 125.637 1.589 . . . . 0.0 110.002 -177.936 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -83.2 153.99 31.22 Favored Glycine 0 C--N 1.361 1.928 0 N-CA-C 116.048 1.179 . . . . 0.0 116.048 177.256 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' ASN . . . . . 0.477 ' H ' ' NH2' ' A' ' 46' ' ' ARG 0.422 10.2 p30 -95.3 -101.25 0.16 Allowed 'General case' 0 CA--C 1.55 0.947 0 N-CA-C 115.676 1.732 . . . . 0.0 115.676 179.696 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -129.39 9.08 5.55 Favored 'General case' 0 C--N 1.369 1.421 0 N-CA-C 117.476 2.399 . . . . 0.0 117.476 -170.341 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 33.7 t30 -109.65 30.29 6.79 Favored 'General case' 0 C--N 1.364 1.224 0 O-C-N 119.761 -1.837 . . . . 0.0 106.642 176.223 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.62 HH21 ' HB2' ' A' ' 12' ' ' ARG . 43.2 mmt-85 -111.42 123.2 49.74 Favored 'General case' 0 C--N 1.368 1.4 0 CA-C-O 124.821 2.248 . . . . 0.0 109.702 -177.59 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 15.6 m-85 -113.55 148.28 36.41 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-N 112.207 -2.27 . . . . 0.0 112.167 -172.494 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -82.79 -27.64 30.82 Favored 'General case' 0 C--N 1.37 1.484 0 C-N-CA 125.931 1.692 . . . . 0.0 114.621 -179.85 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 61.9 p -137.65 173.54 11.54 Favored 'General case' 0 C--N 1.356 0.872 0 N-CA-C 106.588 -1.634 . . . . 0.0 106.588 177.827 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 14.0 tt -67.51 -27.96 40.37 Favored 'Isoleucine or valine' 0 C--N 1.365 1.26 0 C-N-CA 128.226 2.61 . . . . 0.0 114.764 179.003 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -94.35 5.3 70.91 Favored Glycine 0 C--N 1.361 1.947 0 O-C-N 121.251 -0.905 . . . . 0.0 114.464 -173.339 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -91.71 -21.96 20.46 Favored 'General case' 0 C--N 1.359 0.981 0 CA-C-O 122.227 1.013 . . . . 0.0 110.213 172.745 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 40.0 t -64.41 -51.75 61.65 Favored 'General case' 0 C--N 1.359 1.012 0 C-N-CA 130.101 3.36 . . . . 0.0 116.593 -178.709 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.405 ' HB3' ' HG3' ' A' ' 60' ' ' LYS . 4.4 mtp180 -68.65 -29.7 68.24 Favored 'General case' 0 C--N 1.344 0.334 1 C-N-CA 132.051 4.14 . . . . 0.0 116.915 -175.883 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 56.9 tttm -78.72 -10.15 59.66 Favored 'General case' 0 C--N 1.357 0.934 0 C-N-CA 126.625 1.97 . . . . 0.0 113.937 -179.759 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.499 ' HD3' ' CE2' ' A' ' 6' ' ' TYR . 31.6 mttt -98.4 -36.42 9.97 Favored 'General case' 0 C--N 1.359 1.004 0 C-N-CA 127.217 2.207 . . . . 0.0 111.39 175.946 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 57' ' ' CYS . . . . . 0.454 ' HB2' ' CD2' ' A' ' 25' ' ' PHE . 27.8 m -126.52 15.43 7.64 Favored 'General case' 0 C--N 1.357 0.902 0 N-CA-C 118.147 2.647 . . . . 0.0 118.147 -168.763 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 18.3 mt -140.47 -20.07 0.85 Allowed 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 122.596 2.453 . . . . 0.0 113.631 174.915 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 82.69 56.58 2.75 Favored Glycine 0 C--N 1.363 2.081 0 C-N-CA 126.794 2.14 . . . . 0.0 112.279 -172.965 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' LYS . . . . . 0.405 ' HG3' ' HB3' ' A' ' 54' ' ' ARG . 15.9 ptmt . . . . . 0 C--O 1.261 1.697 0 CA-C-O 116.62 -1.657 . . . . 0.0 107.394 -175.294 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 21.0 t90 . . . . . 0 N--CA 1.436 -1.165 0 CA-C-O 122.721 1.248 . . . . 0.0 110.397 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 80.7 mt-30 -140.23 151.99 65.94 Favored Pre-proline 0 C--N 1.357 0.896 1 N-CA-C 99.264 -4.347 . . . . 0.0 99.264 172.482 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.447 ' HA ' ' HD3' ' A' ' 4' ' ' PRO . 4.8 Cg_exo -81.2 117.69 3.2 Favored 'Trans proline' 0 CA--C 1.551 1.341 0 CA-C-N 126.14 3.228 . . . . 0.0 117.047 -164.275 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.447 ' HD3' ' HA ' ' A' ' 3' ' ' PRO . 17.1 Cg_exo -77.56 -117.01 0.01 OUTLIER 'Trans proline' 0 C--N 1.366 1.454 1 C-N-CA 126.003 4.469 . . . . 0.0 114.199 176.931 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 5' ' ' TRP . . . . . 0.483 ' CE2' ' CE1' ' A' ' 6' ' ' TYR . 52.0 p-90 -87.22 -68.01 0.78 Allowed 'General case' 0 C--N 1.374 1.657 0 C-N-CA 126.339 1.856 . . . . 0.0 115.011 -179.565 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.483 ' CE1' ' CE2' ' A' ' 5' ' ' TRP . 0.1 OUTLIER -31.73 -60.53 0.24 Allowed 'General case' 0 C--N 1.359 0.985 1 C-N-CA 134.296 5.038 . . . . 0.0 118.58 -173.818 . . . . . . . . 4 4 . 1 . 010 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.405 ' O ' ' HB2' ' A' ' 27' ' ' TRP . 3.3 m -52.87 -40.24 63.27 Favored 'General case' 0 CA--C 1.497 -1.07 1 C-N-CA 131.987 4.115 . . . . 0.0 116.34 -176.129 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . 0.273 57.0 tttm -113.87 22.11 14.28 Favored 'General case' 0 N--CA 1.428 -1.569 0 C-N-CA 128.385 2.674 . . . . 0.0 108.166 -174.404 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.431 ' HA ' ' HD3' ' A' ' 10' ' ' PRO . 14.6 tp10 -95.36 138.74 21.85 Favored Pre-proline 0 C--N 1.374 1.64 0 O-C-N 120.325 -1.484 . . . . 0.0 112.148 -174.327 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.431 ' HD3' ' HA ' ' A' ' 9' ' ' GLU . 46.5 Cg_exo -70.05 110.18 2.55 Favored 'Trans proline' 0 C--N 1.363 1.333 0 C-N-CA 124.227 3.285 . . . . 0.0 112.555 -174.518 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 8.6 p -72.95 132.13 33.86 Favored 'Isoleucine or valine' 0 C--N 1.36 1.031 0 C-N-CA 128.057 2.543 . . . . 0.0 110.519 178.303 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . 0.252 41.1 mmt-85 -132.28 136.54 47.01 Favored 'General case' 0 CA--C 1.496 -1.123 0 C-N-CA 126.16 1.784 . . . . 0.0 106.645 -169.87 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.302 16.7 tt -97.67 -41.01 10.51 Favored 'Isoleucine or valine' 0 C--N 1.37 1.473 0 CA-C-N 119.924 1.238 . . . . 0.0 111.494 175.279 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 118.51 -151.94 17.61 Favored Glycine 0 C--N 1.362 1.982 0 C-N-CA 124.351 0.977 . . . . 0.0 115.303 172.914 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 70.5 m -153.65 38.85 0.48 Allowed 'General case' 0 C--N 1.362 1.151 0 O-C-N 119.123 -2.398 . . . . 0.0 108.672 178.405 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -98.04 179.1 4.89 Favored 'General case' 0 C--N 1.357 0.913 0 C-N-CA 128.322 2.649 . . . . 0.0 110.398 178.758 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 14.0 mmmm -102.85 36.83 2.09 Favored 'General case' 0 C--N 1.352 0.688 0 O-C-N 120.104 -1.623 . . . . 0.0 112.367 -175.719 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 1.5 tpmt? -148.35 168.28 23.0 Favored 'General case' 0 C--N 1.364 1.197 0 C-N-CA 124.231 1.012 . . . . 0.0 109.809 179.187 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 13.8 mm-40 -147.06 112.43 5.56 Favored 'General case' 0 N--CA 1.441 -0.907 0 C-N-CA 128.767 2.827 . . . . 0.0 105.104 169.357 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 82.9 m-85 -104.63 133.02 50.18 Favored 'General case' 0 C--N 1.354 0.768 0 O-C-N 119.886 -1.759 . . . . 0.0 107.609 174.424 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' SER . . . . . 0.455 ' HA ' ' HG ' ' A' ' 36' ' ' LEU . 5.1 t -69.49 125.72 27.58 Favored 'General case' 0 C--N 1.377 1.777 0 CA-C-N 122.179 2.263 . . . . 0.0 115.337 179.831 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 4.5 p -138.49 -169.37 2.58 Favored 'General case' 0 C--N 1.352 0.691 0 C-N-CA 128.043 2.537 . . . . 0.0 111.805 -173.297 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 79.9 m-85 -140.3 153.03 46.32 Favored 'General case' 0 C--N 1.359 0.979 0 C-N-CA 129.569 3.148 . . . . 0.0 112.008 176.042 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . 0.288 4.1 p90 -144.18 163.48 33.48 Favored 'General case' 0 C--N 1.376 1.73 0 C-N-CA 127.038 2.135 . . . . 0.0 109.816 170.683 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 16.0 t80 -99.53 128.32 45.63 Favored 'General case' 0 C--N 1.369 1.418 0 C-N-CA 125.693 1.597 . . . . 0.0 108.918 -179.07 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.503 ' NZ ' ' H ' ' A' ' 28' ' ' THR . 0.0 OUTLIER -91.29 112.17 23.97 Favored 'General case' 0 C--N 1.372 1.569 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 175.25 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 27' ' ' TRP . . . . . 0.456 ' N ' ' HZ2' ' A' ' 26' ' ' LYS . 16.9 t-105 -61.29 -40.67 95.01 Favored 'General case' 0 C--N 1.349 0.552 0 C-N-CA 128.918 2.887 . . . . 0.0 115.057 177.813 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.503 ' H ' ' NZ ' ' A' ' 26' ' ' LYS 0.318 46.4 p -83.24 -25.54 31.59 Favored 'General case' 0 C--N 1.36 1.03 0 C-N-CA 123.626 0.771 . . . . 0.0 112.504 176.402 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.4 ' HB3' ' HB3' ' A' ' 26' ' ' LYS . . . -82.19 -39.76 22.69 Favored 'General case' 0 C--N 1.379 1.864 0 CA-C-N 120.826 1.648 . . . . 0.0 114.036 172.351 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . 0.274 24.3 tptt 84.09 25.77 0.1 Allowed 'General case' 0 C--N 1.365 1.269 0 C-N-CA 129.007 2.923 . . . . 0.0 113.417 178.841 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 23.6 tptp -147.39 170.39 17.46 Favored 'General case' 0 C--N 1.357 0.895 0 C-N-CA 126.035 1.734 . . . . 0.0 106.786 179.822 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 78.8 m -85.61 142.16 29.29 Favored 'General case' 0 C--N 1.355 0.824 0 C-N-CA 127.786 2.434 . . . . 0.0 113.458 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 13.8 mt -127.14 149.71 70.24 Favored Pre-proline 0 C--N 1.356 0.879 0 C-N-CA 125.566 1.547 . . . . 0.0 109.388 178.382 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 65.3 Cg_endo -82.36 154.28 16.26 Favored 'Trans proline' 0 C--N 1.348 0.55 0 C-N-CA 123.928 3.085 . . . . 0.0 111.066 164.07 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 1.4 p90 -152.35 171.76 17.52 Favored 'General case' 0 N--CA 1.448 -0.559 1 N-CA-C 99.659 -4.2 . . . . 0.0 99.659 170.899 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.455 ' HG ' ' HA ' ' A' ' 21' ' ' SER . 7.8 mp -110.65 156.98 20.23 Favored 'General case' 0 N--CA 1.44 -0.942 0 N-CA-C 105.436 -2.061 . . . . 0.0 105.436 174.001 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 3.1 t80 -119.5 130.32 55.15 Favored 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 126.609 1.964 . . . . 0.0 108.332 179.603 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 43.2 m -83.78 -33.22 25.04 Favored 'General case' 0 C--N 1.361 1.097 0 N-CA-C 115.842 1.794 . . . . 0.0 115.842 178.891 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 121.37 -67.13 0.45 Allowed Glycine 0 C--N 1.355 1.601 0 C-N-CA 125.286 1.422 . . . . 0.0 113.682 -176.57 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 18.3 p -93.78 124.23 37.64 Favored 'General case' 0 C--N 1.355 0.833 0 O-C-N 120.652 -1.499 . . . . 0.0 110.106 179.096 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 105.53 -16.11 44.95 Favored Glycine 0 C--N 1.361 1.935 0 O-C-N 121.564 -0.71 . . . . 0.0 112.616 -175.904 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -81.19 165.85 47.48 Favored Glycine 0 C--N 1.364 2.126 0 CA-C-N 118.671 1.236 . . . . 0.0 114.722 173.079 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -155.22 118.52 4.42 Favored 'General case' 0 C--N 1.36 1.058 0 N-CA-C 116.24 1.941 . . . . 0.0 116.24 -178.963 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . 41.77 -34.63 0.0 OUTLIER 'General case' 0 C--N 1.368 1.373 2 N-CA-C 124.213 4.894 . . . . 0.0 124.213 170.828 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 53.7 t30 -93.25 72.13 4.53 Favored 'General case' 0 C--N 1.36 1.047 0 C-N-CA 125.715 1.606 . . . . 0.0 109.87 -175.598 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 5.4 ptp180 -148.3 131.38 16.32 Favored 'General case' 0 CA--C 1.508 -0.671 0 CA-C-O 123.916 1.817 . . . . 0.0 108.734 176.636 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' PHE . . . . . 0.422 ' CD2' ' HA ' ' A' ' 53' ' ' CYS . 13.9 m-85 -106.34 142.24 36.33 Favored 'General case' 0 C--N 1.349 0.571 0 C-N-CA 126.696 1.998 . . . . 0.0 109.322 -174.02 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.43 -37.4 60.42 Favored 'General case' 0 C--N 1.372 1.572 0 N-CA-C 114.965 1.468 . . . . 0.0 114.965 -178.332 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 72.8 p -123.29 -179.63 4.38 Favored 'General case' 0 C--N 1.361 1.081 0 C-N-CA 127.079 2.151 . . . . 0.0 107.863 175.561 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 18.6 tt -76.77 -16.28 14.78 Favored 'Isoleucine or valine' 0 C--N 1.364 1.206 0 C-N-CA 127.91 2.484 . . . . 0.0 113.594 174.513 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -96.59 -8.28 57.39 Favored Glycine 0 C--N 1.366 2.241 0 O-C-N 120.454 -1.404 . . . . 0.0 115.252 -178.779 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 14.0 tp10 -85.87 -18.8 31.77 Favored 'General case' 0 C--N 1.362 1.147 0 C-N-CA 125.509 1.524 . . . . 0.0 111.603 175.078 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' CYS . . . . . 0.422 ' HA ' ' CD2' ' A' ' 47' ' ' PHE . 52.9 t -63.51 -61.47 2.31 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 128.312 2.645 . . . . 0.0 114.779 179.99 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 6.7 ptt180 -68.92 -13.41 62.41 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 129.953 3.301 . . . . 0.0 118.632 -177.844 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 17.6 mmtp -68.34 -52.78 29.46 Favored 'General case' 0 C--N 1.366 1.309 0 C-N-CA 126.452 1.901 . . . . 0.0 112.647 176.977 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.455 ' HD2' ' CD1' ' A' ' 6' ' ' TYR . 32.3 mtmt -68.7 -24.63 64.51 Favored 'General case' 0 C--N 1.356 0.858 0 C-N-CA 130.419 3.488 . . . . 0.0 113.623 176.971 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 90.7 m -128.37 5.39 5.73 Favored 'General case' 0 C--N 1.359 0.981 0 N-CA-C 119.166 3.024 . . . . 0.0 119.166 -170.04 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 13.5 mt -134.99 -15.58 1.99 Allowed 'General case' 0 N--CA 1.473 0.696 0 CA-C-N 123.15 2.704 . . . . 0.0 111.267 172.441 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 75.9 63.65 2.39 Favored Glycine 0 C--N 1.363 2.03 0 C-N-CA 128.252 2.834 . . . . 0.0 112.47 -168.391 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 14.2 ptmt . . . . . 0 C--O 1.262 1.724 0 CA-C-O 115.655 -2.117 . . . . 0.0 107.134 -176.442 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 5.5 t90 . . . . . 0 N--CA 1.433 -1.292 0 N-CA-C 106.014 -1.847 . . . . 0.0 106.014 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 32.4 mt-30 -139.45 148.55 56.87 Favored Pre-proline 0 C--N 1.355 0.825 1 N-CA-C 100.008 -4.071 . . . . 0.0 100.008 172.093 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -74.23 124.23 8.85 Favored 'Trans proline' 0 CA--C 1.555 1.533 0 C-N-CA 123.491 2.794 . . . . 0.0 115.516 -169.562 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.524 ' HG2' ' CD2' ' A' ' 6' ' ' TYR . 43.2 Cg_endo -93.3 -113.4 0.0 OUTLIER 'Trans proline' 0 CA--C 1.549 1.227 1 C-N-CA 126.569 4.846 . . . . 0.0 111.174 -179.446 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 5' ' ' TRP . . . . . 0.47 ' CE3' ' CD1' ' A' ' 6' ' ' TYR 0.272 47.7 p-90 -86.49 -70.62 0.59 Allowed 'General case' 0 C--N 1.383 2.023 0 C-N-CA 126.929 2.091 . . . . 0.0 114.483 178.591 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.524 ' CD2' ' HG2' ' A' ' 4' ' ' PRO . 0.1 OUTLIER -31.72 -55.66 0.28 Allowed 'General case' 0 C--N 1.36 1.061 1 C-N-CA 133.277 4.631 . . . . 0.0 118.887 -173.663 . . . . . . . . 4 4 . 1 . 011 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 3.2 m -59.52 -33.21 71.09 Favored 'General case' 0 CA--C 1.498 -1.038 0 C-N-CA 130.215 3.406 . . . . 0.0 117.638 -173.95 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . 0.303 65.3 tttm -117.14 18.31 14.59 Favored 'General case' 0 N--CA 1.436 -1.152 0 C-N-CA 128.978 2.911 . . . . 0.0 107.958 -176.232 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.402 ' HA ' ' HD3' ' A' ' 10' ' ' PRO . 23.3 tp10 -93.64 131.46 32.24 Favored Pre-proline 0 C--N 1.366 1.291 0 O-C-N 120.398 -1.439 . . . . 0.0 112.919 -173.419 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.402 ' HD3' ' HA ' ' A' ' 9' ' ' GLU . 77.9 Cg_exo -63.63 119.27 6.26 Favored 'Trans proline' 0 C--N 1.362 1.239 0 C-N-CA 124.368 3.379 . . . . 0.0 116.452 -167.348 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 11.1 p -69.11 141.14 17.74 Favored 'Isoleucine or valine' 0 C--N 1.359 0.989 0 C-N-CA 125.308 1.443 . . . . 0.0 114.256 178.815 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.515 ' HB2' HH22 ' A' ' 46' ' ' ARG . 9.5 mmm180 -131.07 -160.56 1.05 Allowed 'General case' 0 N--CA 1.438 -1.045 0 C-N-CA 126.06 1.744 . . . . 0.0 110.969 -174.911 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 11.1 tt -159.07 -35.8 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.427 -1.576 0 C-N-CA 128.283 2.633 . . . . 0.0 109.454 171.663 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.459 ' H ' ' NH2' ' A' ' 12' ' ' ARG . . . 106.97 -62.81 0.3 Allowed Glycine 0 C--N 1.356 1.682 0 N-CA-C 108.574 -1.811 . . . . 0.0 108.574 -173.054 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . 0.337 69.0 m 90.89 49.5 0.0 OUTLIER 'General case' 0 C--N 1.354 0.799 0 C-N-CA 129.552 3.141 . . . . 0.0 111.17 178.019 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -92.41 -158.77 0.61 Allowed 'General case' 0 C--N 1.359 0.995 0 CA-C-O 123.981 1.848 . . . . 0.0 110.901 176.198 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 13.2 mmmm -88.06 -12.71 43.48 Favored 'General case' 0 N--CA 1.453 -0.317 0 N-CA-C 117.01 2.226 . . . . 0.0 117.01 -171.595 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 76.0 tttt -148.43 141.56 24.98 Favored 'General case' 0 C--N 1.361 1.099 0 O-C-N 120.149 -1.594 . . . . 0.0 108.159 176.776 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 10.0 mp0 -100.18 122.7 43.42 Favored 'General case' 0 C--N 1.355 0.809 0 C-N-CA 125.923 1.689 . . . . 0.0 108.218 179.376 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 7.1 m-85 -110.27 134.91 51.79 Favored 'General case' 0 C--N 1.359 0.997 0 N-CA-C 104.62 -2.363 . . . . 0.0 104.62 177.909 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 3.8 t -69.36 141.02 54.29 Favored 'General case' 0 C--N 1.365 1.282 0 CA-C-N 121.809 2.095 . . . . 0.0 116.172 -175.207 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 20.1 p -138.19 -171.15 2.96 Favored 'General case' 0 C--N 1.358 0.976 0 C-N-CA 126.849 2.06 . . . . 0.0 111.108 179.385 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 -139.91 147.06 40.03 Favored 'General case' 0 C--N 1.362 1.109 0 C-N-CA 127.37 2.268 . . . . 0.0 110.709 172.577 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 9.7 p90 -137.85 162.9 32.78 Favored 'General case' 0 C--N 1.373 1.607 0 C-N-CA 126.411 1.884 . . . . 0.0 109.558 172.723 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' PHE . . . . . 0.407 ' CZ ' ' HG ' ' A' ' 58' ' ' LEU . 11.7 t80 -100.19 127.05 46.53 Favored 'General case' 0 C--N 1.362 1.11 0 O-C-N 120.598 -1.314 . . . . 0.0 107.726 179.694 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.648 ' HD2' HD11 ' A' ' 33' ' ' LEU . 36.4 tttm -86.62 104.93 16.51 Favored 'General case' 0 C--N 1.371 1.528 0 O-C-N 121.335 -0.853 . . . . 0.0 111.102 178.126 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 43.3 t-105 -52.01 -46.49 64.96 Favored 'General case' 0 C--N 1.364 1.197 0 C-N-CA 128.863 2.865 . . . . 0.0 116.811 -176.279 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 2.2 p -88.32 1.25 55.0 Favored 'General case' 0 C--N 1.349 0.57 0 C-N-CA 125.53 1.532 . . . . 0.0 113.578 179.567 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -109.87 -40.27 4.83 Favored 'General case' 0 C--N 1.36 1.057 0 O-C-N 120.95 -1.094 . . . . 0.0 111.54 176.402 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . 0.253 26.9 tptt 86.39 27.16 0.05 OUTLIER 'General case' 0 C--N 1.363 1.187 0 C-N-CA 127.953 2.501 . . . . 0.0 113.54 179.523 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 61.4 tttp -146.48 159.55 43.26 Favored 'General case' 0 C--N 1.356 0.886 0 C-N-CA 125.422 1.489 . . . . 0.0 108.102 -178.321 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 76.5 m -79.72 140.77 36.85 Favored 'General case' 0 C--N 1.364 1.214 0 C-N-CA 127.717 2.407 . . . . 0.0 112.449 177.03 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.648 HD11 ' HD2' ' A' ' 26' ' ' LYS . 19.1 mt -128.32 157.38 74.68 Favored Pre-proline 0 C--N 1.355 0.807 0 C-N-CA 126.209 1.804 . . . . 0.0 109.183 177.274 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -88.11 167.77 6.67 Favored 'Trans proline' 0 N--CA 1.455 -0.745 0 C-N-CA 123.815 3.01 . . . . 0.0 111.412 167.976 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 5.4 p90 -163.32 -176.71 4.91 Favored 'General case' 0 N--CA 1.445 -0.683 0 N-CA-C 102.005 -3.331 . . . . 0.0 102.005 172.61 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -125.21 147.01 49.26 Favored 'General case' 0 N--CA 1.423 -1.808 0 N-CA-C 104.929 -2.249 . . . . 0.0 104.929 173.916 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.404 ' CZ ' ' HA2' ' A' ' 39' ' ' GLY . 36.8 t80 -111.1 137.69 48.45 Favored 'General case' 0 CA--C 1.533 0.302 0 N-CA-C 104.607 -2.368 . . . . 0.0 104.607 173.316 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 77.5 p -104.78 -2.3 25.01 Favored 'General case' 0 C--N 1.365 1.266 0 C-N-CA 125.521 1.528 . . . . 0.0 112.386 -178.665 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' GLY . . . . . 0.404 ' HA2' ' CZ ' ' A' ' 37' ' ' PHE . . . 94.11 -59.6 2.0 Favored Glycine 0 C--N 1.356 1.643 0 O-C-N 120.029 -1.669 . . . . 0.0 115.252 170.419 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.9 m -73.09 62.27 0.63 Allowed 'General case' 0 C--N 1.354 0.802 0 C-N-CA 127.876 2.471 . . . . 0.0 116.036 -176.432 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 127.77 34.79 0.54 Allowed Glycine 0 C--N 1.357 1.737 0 N-CA-C 119.344 2.497 . . . . 0.0 119.344 168.687 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -94.31 170.98 30.49 Favored Glycine 0 C--N 1.368 2.316 0 CA-C-N 121.793 2.796 . . . . 0.0 111.524 175.937 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . 0.312 27.2 p30 -88.9 -99.17 0.09 Allowed 'General case' 0 C--N 1.365 1.262 0 N-CA-C 117.297 2.332 . . . . 0.0 117.297 -178.087 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -144.78 -9.38 0.62 Allowed 'General case' 0 C--N 1.353 0.719 0 O-C-N 120.461 -1.399 . . . . 0.0 114.175 -171.989 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 61.3 t30 -94.93 77.44 3.59 Favored 'General case' 0 C--N 1.357 0.895 0 O-C-N 119.97 -1.706 . . . . 0.0 114.313 -177.781 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.515 HH22 ' HB2' ' A' ' 12' ' ' ARG 0.406 0.0 OUTLIER -145.17 145.03 31.19 Favored 'General case' 0 C--N 1.357 0.898 0 CA-C-O 124.542 2.115 . . . . 0.0 113.745 169.229 . . . . . . . . 4 4 . 1 . 011 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 12.0 m-85 -111.32 133.68 53.47 Favored 'General case' 0 C--N 1.353 0.744 0 C-N-CA 128.025 2.53 . . . . 0.0 108.249 -177.386 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 4.2 mp0 -74.44 -55.04 6.41 Favored 'General case' 0 C--N 1.371 1.523 0 C-N-CA 126.492 1.917 . . . . 0.0 113.132 -178.095 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 9.8 p -111.69 160.79 16.93 Favored 'General case' 0 C--N 1.354 0.804 0 N-CA-C 104.958 -2.238 . . . . 0.0 104.958 174.939 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 16.4 tt -59.49 -30.13 43.81 Favored 'Isoleucine or valine' 0 C--N 1.361 1.095 0 N-CA-C 117.42 2.378 . . . . 0.0 117.42 -175.026 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -96.22 13.59 65.6 Favored Glycine 0 C--N 1.357 1.73 0 O-C-N 119.926 -1.734 . . . . 0.0 115.293 -179.168 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 16.1 tp10 -89.84 -4.58 57.52 Favored 'General case' 0 C--N 1.364 1.22 0 CA-C-O 122.899 1.333 . . . . 0.0 109.845 171.107 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 18.7 t -79.78 -39.03 31.8 Favored 'General case' 0 C--N 1.359 1.0 1 C-N-CA 132.687 4.395 . . . . 0.0 112.843 179.668 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 55.2 mtp180 -69.01 -47.31 65.8 Favored 'General case' 0 C--N 1.34 0.17 1 C-N-CA 133.925 4.89 . . . . 0.0 117.486 -178.532 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 87.3 tttt -66.94 -30.88 71.14 Favored 'General case' 0 C--N 1.362 1.13 0 C-N-CA 127.827 2.451 . . . . 0.0 113.727 -178.878 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.412 ' HD2' ' CD1' ' A' ' 6' ' ' TYR . 20.3 mtmm -87.88 -36.05 17.39 Favored 'General case' 0 C--N 1.359 1.02 0 C-N-CA 127.876 2.47 . . . . 0.0 112.192 174.636 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 97.6 m -127.04 2.82 6.52 Favored 'General case' 0 C--N 1.369 1.427 0 N-CA-C 120.725 3.602 . . . . 0.0 120.725 -171.725 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.407 ' HG ' ' CZ ' ' A' ' 25' ' ' PHE . 14.7 mt -130.4 -26.28 2.32 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 122.215 2.28 . . . . 0.0 110.756 170.365 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 88.9 52.64 2.73 Favored Glycine 0 C--N 1.361 1.963 0 C-N-CA 128.646 3.022 . . . . 0.0 111.327 -172.278 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 19.3 ptmt . . . . . 0 C--O 1.259 1.59 0 CA-C-N 118.377 1.089 . . . . 0.0 111.033 -172.934 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 84.7 t90 . . . . . 0 N--CA 1.434 -1.229 0 CA-C-O 122.149 0.976 . . . . 0.0 108.681 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 24.2 mm-40 -144.32 148.48 41.1 Favored Pre-proline 0 C--N 1.349 0.584 1 N-CA-C 98.296 -4.705 . . . . 0.0 98.296 170.733 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.426 ' HA ' ' HD3' ' A' ' 4' ' ' PRO . 2.9 Cg_endo -74.47 120.33 6.17 Favored 'Trans proline' 0 CA--C 1.555 1.548 0 CA-C-N 124.701 2.715 . . . . 0.0 116.023 -168.511 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.426 ' HD3' ' HA ' ' A' ' 3' ' ' PRO . 24.1 Cg_exo -77.41 -120.22 0.01 OUTLIER 'Trans proline' 0 C--N 1.369 1.657 1 C-N-CA 126.968 5.112 . . . . 0.0 113.587 175.639 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 5' ' ' TRP . . . . . 0.482 ' CE3' ' CD1' ' A' ' 6' ' ' TYR . 0.4 OUTLIER -86.66 -68.16 0.76 Allowed 'General case' 0 C--N 1.379 1.885 0 C-N-CA 126.955 2.102 . . . . 0.0 113.432 177.557 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.482 ' CD1' ' CE3' ' A' ' 5' ' ' TRP . 0.1 OUTLIER -31.13 -51.46 0.17 Allowed 'General case' 0 C--N 1.363 1.191 1 C-N-CA 133.97 4.908 . . . . 0.0 117.591 -172.844 . . . . . . . . 4 4 . 1 . 012 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.41 ' O ' ' HB2' ' A' ' 27' ' ' TRP . 2.9 m -57.87 -43.49 86.04 Favored 'General case' 0 CA--C 1.511 -0.519 0 C-N-CA 129.925 3.29 . . . . 0.0 116.007 -175.708 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 26.7 mtpp -103.8 17.38 24.23 Favored 'General case' 0 C--N 1.357 0.904 0 C-N-CA 127.231 2.212 . . . . 0.0 109.908 177.261 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.462 ' HA ' ' HD3' ' A' ' 10' ' ' PRO . 29.7 tp10 -90.22 127.06 54.76 Favored Pre-proline 0 C--N 1.361 1.072 0 O-C-N 120.468 -1.395 . . . . 0.0 112.234 -170.893 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.462 ' HD3' ' HA ' ' A' ' 9' ' ' GLU . 50.0 Cg_exo -67.88 122.51 9.64 Favored 'Trans proline' 0 C--N 1.364 1.371 0 C-N-CA 124.08 3.186 . . . . 0.0 114.43 -165.977 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 7.8 p -69.78 134.06 30.78 Favored 'Isoleucine or valine' 0 C--N 1.357 0.918 0 C-N-CA 126.692 1.997 . . . . 0.0 112.674 -179.767 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 46.8 mtt180 -135.05 125.18 25.99 Favored 'General case' 0 C--N 1.359 0.981 0 CA-C-O 117.134 -1.412 . . . . 0.0 109.109 -175.486 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.267 17.3 tt -96.2 -38.73 8.63 Favored 'Isoleucine or valine' 0 C--N 1.37 1.486 0 CA-C-N 120.16 1.345 . . . . 0.0 112.106 175.398 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 114.4 -144.67 18.39 Favored Glycine 0 C--N 1.357 1.7 0 C-N-CA 125.805 1.669 . . . . 0.0 113.846 177.348 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 71.4 m -158.36 40.73 0.26 Allowed 'General case' 0 C--N 1.36 1.041 0 O-C-N 119.018 -2.46 . . . . 0.0 108.192 179.772 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -104.38 -175.56 2.83 Favored 'General case' 0 C--N 1.356 0.87 0 CA-C-O 124.555 2.122 . . . . 0.0 110.08 179.917 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 14.0 mmmm -111.14 39.35 2.3 Favored 'General case' 0 C--N 1.344 0.329 0 C-N-CA 125.669 1.588 . . . . 0.0 110.824 -177.966 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 16.6 tppt? -146.33 156.53 43.4 Favored 'General case' 0 N--CA 1.439 -1.024 0 N-CA-C 104.192 -2.521 . . . . 0.0 104.192 179.525 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 6.5 mp0 -147.94 118.83 7.61 Favored 'General case' 0 N--CA 1.433 -1.303 0 N-CA-C 105.054 -2.202 . . . . 0.0 105.054 171.843 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 73.5 m-85 -103.4 145.07 30.54 Favored 'General case' 0 C--N 1.353 0.723 0 N-CA-C 105.718 -1.956 . . . . 0.0 105.718 171.04 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 3.7 t -72.75 142.65 48.13 Favored 'General case' 0 C--N 1.371 1.534 0 CA-C-N 122.063 2.211 . . . . 0.0 115.146 -177.997 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 80.6 p -146.82 -169.38 3.28 Favored 'General case' 0 C--N 1.361 1.089 0 C-N-CA 125.553 1.541 . . . . 0.0 113.606 -175.948 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 62.0 m-85 -145.63 149.28 34.22 Favored 'General case' 0 C--N 1.361 1.095 0 C-N-CA 130.384 3.474 . . . . 0.0 110.777 175.929 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 9.4 p90 -143.49 154.46 43.67 Favored 'General case' 0 C--N 1.365 1.271 0 C-N-CA 127.44 2.296 . . . . 0.0 109.691 174.456 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 11.5 t80 -94.49 121.87 36.48 Favored 'General case' 0 C--N 1.371 1.523 0 N-CA-C 106.269 -1.752 . . . . 0.0 106.269 177.404 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.11 102.56 14.37 Favored 'General case' 0 N--CA 1.431 -1.383 0 CA-C-O 122.032 0.92 . . . . 0.0 110.282 178.709 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' TRP . . . . . 0.41 ' HB2' ' O ' ' A' ' 7' ' ' CYS . 14.9 t-105 -48.11 -46.36 33.99 Favored 'General case' 0 C--N 1.355 0.824 0 C-N-CA 130.26 3.424 . . . . 0.0 118.266 -174.93 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 3.0 p -79.08 -18.6 53.08 Favored 'General case' 0 C--N 1.358 0.941 0 C-N-CA 125.675 1.59 . . . . 0.0 112.98 179.191 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -87.54 -40.81 13.95 Favored 'General case' 0 C--N 1.366 1.324 0 C-N-CA 124.401 1.08 . . . . 0.0 111.18 172.936 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . 0.297 0.0 OUTLIER 77.45 30.2 0.51 Allowed 'General case' 0 C--N 1.363 1.179 0 C-N-CA 128.94 2.896 . . . . 0.0 113.41 179.349 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 53.2 tptt -148.35 167.39 25.34 Favored 'General case' 0 C--N 1.358 0.971 0 C-N-CA 127.247 2.219 . . . . 0.0 107.204 176.899 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 92.7 m -78.67 138.26 38.21 Favored 'General case' 0 C--N 1.357 0.93 0 C-N-CA 128.481 2.713 . . . . 0.0 114.822 178.971 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 12.0 mt -122.95 148.44 54.06 Favored Pre-proline 0 C--N 1.359 1.013 0 C-N-CA 125.846 1.659 . . . . 0.0 109.328 176.19 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 63.3 Cg_endo -82.8 159.5 16.2 Favored 'Trans proline' 0 CA--C 1.535 0.527 0 C-N-CA 123.115 2.543 . . . . 0.0 111.689 167.311 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . 0.317 2.0 p90 -150.97 -160.27 1.15 Allowed 'General case' 0 C--N 1.347 0.468 0 N-CA-C 104.888 -2.264 . . . . 0.0 104.888 169.796 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 18.8 mt -140.87 153.11 45.58 Favored 'General case' 0 N--CA 1.436 -1.128 0 N-CA-C 101.83 -3.396 . . . . 0.0 101.83 175.472 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -121.95 130.59 53.45 Favored 'General case' 0 N--CA 1.469 0.484 0 N-CA-C 105.071 -2.196 . . . . 0.0 105.071 178.035 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 89.3 p -77.84 -82.54 0.09 Allowed 'General case' 0 C--N 1.37 1.48 0 O-C-N 121.13 -0.981 . . . . 0.0 112.2 179.733 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 176.7 -59.6 0.1 Allowed Glycine 0 CA--C 1.488 -1.597 0 N-CA-C 108.99 -1.644 . . . . 0.0 108.99 173.565 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 20.2 p -83.73 79.42 9.47 Favored 'General case' 0 C--N 1.359 1.018 0 C-N-CA 126.692 1.997 . . . . 0.0 112.963 179.694 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 144.4 19.36 0.19 Allowed Glycine 0 C--N 1.352 1.425 0 N-CA-C 116.933 1.533 . . . . 0.0 116.933 174.557 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -71.14 176.07 38.06 Favored Glycine 0 C--N 1.366 2.204 0 N-CA-C 119.711 2.645 . . . . 0.0 119.711 175.692 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' ASN . . . . . 0.445 ' H ' ' CZ ' ' A' ' 46' ' ' ARG . 36.0 t-20 -136.76 -156.68 0.72 Allowed 'General case' 0 C--N 1.353 0.726 0 C-N-CA 125.392 1.477 . . . . 0.0 109.114 -174.596 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -99.44 -15.87 18.57 Favored 'General case' 0 C--N 1.354 0.784 0 O-C-N 120.256 -1.527 . . . . 0.0 114.261 -176.869 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 63.0 t30 -94.5 73.83 3.79 Favored 'General case' 0 C--N 1.363 1.165 0 O-C-N 119.653 -1.904 . . . . 0.0 110.396 -178.555 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.445 ' CZ ' ' H ' ' A' ' 43' ' ' ASN 0.303 0.0 OUTLIER -137.21 127.59 26.54 Favored 'General case' 0 C--N 1.352 0.704 0 CA-C-O 124.135 1.921 . . . . 0.0 109.759 172.02 . . . . . . . . 4 4 . 1 . 012 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 23.4 m-85 -108.06 142.99 37.4 Favored 'General case' 0 C--N 1.353 0.748 0 C-N-CA 127.364 2.266 . . . . 0.0 109.011 -175.248 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 32.5 mt-30 -66.12 -68.63 0.35 Allowed 'General case' 0 C--N 1.365 1.255 0 C-N-CA 128.57 2.748 . . . . 0.0 113.49 -178.544 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 40.9 p -119.12 170.65 8.88 Favored 'General case' 0 C--N 1.354 0.793 0 C-N-CA 124.955 1.302 . . . . 0.0 108.788 176.901 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 16.0 tt -58.72 -26.78 32.72 Favored 'Isoleucine or valine' 0 C--N 1.361 1.105 0 C-N-CA 128.46 2.704 . . . . 0.0 116.297 178.664 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -86.04 -16.9 62.15 Favored Glycine 0 C--N 1.36 1.88 0 O-C-N 120.282 -1.511 . . . . 0.0 116.088 175.35 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 15.2 tp10 -82.9 -25.58 32.33 Favored 'General case' 0 C--N 1.371 1.52 0 CA-C-N 120.358 2.079 . . . . 0.0 111.349 176.313 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 9.6 t -59.84 -44.6 93.99 Favored 'General case' 0 CA--C 1.559 1.293 0 C-N-CA 127.526 2.33 . . . . 0.0 115.955 177.524 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 5.4 ptt180 -82.24 -18.66 41.72 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 126.509 1.923 . . . . 0.0 113.645 178.087 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 36.1 ttmt -75.46 -16.42 60.32 Favored 'General case' 0 C--N 1.361 1.091 0 C-N-CA 126.797 2.039 . . . . 0.0 114.656 178.552 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.426 ' HD2' ' CD1' ' A' ' 6' ' ' TYR . 5.4 ttmt -103.98 -24.33 13.25 Favored 'General case' 0 C--N 1.361 1.098 0 C-N-CA 126.208 1.803 . . . . 0.0 110.82 175.985 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 57' ' ' CYS . . . . . 0.444 ' SG ' ' HB2' ' A' ' 6' ' ' TYR . 34.4 m -127.21 10.38 6.85 Favored 'General case' 0 C--N 1.364 1.21 0 N-CA-C 118.031 2.604 . . . . 0.0 118.031 -169.14 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 12.1 mt -139.34 -18.67 0.98 Allowed 'General case' 0 C--N 1.35 0.614 0 CA-C-N 121.838 2.108 . . . . 0.0 112.87 172.256 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 82.05 51.53 4.42 Favored Glycine 0 C--N 1.362 1.988 0 C-N-CA 127.589 2.518 . . . . 0.0 111.673 -171.275 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 12.8 mtpt . . . . . 0 C--O 1.262 1.743 0 C-N-CA 124.76 1.224 . . . . 0.0 108.232 -177.024 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' TRP . . . . . 0.5 ' CZ2' ' HB3' ' A' ' 3' ' ' PRO . 83.0 t90 . . . . . 0 N--CA 1.432 -1.338 0 N-CA-C 107.386 -1.339 . . . . 0.0 107.386 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 23.8 mp0 -144.76 148.22 38.6 Favored Pre-proline 0 C--N 1.353 0.728 1 N-CA-C 96.865 -5.235 . . . . 0.0 96.865 172.185 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.5 ' HB3' ' CZ2' ' A' ' 1' ' ' TRP . 90.3 Cg_endo -81.08 123.23 4.47 Favored 'Trans proline' 0 CA--C 1.555 1.553 0 CA-C-N 125.702 3.072 . . . . 0.0 115.259 -165.815 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.46 ' HD3' ' HA ' ' A' ' 3' ' ' PRO . 43.1 Cg_exo -74.52 -115.48 0.01 OUTLIER 'Trans proline' 0 CA--C 1.55 1.301 1 C-N-CA 126.751 4.967 . . . . 0.0 113.828 174.527 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 5' ' ' TRP . . . . . 0.488 ' CE3' ' CD2' ' A' ' 6' ' ' TYR . 21.7 p-90 -87.75 -72.3 0.53 Allowed 'General case' 0 C--N 1.376 1.729 0 C-N-CA 126.71 2.004 . . . . 0.0 115.01 179.882 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.488 ' CD2' ' CE3' ' A' ' 5' ' ' TRP . 0.0 OUTLIER -31.26 -53.99 0.23 Allowed 'General case' 0 C--N 1.356 0.877 1 C-N-CA 133.868 4.867 . . . . 0.0 118.065 -173.378 . . . . . . . . 4 4 . 1 . 013 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.405 ' O ' ' HB2' ' A' ' 27' ' ' TRP . 1.9 m -54.96 -33.49 62.4 Favored 'General case' 0 CA--C 1.502 -0.901 0 C-N-CA 131.444 3.897 . . . . 0.0 116.488 -176.501 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 11.7 mtpp -113.96 13.73 18.32 Favored 'General case' 0 N--CA 1.439 -0.987 0 C-N-CA 129.978 3.311 . . . . 0.0 109.891 -177.857 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.45 ' HA ' ' HD3' ' A' ' 10' ' ' PRO . 34.7 tp10 -90.67 142.37 27.81 Favored Pre-proline 0 C--N 1.364 1.209 0 O-C-N 120.74 -1.225 . . . . 0.0 114.289 -170.29 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.45 ' HD3' ' HA ' ' A' ' 9' ' ' GLU . 51.7 Cg_exo -68.0 117.7 5.09 Favored 'Trans proline' 0 C--N 1.367 1.531 0 C-N-CA 124.682 3.588 . . . . 0.0 115.324 -173.891 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 14.5 p -69.72 128.02 32.48 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.938 0 C-N-CA 128.387 2.675 . . . . 0.0 111.885 176.138 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.433 ' HB2' HH22 ' A' ' 46' ' ' ARG . 2.2 mmp_? -142.36 122.58 13.84 Favored 'General case' 0 C--N 1.366 1.313 0 C-N-CA 125.65 1.58 . . . . 0.0 113.546 -170.708 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 12.9 tt -86.78 -42.22 15.35 Favored 'Isoleucine or valine' 0 C--N 1.376 1.757 0 C-N-CA 127.873 2.469 . . . . 0.0 115.931 -179.692 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 82.46 -165.42 44.55 Favored Glycine 0 C--N 1.362 2.003 0 O-C-N 121.279 -0.888 . . . . 0.0 114.161 -173.451 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 72.4 m -162.75 69.28 0.24 Allowed 'General case' 0 CA--C 1.507 -0.686 0 O-C-N 119.458 -2.201 . . . . 0.0 108.028 179.66 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 25.7 m -117.69 -85.33 0.64 Allowed 'General case' 0 N--CA 1.445 -0.688 0 CA-C-O 121.84 0.829 . . . . 0.0 112.815 -174.829 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 2.7 mmmp? -101.74 -64.81 1.02 Allowed 'General case' 0 CA--C 1.51 -0.593 0 N-CA-C 114.636 1.347 . . . . 0.0 114.636 -169.031 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.606 ' HG3' ' H ' ' A' ' 19' ' ' GLN . 14.8 tptp -143.96 -153.39 0.47 Allowed 'General case' 0 CA--C 1.504 -0.811 0 N-CA-C 104.37 -2.456 . . . . 0.0 104.37 -172.206 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' GLN . . . . . 0.606 ' H ' ' HG3' ' A' ' 18' ' ' LYS . 9.6 mm-40 -131.93 110.02 10.49 Favored 'General case' 0 N--CA 1.432 -1.328 0 N-CA-C 101.183 -3.636 . . . . 0.0 101.183 171.254 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 30.7 m-85 -106.83 138.45 42.98 Favored 'General case' 0 C--N 1.354 0.788 0 C-N-CA 125.794 1.638 . . . . 0.0 108.099 178.234 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' SER . . . . . 0.452 ' HA ' ' HG ' ' A' ' 36' ' ' LEU . 3.9 t -65.71 120.96 13.92 Favored 'General case' 0 C--N 1.371 1.513 0 N-CA-C 117.554 2.427 . . . . 0.0 117.554 -175.053 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -116.53 -168.24 1.42 Allowed 'General case' 0 C--N 1.37 1.487 0 C-N-CA 128.541 2.736 . . . . 0.0 111.232 177.171 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 23.6 m-85 -150.34 150.41 31.41 Favored 'General case' 0 C--N 1.355 0.835 0 C-N-CA 129.494 3.118 . . . . 0.0 108.191 174.258 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 8.9 p90 -145.14 166.14 26.28 Favored 'General case' 0 C--N 1.356 0.889 0 C-N-CA 126.325 1.85 . . . . 0.0 109.684 171.998 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' PHE . . . . . 0.44 ' CD2' ' HB2' ' A' ' 57' ' ' CYS . 19.0 t80 -98.02 125.72 43.11 Favored 'General case' 0 C--N 1.36 1.045 0 O-C-N 120.026 -1.671 . . . . 0.0 108.814 176.655 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 26.7 ttpt -85.05 103.15 13.81 Favored 'General case' 0 C--N 1.379 1.862 0 O-C-N 120.152 -1.593 . . . . 0.0 108.57 173.92 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' TRP . . . . . 0.405 ' HB2' ' O ' ' A' ' 7' ' ' CYS . 26.1 t-105 -46.07 -43.52 14.67 Favored 'General case' 0 C--N 1.358 0.951 0 C-N-CA 129.904 3.282 . . . . 0.0 117.528 -176.917 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 4.0 p -82.36 -29.83 30.71 Favored 'General case' 0 C--N 1.35 0.59 0 C-N-CA 127.787 2.435 . . . . 0.0 113.885 179.727 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -82.63 -23.69 34.18 Favored 'General case' 0 C--N 1.37 1.494 0 CA-C-N 120.935 1.698 . . . . 0.0 113.853 176.608 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . 0.261 30.5 mmmt 73.23 23.01 2.7 Favored 'General case' 0 C--N 1.367 1.328 0 C-N-CA 126.929 2.092 . . . . 0.0 112.246 -176.842 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.519 ' NZ ' HH12 ' A' ' 54' ' ' ARG . 6.8 mmtm -146.21 164.6 31.77 Favored 'General case' 0 C--N 1.365 1.246 0 C-N-CA 125.655 1.582 . . . . 0.0 112.684 -177.06 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 68.5 m -89.9 141.28 28.8 Favored 'General case' 0 C--N 1.359 1.005 0 C-N-CA 127.501 2.32 . . . . 0.0 116.321 -173.863 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 39.3 mt -127.44 145.59 55.14 Favored Pre-proline 0 C--N 1.363 1.183 0 C-N-CA 125.034 1.334 . . . . 0.0 110.741 -179.083 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 62.2 Cg_endo -84.54 143.17 9.66 Favored 'Trans proline' 0 CA--C 1.536 0.606 0 C-N-CA 123.474 2.783 . . . . 0.0 111.07 167.138 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 1.6 p90 -142.35 159.83 41.45 Favored 'General case' 0 C--N 1.349 0.569 0 N-CA-C 101.098 -3.667 . . . . 0.0 101.098 170.964 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.452 ' HG ' ' HA ' ' A' ' 21' ' ' SER . 6.9 mp -104.82 158.5 16.48 Favored 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 125.655 1.582 . . . . 0.0 107.75 178.39 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 9.0 t80 -125.55 144.2 50.67 Favored 'General case' 0 CA--C 1.557 1.228 0 C-N-CA 127.55 2.34 . . . . 0.0 110.088 179.749 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.9 t -84.86 -19.64 32.06 Favored 'General case' 0 C--N 1.376 1.724 0 N-CA-C 117.834 2.531 . . . . 0.0 117.834 -179.722 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 119.3 -30.71 5.7 Favored Glycine 0 C--N 1.361 1.966 0 C-N-CA 126.265 1.888 . . . . 0.0 116.333 172.871 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -137.23 142.85 42.05 Favored 'General case' 0 C--N 1.345 0.405 0 N-CA-C 104.756 -2.313 . . . . 0.0 104.756 173.418 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 100.8 10.53 43.05 Favored Glycine 0 C--N 1.365 2.178 0 O-C-N 121.085 -1.01 . . . . 0.0 115.429 -174.341 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -105.82 -171.33 23.51 Favored Glycine 0 C--N 1.358 1.77 0 C-N-CA 124.888 1.232 . . . . 0.0 114.446 177.012 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' ASN . . . . . 0.489 ' H ' ' CZ ' ' A' ' 46' ' ' ARG 0.311 31.8 p30 -124.3 -106.53 0.34 Allowed 'General case' 0 C--N 1.363 1.168 0 N-CA-C 116.265 1.95 . . . . 0.0 116.265 178.782 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -152.92 6.79 0.39 Allowed 'General case' 0 C--N 1.352 0.711 0 O-C-N 121.256 -0.903 . . . . 0.0 112.686 -172.042 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 55.8 t30 -104.17 46.43 0.92 Allowed 'General case' 0 C--N 1.365 1.28 0 O-C-N 120.574 -1.328 . . . . 0.0 109.406 176.264 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.489 ' CZ ' ' H ' ' A' ' 43' ' ' ASN 0.365 0.0 OUTLIER -132.1 106.93 8.3 Favored 'General case' 0 C--N 1.358 0.971 0 CA-C-O 124.468 2.08 . . . . 0.0 107.508 -179.368 . . . . . . . . 4 4 . 1 . 013 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 13.0 m-30 -93.02 149.62 21.09 Favored 'General case' 0 C--N 1.346 0.427 0 C-N-CA 128.54 2.736 . . . . 0.0 111.762 -165.573 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 35.8 mt-30 -74.73 -41.55 59.93 Favored 'General case' 0 C--N 1.37 1.495 0 N-CA-C 116.746 2.128 . . . . 0.0 116.746 -172.289 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 48.9 p -136.84 179.02 6.63 Favored 'General case' 0 C--N 1.356 0.849 0 C-N-CA 128.584 2.754 . . . . 0.0 105.54 178.55 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 18.1 tt -75.56 -17.65 15.74 Favored 'Isoleucine or valine' 0 C--N 1.37 1.463 0 O-C-N 120.42 -1.425 . . . . 0.0 113.452 175.596 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -77.25 -18.18 78.56 Favored Glycine 0 C--N 1.366 2.225 0 C-N-CA 125.704 1.621 . . . . 0.0 116.166 175.781 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -83.27 -2.17 54.98 Favored 'General case' 0 C--N 1.365 1.28 0 C-N-CA 126.371 1.868 . . . . 0.0 112.109 177.388 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 4.7 t -94.94 -24.34 17.01 Favored 'General case' 0 C--N 1.356 0.88 0 C-N-CA 128.715 2.806 . . . . 0.0 114.449 179.87 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.519 HH12 ' NZ ' ' A' ' 31' ' ' LYS . 0.0 OUTLIER -84.78 -37.91 20.24 Favored 'General case' 0 C--O 1.237 0.419 1 C-N-CA 132.393 4.277 . . . . 0.0 109.398 179.034 . . . . . . . . 4 4 . 1 . 013 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 28.0 ttmt -71.71 -28.03 63.42 Favored 'General case' 0 C--N 1.351 0.654 0 C-N-CA 129.303 3.041 . . . . 0.0 113.871 -178.285 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 27.2 mtmt -101.08 -39.18 7.82 Favored 'General case' 0 C--N 1.358 0.941 0 C-N-CA 125.094 1.358 . . . . 0.0 112.592 178.098 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' CYS . . . . . 0.44 ' HB2' ' CD2' ' A' ' 25' ' ' PHE . 99.2 m -126.49 17.22 7.59 Favored 'General case' 0 C--N 1.358 0.951 0 N-CA-C 116.98 2.215 . . . . 0.0 116.98 -170.13 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 22.5 mt -137.15 -23.05 1.15 Allowed 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 122.518 2.417 . . . . 0.0 112.682 168.666 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 86.78 48.74 4.34 Favored Glycine 0 C--N 1.367 2.268 0 C-N-CA 127.134 2.302 . . . . 0.0 111.524 -175.655 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 13.9 ptmt . . . . . 0 C--O 1.261 1.666 0 CA-C-O 118.572 -0.727 . . . . 0.0 110.544 -173.26 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 11.9 t90 . . . . . 0 N--CA 1.434 -1.239 0 CA-C-O 122.748 1.261 . . . . 0.0 109.294 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -135.75 148.91 67.32 Favored Pre-proline 0 C--N 1.351 0.659 1 N-CA-C 100.148 -4.019 . . . . 0.0 100.148 172.737 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.433 ' HA ' ' HD3' ' A' ' 4' ' ' PRO . 1.4 Cg_endo -77.35 125.38 7.7 Favored 'Trans proline' 0 CA--C 1.554 1.495 0 CA-C-N 124.807 2.753 . . . . 0.0 115.222 -169.026 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.521 ' HG2' ' CD2' ' A' ' 6' ' ' TYR . 38.3 Cg_endo -96.29 -116.09 0.0 OUTLIER 'Trans proline' 0 CA--C 1.549 1.239 1 C-N-CA 126.549 4.833 . . . . 0.0 110.855 -176.473 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 5' ' ' TRP . . . . . 0.471 ' CE3' ' CD1' ' A' ' 6' ' ' TYR 0.274 35.5 p-90 -85.67 -67.59 0.79 Allowed 'General case' 0 C--N 1.38 1.908 0 C-N-CA 126.496 1.918 . . . . 0.0 115.093 178.395 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.521 ' CD2' ' HG2' ' A' ' 4' ' ' PRO . 0.1 OUTLIER -32.71 -53.06 0.33 Allowed 'General case' 0 N--CA 1.48 1.071 1 C-N-CA 132.277 4.231 . . . . 0.0 119.162 -172.353 . . . . . . . . 4 4 . 1 . 014 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.7 m -60.51 -38.16 83.46 Favored 'General case' 0 N--CA 1.449 -0.514 0 C-N-CA 128.733 2.813 . . . . 0.0 113.277 -179.488 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 39.8 mtpt -104.16 14.01 31.26 Favored 'General case' 0 C--N 1.363 1.17 0 C-N-CA 129.08 2.952 . . . . 0.0 110.579 -177.71 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.425 ' HA ' ' HD3' ' A' ' 10' ' ' PRO . 3.4 tp10 -96.67 127.79 38.28 Favored Pre-proline 0 C--N 1.364 1.217 0 O-C-N 119.853 -1.779 . . . . 0.0 112.015 -172.273 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.425 ' HD3' ' HA ' ' A' ' 9' ' ' GLU . 52.4 Cg_exo -68.16 120.85 7.81 Favored 'Trans proline' 0 C--N 1.358 1.056 0 C-N-CA 124.167 3.245 . . . . 0.0 115.093 -165.881 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 8.1 p -67.85 133.85 31.03 Favored 'Isoleucine or valine' 0 C--N 1.36 1.057 0 C-N-CA 126.568 1.947 . . . . 0.0 113.934 -179.585 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . 0.287 16.5 mmt-85 -134.49 117.9 16.74 Favored 'General case' 0 C--N 1.36 1.04 0 C-N-CA 126.611 1.964 . . . . 0.0 108.494 -171.772 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 21.1 tt -93.18 -40.25 11.74 Favored 'Isoleucine or valine' 0 C--N 1.369 1.443 0 CA-C-N 120.399 1.454 . . . . 0.0 109.453 173.387 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 98.17 -67.47 0.73 Allowed Glycine 0 C--N 1.36 1.895 0 C-N-CA 124.67 1.129 . . . . 0.0 114.533 175.942 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . 0.322 89.9 p 87.91 28.91 0.03 OUTLIER 'General case' 0 C--N 1.362 1.143 0 C-N-CA 129.303 3.041 . . . . 0.0 110.524 -172.083 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 6.6 t -70.16 -89.95 0.02 OUTLIER 'General case' 0 C--N 1.364 1.221 0 N-CA-C 116.345 1.98 . . . . 0.0 116.345 -176.998 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 63.2 mmtt -88.89 -62.02 1.58 Allowed 'General case' 0 C--N 1.355 0.843 0 C-N-CA 125.074 1.349 . . . . 0.0 113.408 -178.02 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . 0.264 0.0 OUTLIER -148.0 -136.5 0.08 Allowed 'General case' 0 C--N 1.349 0.556 0 N-CA-C 104.472 -2.418 . . . . 0.0 104.472 175.391 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -150.11 123.48 9.0 Favored 'General case' 0 C--N 1.351 0.665 0 N-CA-C 103.643 -2.725 . . . . 0.0 103.643 175.314 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 19.6 m-85 -105.84 158.08 17.01 Favored 'General case' 0 C--N 1.36 1.024 0 C-N-CA 126.46 1.904 . . . . 0.0 106.14 177.662 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 2.6 t -82.31 144.59 30.49 Favored 'General case' 0 C--N 1.367 1.331 0 CA-C-N 122.111 2.232 . . . . 0.0 115.964 -176.247 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 61.1 p -146.77 -170.91 3.64 Favored 'General case' 0 C--N 1.364 1.197 0 C-N-CA 127.767 2.427 . . . . 0.0 112.671 -177.471 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 45.1 m-85 -141.05 152.76 45.1 Favored 'General case' 0 C--N 1.358 0.958 0 C-N-CA 129.984 3.313 . . . . 0.0 109.921 171.384 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . 0.303 2.9 p90 -144.68 158.97 43.56 Favored 'General case' 0 C--N 1.365 1.275 0 C-N-CA 126.999 2.12 . . . . 0.0 110.035 172.832 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 12.6 t80 -104.17 130.31 51.93 Favored 'General case' 0 C--N 1.365 1.263 0 N-CA-C 106.931 -1.507 . . . . 0.0 106.931 179.018 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.534 ' NZ ' ' H ' ' A' ' 28' ' ' THR . 0.0 OUTLIER -96.27 112.57 24.27 Favored 'General case' 0 N--CA 1.446 -0.671 0 C-N-CA 125.099 1.36 . . . . 0.0 110.047 179.222 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 27' ' ' TRP . . . . . 0.418 ' N ' ' HZ2' ' A' ' 26' ' ' LYS . 38.2 t-105 -50.47 -48.57 56.62 Favored 'General case' 0 C--N 1.355 0.819 0 C-N-CA 129.553 3.141 . . . . 0.0 116.494 175.007 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.534 ' H ' ' NZ ' ' A' ' 26' ' ' LYS 0.294 39.7 p -82.3 -25.7 33.73 Favored 'General case' 0 C--N 1.36 1.052 0 C-N-CA 124.471 1.109 . . . . 0.0 112.792 178.362 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -78.1 -38.9 43.01 Favored 'General case' 0 C--N 1.378 1.813 0 CA-C-N 120.779 1.627 . . . . 0.0 114.072 172.799 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . 0.301 52.5 mmtt 78.45 21.36 0.8 Allowed 'General case' 0 C--N 1.369 1.418 0 C-N-CA 128.107 2.563 . . . . 0.0 113.547 179.742 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 63.1 tttt -147.6 168.41 22.07 Favored 'General case' 0 C--N 1.355 0.835 0 C-N-CA 126.578 1.951 . . . . 0.0 106.509 -179.931 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 79.1 m -81.21 146.05 30.67 Favored 'General case' 0 C--N 1.358 0.942 0 C-N-CA 126.961 2.104 . . . . 0.0 115.745 179.894 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 12.8 mt -122.83 142.97 39.15 Favored Pre-proline 0 C--N 1.358 0.941 0 C-N-CA 125.75 1.62 . . . . 0.0 109.828 177.086 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 63.7 Cg_endo -85.6 147.32 9.68 Favored 'Trans proline' 0 C--N 1.35 0.645 0 C-N-CA 124.403 3.402 . . . . 0.0 111.077 169.181 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . 0.386 3.4 p90 -145.42 -157.73 0.82 Allowed 'General case' 0 C--N 1.352 0.695 0 CA-C-N 114.95 -1.023 . . . . 0.0 109.41 174.749 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 40.2 mt -140.31 153.85 46.6 Favored 'General case' 0 N--CA 1.436 -1.134 0 C-N-CA 128.31 2.644 . . . . 0.0 104.153 -178.598 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -137.98 127.17 24.42 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 127.817 2.447 . . . . 0.0 108.465 -178.169 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 96.7 p -83.71 4.51 28.42 Favored 'General case' 0 C--N 1.368 1.371 0 N-CA-C 119.714 3.227 . . . . 0.0 119.714 -176.247 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 88.2 -31.25 4.83 Favored Glycine 0 C--N 1.355 1.615 0 C-N-CA 129.252 3.31 . . . . 0.0 120.103 172.58 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -136.22 31.78 2.9 Favored 'General case' 0 CA--C 1.509 -0.597 0 O-C-N 121.441 -1.035 . . . . 0.0 109.931 -175.681 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -150.36 36.91 0.93 Allowed Glycine 0 C--N 1.355 1.599 0 N-CA-C 110.457 -1.057 . . . . 0.0 110.457 176.186 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -101.3 -177.42 28.84 Favored Glycine 0 C--N 1.357 1.739 0 C-N-CA 125.455 1.502 . . . . 0.0 113.99 174.72 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' ASN . . . . . 0.5 ' H ' ' NH1' ' A' ' 46' ' ' ARG 0.381 42.0 p30 -125.01 -96.0 0.45 Allowed 'General case' 0 C--N 1.356 0.891 0 O-C-N 120.945 -1.327 . . . . 0.0 111.225 174.322 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -145.3 -16.56 0.49 Allowed 'General case' 0 C--N 1.348 0.541 0 C-N-CA 125.205 1.402 . . . . 0.0 112.274 -174.984 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 50.6 t30 -94.11 74.1 4.05 Favored 'General case' 0 C--N 1.363 1.168 0 O-C-N 120.165 -1.584 . . . . 0.0 111.738 -177.939 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.5 ' NH1' ' H ' ' A' ' 43' ' ' ASN 0.295 0.0 OUTLIER -137.27 130.55 31.03 Favored 'General case' 0 C--N 1.352 0.674 0 CA-C-O 124.271 1.986 . . . . 0.0 108.868 173.638 . . . . . . . . 4 4 . 1 . 014 nuclear build full ' A' A ' 47' ' ' PHE . . . . . 0.441 ' CD2' ' HA ' ' A' ' 53' ' ' CYS . 21.7 m-85 -111.31 141.94 44.18 Favored 'General case' 0 CA--C 1.507 -0.685 0 C-N-CA 127.914 2.486 . . . . 0.0 108.598 -174.763 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 31.0 mt-30 -67.35 -64.63 0.82 Allowed 'General case' 0 C--N 1.363 1.167 0 C-N-CA 127.097 2.159 . . . . 0.0 114.609 -175.572 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 31.4 p -121.47 171.9 8.46 Favored 'General case' 0 C--N 1.353 0.743 0 C-N-CA 126.492 1.917 . . . . 0.0 107.499 177.791 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 17.7 tt -59.36 -25.71 31.73 Favored 'Isoleucine or valine' 0 C--N 1.363 1.174 0 C-N-CA 127.802 2.441 . . . . 0.0 117.227 178.78 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -88.48 -17.32 57.25 Favored Glycine 0 C--N 1.353 1.503 0 N-CA-C 116.669 1.427 . . . . 0.0 116.669 174.301 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 15.8 tp10 -70.05 -34.62 73.45 Favored 'General case' 0 C--N 1.378 1.835 0 CA-C-N 120.015 1.908 . . . . 0.0 112.016 174.547 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' CYS . . . . . 0.441 ' HA ' ' CD2' ' A' ' 47' ' ' PHE . 48.7 t -47.92 -44.17 29.67 Favored 'General case' 0 C--N 1.361 1.108 0 C-N-CA 128.575 2.75 . . . . 0.0 116.024 175.444 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 8.4 mtp85 -74.34 -26.67 60.29 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 130.964 3.705 . . . . 0.0 117.385 -179.174 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 12.5 mttp -80.34 -11.72 59.67 Favored 'General case' 0 C--N 1.364 1.225 0 C-N-CA 125.572 1.549 . . . . 0.0 114.815 -179.634 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 9.9 mtmm -103.52 -28.69 11.6 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 126.664 1.986 . . . . 0.0 109.38 175.001 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 53.6 m -125.86 6.68 7.36 Favored 'General case' 0 C--N 1.365 1.265 0 N-CA-C 119.551 3.167 . . . . 0.0 119.551 -170.502 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 16.3 mt -134.54 -15.39 2.14 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 123.435 2.834 . . . . 0.0 113.334 174.826 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 77.49 57.47 3.59 Favored Glycine 0 C--N 1.361 1.931 0 C-N-CA 128.238 2.828 . . . . 0.0 113.02 -171.443 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 16.0 ptpt . . . . . 0 C--O 1.259 1.604 0 N-CA-C 107.889 -1.152 . . . . 0.0 107.889 -176.197 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' TRP . . . . . 0.515 ' CZ2' ' HB3' ' A' ' 3' ' ' PRO . 81.0 t90 . . . . . 0 N--CA 1.434 -1.263 0 N-CA-C 107.099 -1.445 . . . . 0.0 107.099 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 81.2 mt-30 -149.38 149.0 28.02 Favored Pre-proline 0 C--N 1.355 0.829 1 N-CA-C 97.549 -4.982 . . . . 0.0 97.549 174.22 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.515 ' HB3' ' CZ2' ' A' ' 1' ' ' TRP . 60.5 Cg_endo -86.95 118.84 1.48 Allowed 'Trans proline' 0 CA--C 1.557 1.635 0 CA-C-N 125.045 2.838 . . . . 0.0 115.845 -162.997 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.445 ' HD3' ' HA ' ' A' ' 3' ' ' PRO . 30.0 Cg_exo -76.09 -110.53 0.01 OUTLIER 'Trans proline' 0 C--N 1.362 1.287 1 C-N-CA 126.552 4.834 . . . . 0.0 114.658 178.942 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 5' ' ' TRP . . . . . 0.487 ' CE3' ' CD2' ' A' ' 6' ' ' TYR 0.316 36.5 p-90 -88.46 -70.47 0.64 Allowed 'General case' 0 C--N 1.379 1.854 0 C-N-CA 126.671 1.988 . . . . 0.0 116.334 -178.695 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.487 ' CD2' ' CE3' ' A' ' 5' ' ' TRP . 0.0 OUTLIER -32.06 -55.76 0.31 Allowed 'General case' 0 C--N 1.36 1.042 1 C-N-CA 135.74 5.616 . . . . 0.0 118.07 -173.338 . . . . . . . . 4 4 . 1 . 015 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.434 ' O ' ' HB2' ' A' ' 27' ' ' TRP . 0.1 OUTLIER -55.13 -39.78 69.8 Favored 'General case' 0 N--CA 1.444 -0.769 0 C-N-CA 130.287 3.435 . . . . 0.0 114.553 -179.8 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 10.1 mtpp -105.12 13.5 30.65 Favored 'General case' 0 C--N 1.356 0.867 0 C-N-CA 127.559 2.344 . . . . 0.0 110.56 -178.074 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.436 ' HB3' ' HB2' ' A' ' 45' ' ' ASN . 3.7 tp10 -93.46 132.84 29.35 Favored Pre-proline 0 C--N 1.368 1.385 0 O-C-N 120.012 -1.68 . . . . 0.0 112.458 -171.884 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.4 ' HD3' ' HA ' ' A' ' 9' ' ' GLU . 53.4 Cg_exo -66.46 122.71 10.2 Favored 'Trans proline' 0 C--N 1.359 1.091 0 C-N-CA 124.054 3.17 . . . . 0.0 116.88 -165.957 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 8.4 p -72.52 132.53 33.27 Favored 'Isoleucine or valine' 0 C--N 1.36 1.026 0 C-N-CA 125.882 1.673 . . . . 0.0 111.743 175.924 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . 0.251 1.6 mmp_? -146.41 124.43 12.07 Favored 'General case' 0 C--N 1.353 0.751 0 CA-C-O 115.063 -2.399 . . . . 0.0 112.956 -168.822 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.278 6.5 tt -88.44 -35.16 7.63 Favored 'Isoleucine or valine' 0 C--N 1.384 2.097 0 CA-C-N 124.922 3.51 . . . . 0.0 115.179 177.64 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 96.47 -68.4 0.93 Allowed Glycine 0 C--N 1.358 1.764 0 N-CA-C 117.388 1.715 . . . . 0.0 117.388 175.081 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 21.6 m 77.22 70.7 0.06 Allowed 'General case' 0 C--N 1.366 1.313 0 C-N-CA 125.822 1.649 . . . . 0.0 110.649 -171.986 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 3.0 t -128.72 -72.61 0.6 Allowed 'General case' 0 CA--C 1.506 -0.717 0 CA-C-O 121.687 0.756 . . . . 0.0 111.143 -176.438 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 12.5 mmmm -97.49 -76.29 0.52 Allowed 'General case' 0 C--N 1.349 0.586 0 C-N-CA 125.869 1.668 . . . . 0.0 113.827 -172.464 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.548 ' HG3' ' H ' ' A' ' 19' ' ' GLN . 20.5 tptp -146.71 -152.56 0.44 Allowed 'General case' 0 CA--C 1.509 -0.596 0 N-CA-C 102.025 -3.324 . . . . 0.0 102.025 -176.657 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' GLN . . . . . 0.548 ' H ' ' HG3' ' A' ' 18' ' ' LYS . 23.4 mp0 -133.75 113.23 12.08 Favored 'General case' 0 N--CA 1.438 -1.068 0 N-CA-C 101.983 -3.34 . . . . 0.0 101.983 170.979 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 33.1 m-85 -107.18 141.66 38.11 Favored 'General case' 0 C--N 1.355 0.845 0 O-C-N 120.484 -1.385 . . . . 0.0 107.921 179.65 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.7 t -66.39 122.65 18.01 Favored 'General case' 0 C--N 1.372 1.573 0 N-CA-C 117.695 2.48 . . . . 0.0 117.695 -176.619 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 1.2 t -120.73 -175.68 3.08 Favored 'General case' 0 C--N 1.363 1.159 0 C-N-CA 129.157 2.983 . . . . 0.0 109.175 -178.881 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 37.0 m-85 -146.12 141.62 27.71 Favored 'General case' 0 C--N 1.349 0.56 0 C-N-CA 129.854 3.262 . . . . 0.0 104.312 170.716 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 16.0 p90 -124.57 148.87 47.56 Favored 'General case' 0 C--N 1.358 0.967 0 N-CA-C 107.499 -1.297 . . . . 0.0 107.499 172.102 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 10.4 t80 -94.76 126.11 39.86 Favored 'General case' 0 C--N 1.363 1.189 0 N-CA-C 104.129 -2.545 . . . . 0.0 104.129 175.639 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -100.0 113.32 25.82 Favored 'General case' 0 N--CA 1.425 -1.682 0 C-N-CA 125.569 1.548 . . . . 0.0 108.85 -175.232 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' TRP . . . . . 0.434 ' HB2' ' O ' ' A' ' 7' ' ' CYS . 45.8 t-105 -53.54 -46.96 70.38 Favored 'General case' 0 C--N 1.361 1.097 0 C-N-CA 129.544 3.138 . . . . 0.0 117.457 -177.922 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 11.0 p -83.49 -5.54 59.19 Favored 'General case' 0 C--N 1.353 0.749 0 C-N-CA 124.542 1.137 . . . . 0.0 113.604 179.456 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -97.06 -47.93 5.59 Favored 'General case' 0 C--N 1.363 1.188 0 C-N-CA 124.819 1.247 . . . . 0.0 111.868 174.993 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . 0.294 0.7 OUTLIER 83.45 26.38 0.11 Allowed 'General case' 0 C--N 1.366 1.287 0 C-N-CA 127.672 2.389 . . . . 0.0 112.489 -178.333 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 7.8 tmtm? -147.78 164.22 34.3 Favored 'General case' 0 C--N 1.356 0.868 0 C-N-CA 128.008 2.523 . . . . 0.0 107.344 179.197 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 64.6 m -81.98 118.81 23.27 Favored 'General case' 0 C--N 1.363 1.195 0 C-N-CA 129.739 3.216 . . . . 0.0 114.606 178.831 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 29.6 mt -105.26 145.73 31.35 Favored Pre-proline 0 C--N 1.354 0.8 0 O-C-N 119.83 -1.794 . . . . 0.0 111.203 177.924 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 69.2 Cg_endo -86.92 144.28 7.24 Favored 'Trans proline' 0 N--CA 1.46 -0.452 0 C-N-CA 123.129 2.552 . . . . 0.0 112.245 173.481 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -149.03 171.16 16.83 Favored 'General case' 0 N--CA 1.444 -0.755 0 N-CA-C 101.338 -3.579 . . . . 0.0 101.338 170.255 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 8.4 mp -111.72 156.23 22.23 Favored 'General case' 0 N--CA 1.449 -0.519 0 C-N-CA 125.967 1.707 . . . . 0.0 106.882 178.398 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 8.3 t80 -116.95 139.69 50.35 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 127.137 2.175 . . . . 0.0 112.157 -179.104 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.3 t -92.76 -4.97 52.18 Favored 'General case' 0 C--N 1.377 1.786 0 N-CA-C 117.401 2.371 . . . . 0.0 117.401 178.291 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 106.21 -44.04 1.56 Allowed Glycine 0 C--N 1.366 2.197 0 CA-C-N 120.908 1.686 . . . . 0.0 116.541 170.856 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -133.69 139.37 46.38 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 103.634 -2.728 . . . . 0.0 103.634 177.322 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 103.09 -12.2 55.69 Favored Glycine 0 C--N 1.358 1.775 0 O-C-N 121.329 -0.857 . . . . 0.0 113.606 -173.75 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -102.93 177.24 25.27 Favored Glycine 0 C--N 1.361 1.922 0 C-N-CA 127.707 2.575 . . . . 0.0 112.622 177.052 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 15.1 p30 -119.72 -100.13 0.44 Allowed 'General case' 0 C--N 1.365 1.269 0 N-CA-C 115.446 1.647 . . . . 0.0 115.446 179.241 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -158.75 17.87 0.2 Allowed 'General case' 0 C--N 1.363 1.19 0 N-CA-C 114.981 1.475 . . . . 0.0 114.981 -172.155 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' ASN . . . . . 0.436 ' HB2' ' HB3' ' A' ' 9' ' ' GLU . 36.6 t30 -106.69 55.64 0.66 Allowed 'General case' 0 C--N 1.366 1.315 0 N-CA-C 104.401 -2.444 . . . . 0.0 104.401 172.47 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 7.0 ptp180 -144.07 105.31 4.24 Favored 'General case' 0 CA--C 1.5 -0.95 0 CA-C-O 124.721 2.201 . . . . 0.0 106.442 -172.08 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 18.4 m-85 -107.14 133.53 51.61 Favored 'General case' 0 N--CA 1.434 -1.241 0 CA-C-N 111.87 -2.423 . . . . 0.0 109.04 -169.849 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 30.9 mt-30 -55.23 -40.0 70.37 Favored 'General case' 0 C--N 1.355 0.845 0 C-N-CA 130.221 3.409 . . . . 0.0 116.605 -177.223 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 81.9 p -136.3 174.08 11.01 Favored 'General case' 0 C--N 1.356 0.862 0 C-N-CA 127.551 2.341 . . . . 0.0 107.656 178.163 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 18.6 tt -68.32 -13.04 16.52 Favored 'Isoleucine or valine' 0 C--N 1.36 1.049 0 C-N-CA 129.36 3.064 . . . . 0.0 116.883 177.58 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -99.61 -25.27 9.36 Favored Glycine 0 C--N 1.353 1.501 0 N-CA-C 116.72 1.448 . . . . 0.0 116.72 176.646 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -68.79 -21.77 64.31 Favored 'General case' 0 N--CA 1.491 1.611 0 CA-C-N 120.254 2.027 . . . . 0.0 113.188 176.509 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 22.7 t -70.84 -23.7 62.38 Favored 'General case' 0 CA--C 1.557 1.222 0 C-N-CA 129.105 2.962 . . . . 0.0 113.593 173.659 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 47.3 mtm180 -86.07 -30.79 22.32 Favored 'General case' 0 C--N 1.354 0.8 0 N-CA-C 116.719 2.118 . . . . 0.0 116.719 -175.102 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 84.1 tttt -77.29 -10.12 59.24 Favored 'General case' 0 C--N 1.369 1.439 0 C-N-CA 126.397 1.879 . . . . 0.0 113.6 -177.509 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 31.6 mtmt -102.06 -30.38 11.21 Favored 'General case' 0 N--CA 1.442 -0.856 0 C-N-CA 126.648 1.979 . . . . 0.0 114.132 -178.878 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' CYS . . . . . 0.43 ' SG ' ' HB2' ' A' ' 6' ' ' TYR . 47.3 m -139.4 25.46 2.43 Favored 'General case' 0 C--N 1.36 1.031 0 O-C-N 120.652 -1.28 . . . . 0.0 114.275 -166.644 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 18.3 mt -145.98 -27.62 0.43 Allowed 'General case' 0 C--N 1.345 0.405 0 O-C-N 120.625 -1.297 . . . . 0.0 111.735 174.436 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 86.61 57.58 2.06 Favored Glycine 0 C--N 1.364 2.094 0 C-N-CA 126.739 2.114 . . . . 0.0 112.706 -173.169 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 15.6 ptmt . . . . . 0 C--O 1.262 1.754 0 N-CA-C 106.433 -1.691 . . . . 0.0 106.433 -176.274 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 84.8 t90 . . . . . 0 N--CA 1.436 -1.166 0 CA-C-O 122.141 0.972 . . . . 0.0 108.496 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 18.6 mm-40 -143.92 149.73 47.08 Favored Pre-proline 0 N--CA 1.442 -0.844 1 N-CA-C 98.596 -4.594 . . . . 0.0 98.596 170.486 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 23.7 Cg_endo -71.88 123.27 9.2 Favored 'Trans proline' 0 CA--C 1.559 1.761 0 C-N-CA 123.655 2.903 . . . . 0.0 114.747 -170.092 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . 0.528 ' HG2' ' CD2' ' A' ' 6' ' ' TYR . 43.7 Cg_endo -92.07 -113.93 0.0 OUTLIER 'Trans proline' 0 CA--C 1.543 0.931 1 C-N-CA 127.263 5.309 . . . . 0.0 110.196 -178.006 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' TRP . . . . . 0.443 ' CE3' ' CD1' ' A' ' 6' ' ' TYR . 4.6 p-90 -85.55 -70.46 0.59 Allowed 'General case' 0 C--N 1.38 1.911 0 C-N-CA 126.817 2.047 . . . . 0.0 114.48 177.029 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.528 ' CD2' ' HG2' ' A' ' 4' ' ' PRO . 0.1 OUTLIER -31.18 -52.27 0.19 Allowed 'General case' 0 C--N 1.365 1.24 1 C-N-CA 132.992 4.517 . . . . 0.0 118.411 -170.811 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 2.3 m -58.75 -40.31 83.49 Favored 'General case' 0 C--N 1.35 0.613 0 C-N-CA 127.567 2.347 . . . . 0.0 114.633 -177.334 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 27.8 mtpp -98.24 15.21 25.17 Favored 'General case' 0 C--N 1.359 0.993 0 C-N-CA 125.9 1.68 . . . . 0.0 111.533 177.616 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 16.9 tt0 -92.27 125.42 56.45 Favored Pre-proline 0 C--N 1.364 1.199 0 O-C-N 119.176 -2.202 . . . . 0.0 110.735 -173.518 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_exo -62.21 145.36 96.22 Favored 'Trans proline' 0 CA--C 1.547 1.126 0 C-N-CA 124.28 3.32 . . . . 0.0 117.508 -169.525 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 7.8 p -79.74 130.88 35.37 Favored 'Isoleucine or valine' 0 C--N 1.369 1.417 0 C-N-CA 123.48 0.712 . . . . 0.0 110.673 174.086 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 22.8 mmt85 -128.91 133.4 47.87 Favored 'General case' 0 C--N 1.35 0.617 0 N-CA-C 104.736 -2.32 . . . . 0.0 104.736 -173.543 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.315 19.4 tt -99.02 -45.04 12.18 Favored 'Isoleucine or valine' 0 C--N 1.369 1.414 0 CA-C-N 122.769 2.531 . . . . 0.0 111.355 175.577 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.358 1.761 0 C-N-CA 124.438 1.018 . . . . 0.0 111.348 -170.353 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 25.6 tttp . . . . . 0 N--CA 1.447 -0.589 0 N-CA-C 103.381 -2.822 . . . . 0.0 103.381 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -126.19 134.08 51.36 Favored 'General case' 0 C--N 1.357 0.917 0 CA-C-N 121.746 2.066 . . . . 0.0 107.766 178.386 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 25.8 m-85 -107.29 146.03 32.01 Favored 'General case' 0 C--N 1.356 0.851 0 C-N-CA 128.094 2.558 . . . . 0.0 109.215 177.093 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.8 t -70.4 136.73 49.85 Favored 'General case' 0 C--N 1.371 1.532 0 N-CA-C 117.902 2.556 . . . . 0.0 117.902 -175.717 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 33.9 p -145.63 161.36 40.01 Favored 'General case' 0 C--N 1.359 1.009 0 C-N-CA 124.79 1.236 . . . . 0.0 113.787 -176.577 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . 0.408 ' HB2' ' HB2' ' A' ' 47' ' ' PHE . 94.3 m-85 -132.49 134.65 45.29 Favored 'General case' 0 C--N 1.343 0.303 0 C-N-CA 126.121 1.768 . . . . 0.0 107.479 177.048 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 29.2 p90 -114.95 144.18 43.99 Favored 'General case' 0 C--N 1.366 1.294 0 N-CA-C 106.772 -1.566 . . . . 0.0 106.772 175.725 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . 0.451 ' HA ' ' HA ' ' A' ' 32' ' ' CYS . 11.9 t80 -89.55 119.12 29.7 Favored 'General case' 0 C--N 1.374 1.646 0 CA-C-N 122.274 2.306 . . . . 0.0 105.692 -179.467 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.542 ' NZ ' ' H ' ' A' ' 28' ' ' THR . 0.5 OUTLIER -89.03 116.41 27.29 Favored 'General case' 0 N--CA 1.429 -1.5 0 C-N-CA 125.303 1.441 . . . . 0.0 109.577 -176.71 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -64.99 -39.63 93.75 Favored 'General case' 0 C--N 1.343 0.317 0 N-CA-C 118.332 2.716 . . . . 0.0 118.332 -172.84 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.542 ' H ' ' NZ ' ' A' ' 26' ' ' LYS . 17.4 p -89.89 -2.86 58.28 Favored 'General case' 0 C--N 1.359 0.98 0 O-C-N 120.523 -1.36 . . . . 0.0 111.496 176.498 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -96.64 -46.88 6.14 Favored 'General case' 0 C--N 1.364 1.22 0 C-N-CA 125.196 1.398 . . . . 0.0 114.183 175.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . 0.296 18.8 tptt 89.3 19.42 0.04 OUTLIER 'General case' 0 C--N 1.368 1.385 0 C-N-CA 126.778 2.031 . . . . 0.0 113.333 -178.242 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 8.1 ptpp? -147.86 169.4 19.9 Favored 'General case' 0 C--N 1.352 0.698 0 C-N-CA 126.486 1.914 . . . . 0.0 108.237 176.728 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.451 ' HA ' ' HA ' ' A' ' 25' ' ' PHE . 74.0 m -90.86 141.33 28.93 Favored 'General case' 0 C--N 1.367 1.357 0 O-C-N 120.513 -1.367 . . . . 0.0 111.668 175.941 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.2 mt -110.93 146.03 33.63 Favored Pre-proline 0 C--N 1.347 0.48 0 N-CA-C 107.77 -1.196 . . . . 0.0 107.77 178.913 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 69.3 Cg_endo -86.58 149.52 8.76 Favored 'Trans proline' 0 N--CA 1.458 -0.606 0 C-N-CA 123.882 3.055 . . . . 0.0 112.797 -179.758 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 5.9 p90 -146.0 -161.52 1.33 Allowed 'General case' 0 N--CA 1.444 -0.774 0 N-CA-C 104.462 -2.422 . . . . 0.0 104.462 171.713 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 84.9 mt -141.96 148.23 38.27 Favored 'General case' 0 N--CA 1.433 -1.321 0 N-CA-C 101.048 -3.686 . . . . 0.0 101.048 173.815 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.412 ' CZ ' ' HA2' ' A' ' 39' ' ' GLY . 2.9 t80 -109.77 138.09 46.63 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 127.497 2.319 . . . . 0.0 106.44 176.925 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 51.8 m -78.62 -43.05 27.26 Favored 'General case' 0 C--N 1.373 1.601 0 CA-C-O 122.935 1.35 . . . . 0.0 111.899 178.615 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . 0.412 ' HA2' ' CZ ' ' A' ' 37' ' ' PHE . . . 125.12 -51.8 0.82 Allowed Glycine 0 C--N 1.349 1.265 0 C-N-CA 125.953 1.74 . . . . 0.0 109.772 -175.43 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 8.0 m -80.27 65.61 5.49 Favored 'General case' 0 C--N 1.357 0.903 0 N-CA-C 116.758 2.133 . . . . 0.0 116.758 -175.156 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 128.82 57.79 0.11 Allowed Glycine 0 C--N 1.37 2.425 0 N-CA-C 118.812 2.285 . . . . 0.0 118.812 173.325 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -103.2 -159.87 25.26 Favored Glycine 0 C--N 1.37 2.434 0 CA-C-N 119.992 1.896 . . . . 0.0 114.423 174.585 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . 0.568 ' H ' ' NH1' ' A' ' 46' ' ' ARG 0.304 46.9 p30 -136.93 -106.6 0.2 Allowed 'General case' 0 C--N 1.356 0.854 0 O-C-N 121.303 -1.116 . . . . 0.0 111.351 -179.809 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -167.75 29.32 0.03 OUTLIER 'General case' 0 C--N 1.355 0.805 0 C-N-CA 124.49 1.116 . . . . 0.0 111.888 -177.734 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 51.9 t-20 -105.94 34.26 3.4 Favored 'General case' 0 C--N 1.37 1.482 0 N-CA-C 105.442 -2.058 . . . . 0.0 105.442 173.523 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.568 ' NH1' ' H ' ' A' ' 43' ' ' ASN . 0.8 OUTLIER -121.91 110.6 16.06 Favored 'General case' 0 C--N 1.358 0.949 0 CA-C-O 125.172 2.415 . . . . 0.0 111.272 -172.554 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . 0.41 ' CE1' ' HE3' ' A' ' 56' ' ' LYS . 84.6 m-85 -92.59 127.23 38.01 Favored 'General case' 0 N--CA 1.445 -0.71 0 C-N-CA 129.569 3.148 . . . . 0.0 106.622 179.729 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.92 -17.35 59.79 Favored 'General case' 0 C--N 1.37 1.49 0 N-CA-C 117.025 2.232 . . . . 0.0 117.025 -173.982 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 31.2 p -142.74 171.49 13.98 Favored 'General case' 0 C--N 1.357 0.917 0 N-CA-C 102.649 -3.093 . . . . 0.0 102.649 175.989 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 6.7 tt -85.67 7.43 2.09 Favored 'Isoleucine or valine' 0 C--N 1.363 1.163 0 O-C-N 119.648 -1.907 . . . . 0.0 113.407 176.297 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -97.75 -13.82 42.46 Favored Glycine 0 C--N 1.362 2.012 0 O-C-N 119.596 -1.94 . . . . 0.0 113.498 178.024 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -85.87 -29.8 23.41 Favored 'General case' 0 C--N 1.359 0.99 0 C-N-CA 126.533 1.933 . . . . 0.0 110.114 175.363 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 6.8 t -37.75 -58.4 0.91 Allowed 'General case' 0 C--N 1.372 1.584 1 C-N-CA 133.302 4.641 . . . . 0.0 116.362 179.654 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.69 -12.11 60.9 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 130.399 3.479 . . . . 0.0 116.836 -178.778 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -86.26 -12.04 50.69 Favored 'General case' 0 C--N 1.368 1.392 0 O-C-N 119.8 -1.813 . . . . 0.0 114.458 -176.863 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.41 ' HE3' ' CE1' ' A' ' 47' ' ' PHE . 18.7 mtmt -105.02 -34.13 8.09 Favored 'General case' 0 C--N 1.352 0.68 0 C-N-CA 125.525 1.53 . . . . 0.0 110.53 177.572 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 17.8 m -124.17 15.49 9.12 Favored 'General case' 0 C--N 1.358 0.956 0 N-CA-C 117.236 2.31 . . . . 0.0 117.236 -169.073 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 15.0 mt -137.37 -26.55 0.99 Allowed 'General case' 0 N--CA 1.472 0.656 0 O-C-N 119.349 -2.095 . . . . 0.0 112.981 175.507 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 85.4 55.06 2.67 Favored Glycine 0 C--N 1.363 2.052 0 C-N-CA 127.911 2.672 . . . . 0.0 112.86 -171.922 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 8.6 ptpt . . . . . 0 C--O 1.263 1.774 0 CA-C-O 116.26 -1.828 . . . . 0.0 106.539 -178.229 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 20.8 t90 . . . . . 0 N--CA 1.432 -1.35 0 N-CA-C 106.224 -1.769 . . . . 0.0 106.224 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 37.1 mt-30 -143.42 143.25 23.36 Favored Pre-proline 0 C--N 1.351 0.648 1 N-CA-C 99.034 -4.432 . . . . 0.0 99.034 175.128 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . 0.436 ' HA ' ' HD3' ' A' ' 4' ' ' PRO . 28.8 Cg_endo -72.37 114.86 4.12 Favored 'Trans proline' 0 CA--C 1.555 1.528 0 C-N-CA 124.776 3.65 . . . . 0.0 117.846 -165.623 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . 0.436 ' HD3' ' HA ' ' A' ' 3' ' ' PRO . 33.3 Cg_exo -77.76 -115.88 0.01 OUTLIER 'Trans proline' 0 C--N 1.371 1.722 1 C-N-CA 127.201 5.267 . . . . 0.0 114.428 177.318 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' TRP . . . . . 0.467 ' CE2' ' CE2' ' A' ' 6' ' ' TYR . 5.0 p-90 -85.44 -68.87 0.7 Allowed 'General case' 0 C--N 1.38 1.902 0 C-N-CA 128.129 2.572 . . . . 0.0 114.874 -178.164 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.467 ' CE2' ' CE2' ' A' ' 5' ' ' TRP . 0.1 OUTLIER -31.67 -56.98 0.28 Allowed 'General case' 0 CA--C 1.492 -1.288 1 C-N-CA 133.717 4.807 . . . . 0.0 116.989 -172.222 . . . . . . . . 4 4 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -56.53 -44.52 80.91 Favored 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 129.158 2.983 . . . . 0.0 115.239 -178.109 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 45.8 mttm -93.18 -13.94 27.77 Favored 'General case' 0 C--N 1.358 0.943 0 C-N-CA 128.921 2.889 . . . . 0.0 113.638 -177.662 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.439 ' HA ' ' HD3' ' A' ' 10' ' ' PRO . 0.1 OUTLIER -71.41 135.6 84.14 Favored Pre-proline 0 C--N 1.361 1.074 0 C-N-CA 127.581 2.352 . . . . 0.0 113.25 -175.06 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . 0.439 ' HD3' ' HA ' ' A' ' 9' ' ' GLU . 72.0 Cg_exo -65.63 131.01 26.41 Favored 'Trans proline' 0 C--N 1.358 1.077 0 C-N-CA 124.232 3.288 . . . . 0.0 118.959 -167.119 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 8.2 p -77.33 124.39 35.65 Favored 'Isoleucine or valine' 0 C--N 1.368 1.395 0 C-N-CA 127.825 2.45 . . . . 0.0 113.912 175.535 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -147.37 133.12 18.94 Favored 'General case' 0 C--N 1.367 1.344 0 C-N-CA 126.951 2.1 . . . . 0.0 112.906 -174.228 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.287 7.2 tt -88.26 -48.4 15.0 Favored 'Isoleucine or valine' 0 C--N 1.372 1.562 0 N-CA-C 117.619 2.451 . . . . 0.0 117.619 179.795 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.364 2.122 0 N-CA-C 117.411 1.724 . . . . 0.0 117.411 -170.231 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 12.0 ptmm? . . . . . 0 CA--C 1.503 -0.843 0 N-CA-C 102.328 -3.212 . . . . 0.0 102.328 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 5.1 mm100 -126.04 112.35 15.77 Favored 'General case' 0 N--CA 1.438 -1.058 0 N-CA-C 100.475 -3.898 . . . . 0.0 100.475 170.333 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 50.0 m-85 -94.4 144.23 25.73 Favored 'General case' 0 C--N 1.364 1.224 0 C-N-CA 126.385 1.874 . . . . 0.0 108.804 -179.654 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 4.9 t -67.54 112.74 4.87 Favored 'General case' 0 C--N 1.367 1.333 0 C-N-CA 126.723 2.009 . . . . 0.0 115.918 -175.764 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 4.6 p -120.26 -167.11 1.4 Allowed 'General case' 0 C--N 1.365 1.248 0 CA-C-O 123.263 1.506 . . . . 0.0 112.924 177.611 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 14.8 m-85 -148.99 136.82 20.58 Favored 'General case' 0 N--CA 1.446 -0.667 0 C-N-CA 129.236 3.014 . . . . 0.0 103.706 170.846 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 9.9 p90 -119.57 152.06 37.63 Favored 'General case' 0 C--N 1.364 1.216 0 CA-C-N 123.074 2.67 . . . . 0.0 109.684 173.102 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 19.6 t80 -94.01 121.66 35.71 Favored 'General case' 0 C--N 1.363 1.158 0 N-CA-C 106.45 -1.685 . . . . 0.0 106.45 -179.157 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.487 ' HD3' HD11 ' A' ' 33' ' ' LEU . 4.9 ttpp -90.9 108.59 19.94 Favored 'General case' 0 C--N 1.367 1.35 0 C-N-CA 123.48 0.712 . . . . 0.0 109.109 176.235 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 11.1 t-105 -52.09 -38.95 58.96 Favored 'General case' 0 C--N 1.355 0.823 0 C-N-CA 128.68 2.792 . . . . 0.0 117.1 -177.925 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 2.1 p -79.42 -30.09 42.17 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 129.686 3.194 . . . . 0.0 113.486 -179.397 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -86.1 -37.31 18.95 Favored 'General case' 0 C--N 1.365 1.273 0 C-N-CA 124.72 1.208 . . . . 0.0 111.473 177.748 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . 0.326 1.5 tptp 80.01 26.39 0.34 Allowed 'General case' 0 C--N 1.361 1.082 0 C-N-CA 127.693 2.397 . . . . 0.0 112.801 -178.621 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.5 tmtt? -147.52 177.27 9.39 Favored 'General case' 0 C--N 1.363 1.171 0 C-N-CA 125.827 1.651 . . . . 0.0 110.87 175.476 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 61.8 m -93.17 122.53 35.65 Favored 'General case' 0 C--N 1.363 1.161 0 C-N-CA 129.043 2.937 . . . . 0.0 114.394 -175.731 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.487 HD11 ' HD3' ' A' ' 26' ' ' LYS . 19.2 mt -104.42 142.44 24.63 Favored Pre-proline 0 C--N 1.358 0.96 0 CA-C-O 117.83 -1.081 . . . . 0.0 109.971 177.536 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 96.9 Cg_endo -82.12 127.62 5.39 Favored 'Trans proline' 0 CA--C 1.531 0.334 0 C-N-CA 123.878 3.052 . . . . 0.0 112.273 175.541 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . 0.261 0.2 OUTLIER -141.39 177.45 8.1 Favored 'General case' 0 C--N 1.35 0.621 0 N-CA-C 102.325 -3.213 . . . . 0.0 102.325 169.512 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 1.1 mp -117.88 165.56 13.53 Favored 'General case' 0 N--CA 1.44 -0.96 0 C-N-CA 125.27 1.428 . . . . 0.0 107.263 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.429 ' CE2' ' HA2' ' A' ' 39' ' ' GLY . 30.3 t80 -123.01 136.52 54.88 Favored 'General case' 0 CA--C 1.551 1.011 0 C-N-CA 125.578 1.551 . . . . 0.0 112.071 178.882 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.9 t -88.08 -24.6 23.38 Favored 'General case' 0 C--N 1.38 1.9 0 CA-C-N 122.073 2.215 . . . . 0.0 114.315 173.422 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . 0.429 ' HA2' ' CE2' ' A' ' 37' ' ' PHE . . . 118.23 -58.66 0.51 Allowed Glycine 0 C--N 1.361 1.93 0 C-N-CA 125.78 1.657 . . . . 0.0 114.166 175.411 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -102.81 115.91 31.52 Favored 'General case' 0 C--N 1.351 0.635 0 C-N-CA 126.307 1.843 . . . . 0.0 106.654 178.721 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 134.46 -45.86 1.09 Allowed Glycine 0 CA--C 1.49 -1.528 0 N-CA-C 109.861 -1.296 . . . . 0.0 109.861 -174.435 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -93.45 -165.93 37.71 Favored Glycine 0 C--N 1.36 1.907 0 O-C-N 121.13 -1.217 . . . . 0.0 113.932 173.263 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . 0.392 3.9 p30 -134.37 -99.81 0.25 Allowed 'General case' 0 C--N 1.353 0.734 0 O-C-N 121.177 -1.19 . . . . 0.0 113.466 179.916 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -150.79 24.4 0.76 Allowed 'General case' 0 C--N 1.374 1.635 0 N-CA-C 117.022 2.23 . . . . 0.0 117.022 -171.059 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . 0.581 ' H ' HH11 ' A' ' 46' ' ' ARG . 40.2 t30 -101.7 48.2 0.89 Allowed 'General case' 0 N--CA 1.491 1.587 0 N-CA-C 105.106 -2.183 . . . . 0.0 105.106 171.458 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.581 HH11 ' H ' ' A' ' 45' ' ' ASN . 0.0 OUTLIER -146.3 118.42 8.3 Favored 'General case' 0 CA--C 1.492 -1.276 0 N-CA-C 104.275 -2.491 . . . . 0.0 104.275 -176.131 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . 0.446 ' CD2' ' HA ' ' A' ' 53' ' ' CYS . 21.8 m-85 -107.23 129.41 54.87 Favored 'General case' 0 N--CA 1.429 -1.49 0 C-N-CA 127.681 2.392 . . . . 0.0 107.524 -165.261 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 23.4 mp0 -70.06 -30.45 67.71 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 126.249 1.82 . . . . 0.0 115.558 -169.107 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 1.4 p -146.21 168.3 21.37 Favored 'General case' 0 C--N 1.352 0.696 0 N-CA-C 104.272 -2.492 . . . . 0.0 104.272 176.268 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 2.3 tt -84.23 138.31 19.4 Favored 'Isoleucine or valine' 0 C--N 1.37 1.484 0 C-N-CA 125.576 1.55 . . . . 0.0 108.246 176.288 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 117.17 -50.06 0.82 Allowed Glycine 0 C--N 1.364 2.105 0 N-CA-C 107.49 -2.244 . . . . 0.0 107.49 -157.367 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 16.2 tp10 -77.71 -20.03 54.24 Favored 'General case' 0 C--N 1.366 1.324 0 N-CA-C 115.813 1.783 . . . . 0.0 115.813 -178.297 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . 0.446 ' HA ' ' CD2' ' A' ' 47' ' ' PHE . 52.7 t -77.57 -42.03 36.75 Favored 'General case' 0 C--N 1.361 1.094 0 C-N-CA 128.509 2.723 . . . . 0.0 112.882 177.923 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 72.5 mtm180 -74.52 -45.73 43.85 Favored 'General case' 0 N--CA 1.447 -0.609 1 C-N-CA 133.732 4.813 . . . . 0.0 112.466 179.96 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 69.8 tttt -82.63 55.03 2.83 Favored 'General case' 0 C--N 1.373 1.609 0 CA-C-O 123.616 1.674 . . . . 0.0 111.852 174.198 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 22.1 mtmt -167.77 -47.03 0.02 OUTLIER 'General case' 0 N--CA 1.444 -0.763 0 C-N-CA 129.977 3.311 . . . . 0.0 105.171 -178.547 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . 0.441 ' SG ' ' HB2' ' A' ' 6' ' ' TYR . 56.3 m -121.65 7.87 10.03 Favored 'General case' 0 C--N 1.357 0.914 0 N-CA-C 119.579 3.178 . . . . 0.0 119.579 -172.942 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 18.7 mt -133.83 -8.6 2.75 Favored 'General case' 0 N--CA 1.481 1.115 0 CA-C-N 125.646 3.839 . . . . 0.0 114.066 175.288 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 67.82 59.35 6.61 Favored Glycine 0 C--N 1.359 1.832 0 C-N-CA 128.262 2.839 . . . . 0.0 113.863 -171.449 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 2.5 ptpp? . . . . . 0 C--O 1.264 1.824 0 N-CA-C 102.366 -3.198 . . . . 0.0 102.366 -175.396 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 1' ' ' TRP . . . . . 0.508 ' CZ2' ' HB3' ' A' ' 3' ' ' PRO . 9.6 t90 . . . . . 0 N--CA 1.433 -1.32 0 N-CA-C 108.076 -1.083 . . . . 0.0 108.076 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 16.6 mm-40 -142.02 150.09 54.78 Favored Pre-proline 0 C--N 1.353 0.758 1 N-CA-C 98.382 -4.673 . . . . 0.0 98.382 171.07 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . 0.508 ' HB3' ' CZ2' ' A' ' 1' ' ' TRP . 87.5 Cg_endo -80.76 132.79 8.91 Favored 'Trans proline' 0 CA--C 1.563 1.933 0 CA-C-N 124.291 2.568 . . . . 0.0 113.455 -166.8 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . 0.508 ' HG2' ' CD2' ' A' ' 6' ' ' TYR . 44.7 Cg_endo -94.46 -113.22 0.0 OUTLIER 'Trans proline' 0 CA--C 1.546 1.119 1 C-N-CA 127.114 5.209 . . . . 0.0 110.784 -178.053 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' TRP . . . . . 0.433 ' CE3' ' CD1' ' A' ' 6' ' ' TYR 0.265 52.7 p-90 -86.98 -69.71 0.66 Allowed 'General case' 0 C--N 1.384 2.103 0 C-N-CA 128.097 2.559 . . . . 0.0 114.926 178.902 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.508 ' CD2' ' HG2' ' A' ' 4' ' ' PRO . 0.0 OUTLIER -32.8 -51.59 0.3 Allowed 'General case' 0 C--N 1.368 1.386 1 C-N-CA 132.472 4.309 . . . . 0.0 117.575 -174.168 . . . . . . . . 4 4 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 3.0 m -60.75 -28.7 68.9 Favored 'General case' 0 CA--C 1.507 -0.708 0 C-N-CA 129.275 3.03 . . . . 0.0 118.127 -175.305 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . 0.25 61.2 tttm -118.41 17.72 13.74 Favored 'General case' 0 C--N 1.355 0.81 0 C-N-CA 128.276 2.63 . . . . 0.0 108.487 -178.218 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.478 ' HA ' ' HD3' ' A' ' 10' ' ' PRO . 22.9 tp10 -94.86 127.78 41.9 Favored Pre-proline 0 C--N 1.36 1.041 0 O-C-N 119.263 -2.148 . . . . 0.0 112.722 -173.428 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . 0.478 ' HD3' ' HA ' ' A' ' 9' ' ' GLU . 38.2 Cg_exo -72.99 140.9 32.22 Favored 'Trans proline' 0 C--N 1.352 0.746 0 C-N-CA 123.903 3.069 . . . . 0.0 113.45 -169.814 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -81.41 153.07 4.18 Favored 'Isoleucine or valine' 0 C--N 1.362 1.109 0 N-CA-C 115.426 1.639 . . . . 0.0 115.426 178.871 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -147.0 119.8 8.65 Favored 'General case' 0 N--CA 1.438 -1.034 0 C-N-CA 125.369 1.468 . . . . 0.0 111.14 -178.281 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.285 11.7 tt -74.02 -40.7 52.25 Favored 'Isoleucine or valine' 0 C--N 1.357 0.894 0 N-CA-C 115.413 1.634 . . . . 0.0 115.413 175.829 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.352 1.419 0 N-CA-C 109.617 -1.393 . . . . 0.0 109.617 -178.933 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 38.3 ttmt . . . . . 0 CA--C 1.504 -0.823 1 N-CA-C 99.545 -4.243 . . . . 0.0 99.545 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -130.31 128.04 40.71 Favored 'General case' 0 C--N 1.354 0.768 0 C-N-CA 123.873 0.869 . . . . 0.0 112.339 -170.071 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 26.8 m-85 -112.04 135.33 52.82 Favored 'General case' 0 C--N 1.358 0.966 0 C-N-CA 127.294 2.238 . . . . 0.0 107.7 177.184 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . 0.483 ' HA ' ' HG ' ' A' ' 36' ' ' LEU 0.277 4.0 t -69.26 132.31 46.27 Favored 'General case' 0 C--N 1.375 1.684 0 N-CA-C 116.492 2.034 . . . . 0.0 116.492 -177.133 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 3.2 p -146.06 -172.08 3.85 Favored 'General case' 0 N--CA 1.448 -0.538 0 C-N-CA 127.633 2.373 . . . . 0.0 110.312 -173.029 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 48.6 m-85 -145.27 153.37 41.22 Favored 'General case' 0 C--N 1.35 0.628 0 C-N-CA 128.631 2.772 . . . . 0.0 110.733 177.083 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . 0.251 12.5 p90 -131.98 154.93 48.83 Favored 'General case' 0 C--N 1.373 1.624 0 C-N-CA 125.292 1.437 . . . . 0.0 108.671 168.106 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 16.2 t80 -94.97 111.88 23.63 Favored 'General case' 0 C--N 1.365 1.268 0 O-C-N 119.716 -1.865 . . . . 0.0 107.966 -179.477 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -83.38 107.03 15.62 Favored 'General case' 0 C--N 1.363 1.195 0 O-C-N 120.366 -1.459 . . . . 0.0 111.83 -176.51 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 41.1 t-105 -46.05 -53.59 9.95 Favored 'General case' 0 C--N 1.357 0.931 1 C-N-CA 132.155 4.182 . . . . 0.0 117.746 -171.546 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.5 p -81.27 -15.74 54.63 Favored 'General case' 0 C--N 1.353 0.723 0 C-N-CA 126.657 1.983 . . . . 0.0 113.084 179.686 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -88.79 -37.63 15.27 Favored 'General case' 0 C--N 1.366 1.299 0 C-N-CA 124.175 0.99 . . . . 0.0 112.044 174.304 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . 0.301 12.0 mmmm 77.25 27.03 0.68 Allowed 'General case' 0 C--N 1.366 1.309 0 C-N-CA 129.562 3.145 . . . . 0.0 113.327 -178.519 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 52.1 pttt -146.45 163.97 33.97 Favored 'General case' 0 C--N 1.355 0.811 0 C-N-CA 125.807 1.643 . . . . 0.0 110.502 -179.572 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 89.4 m -80.48 126.34 31.09 Favored 'General case' 0 C--N 1.359 0.991 0 C-N-CA 128.308 2.643 . . . . 0.0 115.222 -177.247 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 13.2 mt -112.19 147.58 37.26 Favored Pre-proline 0 C--N 1.36 1.039 0 O-C-N 120.461 -1.4 . . . . 0.0 108.725 176.298 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -86.57 142.54 7.02 Favored 'Trans proline' 0 C--N 1.344 0.311 1 C-N-CA 125.542 4.161 . . . . 0.0 111.444 170.976 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -145.7 165.12 29.68 Favored 'General case' 0 N--CA 1.439 -0.993 1 N-CA-C 98.313 -4.699 . . . . 0.0 98.313 169.691 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.483 ' HG ' ' HA ' ' A' ' 21' ' ' SER . 7.8 mp -109.72 149.93 29.04 Favored 'General case' 0 N--CA 1.44 -0.942 0 N-CA-C 104.428 -2.434 . . . . 0.0 104.428 174.922 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -100.51 138.15 37.96 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 126.953 2.101 . . . . 0.0 109.129 176.598 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 9.2 t -107.66 119.0 38.21 Favored 'General case' 0 C--N 1.363 1.179 0 N-CA-C 104.585 -2.376 . . . . 0.0 104.585 171.521 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -68.93 19.58 0.43 Allowed Glycine 0 N--CA 1.479 1.515 0 C-N-CA 127.681 2.563 . . . . 0.0 119.134 -178.397 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 78.7 m -114.12 56.22 0.72 Allowed 'General case' 0 C--N 1.354 0.791 0 C-N-CA 128.943 2.897 . . . . 0.0 108.825 172.355 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 118.29 54.77 0.28 Allowed Glycine 0 C--N 1.359 1.842 0 N-CA-C 120.367 2.907 . . . . 0.0 120.367 171.107 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -86.47 -176.72 49.62 Favored Glycine 0 C--N 1.37 2.466 0 CA-C-N 121.48 2.64 . . . . 0.0 116.412 175.12 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . 0.5 ' H ' ' CZ ' ' A' ' 46' ' ' ARG 0.355 30.2 p30 -113.07 -112.88 0.34 Allowed 'General case' 0 C--N 1.362 1.136 0 O-C-N 119.923 -1.927 . . . . 0.0 114.435 179.887 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -141.64 -9.31 0.94 Allowed 'General case' 0 C--N 1.354 0.761 0 O-C-N 120.406 -1.434 . . . . 0.0 112.894 -174.814 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 61.7 t30 -101.53 57.2 0.84 Allowed 'General case' 0 C--N 1.365 1.261 0 O-C-N 120.19 -1.568 . . . . 0.0 109.969 -179.409 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.5 ' CZ ' ' H ' ' A' ' 43' ' ' ASN 0.37 0.0 OUTLIER -131.06 130.53 43.35 Favored 'General case' 0 CA--C 1.498 -1.033 0 CA-C-O 124.415 2.055 . . . . 0.0 110.197 178.292 . . . . . . . . 4 4 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 10.5 m-85 -114.75 131.42 56.78 Favored 'General case' 0 C--N 1.35 0.593 0 C-N-CA 128.388 2.675 . . . . 0.0 106.894 -177.258 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -85.99 -27.08 25.07 Favored 'General case' 0 C--N 1.371 1.523 0 CA-C-N 121.62 2.009 . . . . 0.0 115.579 -177.311 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 23.9 p -125.19 155.72 39.57 Favored 'General case' 0 C--N 1.351 0.667 0 N-CA-C 104.8 -2.296 . . . . 0.0 104.8 177.497 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 16.4 tt -58.87 -32.17 46.59 Favored 'Isoleucine or valine' 0 C--N 1.36 1.046 0 N-CA-C 117.347 2.351 . . . . 0.0 117.347 -177.621 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . 0.404 ' HA2' ' HD3' ' A' ' 54' ' ' ARG . . . -91.37 1.68 76.84 Favored Glycine 0 C--N 1.358 1.782 0 O-C-N 120.187 -1.571 . . . . 0.0 115.795 178.222 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 15.6 tp10 -82.28 -20.23 37.93 Favored 'General case' 0 C--N 1.365 1.248 0 O-C-N 120.896 -1.355 . . . . 0.0 110.67 170.774 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 19.7 t -72.12 -30.19 64.82 Favored 'General case' 0 C--N 1.363 1.162 0 C-N-CA 129.07 2.948 . . . . 0.0 112.86 175.573 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.404 ' HD3' ' HA2' ' A' ' 51' ' ' GLY . 43.8 mtp180 -76.16 -48.56 20.12 Favored 'General case' 0 C--N 1.355 0.81 0 C-N-CA 127.697 2.399 . . . . 0.0 114.875 176.461 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 30.8 ttmt -82.15 59.92 4.67 Favored 'General case' 0 C--N 1.361 1.075 0 C-N-CA 127.809 2.444 . . . . 0.0 111.841 -174.266 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.421 ' HG2' ' CZ ' ' A' ' 6' ' ' TYR . 23.9 mtmt -179.62 -39.81 0.01 OUTLIER 'General case' 0 N--CA 1.439 -0.993 0 C-N-CA 130.854 3.662 . . . . 0.0 106.09 -176.11 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . 0.409 ' O ' ' CZ2' ' A' ' 1' ' ' TRP . 67.7 m -125.01 7.38 7.98 Favored 'General case' 0 C--N 1.364 1.238 0 N-CA-C 119.862 3.282 . . . . 0.0 119.862 -170.503 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 14.7 mt -140.58 -8.97 1.09 Allowed 'General case' 0 N--CA 1.476 0.834 0 CA-C-N 124.124 3.147 . . . . 0.0 114.466 169.713 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 71.41 51.32 17.42 Favored Glycine 0 C--N 1.356 1.654 0 C-N-CA 128.107 2.765 . . . . 0.0 113.395 -171.923 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 12.3 ptpt . . . . . 0 C--O 1.26 1.629 0 N-CA-C 103.707 -2.701 . . . . 0.0 103.707 -174.195 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 23.3 t90 . . . . . 0 N--CA 1.433 -1.297 0 N-CA-C 108.254 -1.017 . . . . 0.0 108.254 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 23.5 mm-40 -144.14 144.06 24.7 Favored Pre-proline 0 C--N 1.353 0.726 0 N-CA-C 100.482 -3.895 . . . . 0.0 100.482 174.927 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 19.9 Cg_endo -72.69 122.59 8.34 Favored 'Trans proline' 0 CA--C 1.557 1.631 0 CA-C-N 124.782 2.744 . . . . 0.0 116.441 -169.257 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . 0.487 ' HG2' ' CD2' ' A' ' 6' ' ' TYR . 38.2 Cg_endo -91.78 -123.15 0.01 OUTLIER 'Trans proline' 0 CA--C 1.555 1.533 1 C-N-CA 127.034 5.156 . . . . 0.0 111.81 178.694 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' TRP . . . . . 0.469 ' CE3' ' CD1' ' A' ' 6' ' ' TYR 0.336 54.7 p-90 -73.09 -74.14 0.18 Allowed 'General case' 0 C--N 1.384 2.076 0 C-N-CA 126.521 1.928 . . . . 0.0 114.44 178.538 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.487 ' CD2' ' HG2' ' A' ' 4' ' ' PRO . 0.1 OUTLIER -32.04 -51.46 0.24 Allowed 'General case' 0 C--N 1.363 1.169 1 C-N-CA 132.183 4.193 . . . . 0.0 117.469 -175.619 . . . . . . . . 4 4 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.428 ' O ' ' HB2' ' A' ' 27' ' ' TRP . 1.1 m -71.5 -8.01 51.19 Favored 'General case' 0 CA--C 1.51 -0.587 0 C-N-CA 129.885 3.274 . . . . 0.0 115.747 -176.902 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 47.8 mttp -134.81 11.63 3.67 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 128.118 2.567 . . . . 0.0 107.242 -179.604 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.408 ' HA ' ' HD3' ' A' ' 10' ' ' PRO . 34.9 tp10 -96.85 134.42 23.08 Favored Pre-proline 0 C--N 1.364 1.228 0 N-CA-C 115.092 1.515 . . . . 0.0 115.092 -167.849 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . 0.408 ' HD3' ' HA ' ' A' ' 9' ' ' GLU . 72.0 Cg_exo -66.35 121.1 8.32 Favored 'Trans proline' 0 C--N 1.365 1.433 0 C-N-CA 124.707 3.604 . . . . 0.0 116.182 -169.495 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 14.3 p -69.39 136.46 26.2 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.908 0 C-N-CA 127.642 2.377 . . . . 0.0 112.885 177.584 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 61.6 mtp180 -146.33 126.09 13.46 Favored 'General case' 0 C--N 1.359 1.02 0 C-N-CA 125.237 1.415 . . . . 0.0 111.869 -172.274 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 12.9 tt -103.65 -37.27 4.49 Favored 'Isoleucine or valine' 0 C--N 1.37 1.482 0 C-N-CA 126.334 1.854 . . . . 0.0 112.452 175.593 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.366 2.195 0 C-N-CA 127.171 2.319 . . . . 0.0 116.95 176.722 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 15.0 tppt? . . . . . 0 CA--C 1.5 -0.951 0 N-CA-C 106.547 -1.649 . . . . 0.0 106.547 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . 0.337 4.1 mp0 -93.5 121.15 34.61 Favored 'General case' 0 C--N 1.358 0.946 0 CA-C-O 122.955 1.359 . . . . 0.0 112.075 178.736 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 30.0 m-85 -108.21 150.13 27.66 Favored 'General case' 0 C--N 1.356 0.874 0 C-N-CA 128.148 2.579 . . . . 0.0 106.069 -179.176 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 4.1 t -72.0 143.95 49.01 Favored 'General case' 0 C--N 1.368 1.404 0 N-CA-C 117.127 2.269 . . . . 0.0 117.127 -173.536 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 27.7 p -145.87 -173.28 4.11 Favored 'General case' 0 C--N 1.36 1.062 0 C-N-CA 127.934 2.494 . . . . 0.0 112.458 -177.856 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . 0.517 ' HA ' ' HA ' ' A' ' 34' ' ' PRO . 43.0 m-85 -139.69 153.21 47.19 Favored 'General case' 0 C--N 1.361 1.089 0 C-N-CA 129.454 3.102 . . . . 0.0 111.66 174.876 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . 0.282 10.7 p90 -147.93 161.42 41.36 Favored 'General case' 0 C--N 1.367 1.355 0 C-N-CA 126.437 1.895 . . . . 0.0 110.158 172.134 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . 0.427 ' CD2' ' HB2' ' A' ' 57' ' ' CYS . 27.5 t80 -100.53 127.44 46.9 Favored 'General case' 0 C--N 1.368 1.387 0 O-C-N 120.54 -1.35 . . . . 0.0 108.274 178.438 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.408 ' HB3' ' HB3' ' A' ' 29' ' ' ALA . 1.7 ttpp -85.77 103.17 14.3 Favored 'General case' 0 C--N 1.364 1.21 0 C-N-CA 124.334 1.054 . . . . 0.0 112.04 177.873 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' TRP . . . . . 0.428 ' HB2' ' O ' ' A' ' 7' ' ' CYS . 35.3 t-105 -50.69 -44.43 57.92 Favored 'General case' 0 C--N 1.35 0.612 0 C-N-CA 129.301 3.04 . . . . 0.0 116.116 179.361 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 3.7 p -87.31 -6.56 58.47 Favored 'General case' 0 C--N 1.36 1.064 0 C-N-CA 125.193 1.397 . . . . 0.0 113.326 178.478 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.408 ' HB3' ' HB3' ' A' ' 26' ' ' LYS . . . -99.51 -38.48 8.76 Favored 'General case' 0 C--N 1.368 1.376 0 CA-C-N 120.561 1.528 . . . . 0.0 112.095 173.701 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . 0.273 30.4 tptt 84.36 23.59 0.11 Allowed 'General case' 0 C--N 1.367 1.351 0 C-N-CA 127.623 2.369 . . . . 0.0 111.616 -176.258 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 55.2 mtmt -145.54 166.43 25.75 Favored 'General case' 0 C--N 1.357 0.92 0 C-N-CA 126.636 1.974 . . . . 0.0 109.55 -177.61 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 75.0 m -89.39 145.8 25.1 Favored 'General case' 0 C--N 1.358 0.938 0 C-N-CA 127.646 2.379 . . . . 0.0 113.293 -178.791 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 44.6 mt -129.09 148.93 71.08 Favored Pre-proline 0 C--N 1.357 0.934 0 C-N-CA 125.296 1.438 . . . . 0.0 109.182 176.298 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.517 ' HA ' ' HA ' ' A' ' 23' ' ' PHE . 18.6 Cg_endo -86.64 162.31 9.34 Favored 'Trans proline' 0 N--CA 1.46 -0.445 0 C-N-CA 123.267 2.645 . . . . 0.0 110.868 165.933 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . 0.352 2.9 p90 -149.55 -159.24 1.01 Allowed 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 113.269 -1.787 . . . . 0.0 108.332 174.775 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 18.8 mt -139.65 144.94 37.88 Favored 'General case' 0 N--CA 1.439 -1.016 0 N-CA-C 103.323 -2.843 . . . . 0.0 103.323 -178.598 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.408 ' CE2' ' HA2' ' A' ' 39' ' ' GLY . 12.3 t80 -121.2 128.97 52.97 Favored 'General case' 0 CA--C 1.551 0.982 0 C-N-CA 128.852 2.861 . . . . 0.0 109.338 -179.792 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 37.7 m -76.52 2.57 13.48 Favored 'General case' 0 C--N 1.388 2.252 0 N-CA-C 115.976 1.843 . . . . 0.0 115.976 -178.318 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . 0.408 ' HA2' ' CE2' ' A' ' 37' ' ' PHE . . . 83.85 -39.45 2.85 Favored Glycine 0 C--N 1.358 1.776 0 N-CA-C 118.374 2.11 . . . . 0.0 118.374 176.3 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -125.51 38.06 4.25 Favored 'General case' 0 C--N 1.35 0.595 0 C-N-CA 124.514 1.125 . . . . 0.0 108.591 178.484 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -147.8 28.31 1.44 Allowed Glycine 0 C--N 1.356 1.655 0 N-CA-C 116.762 1.465 . . . . 0.0 116.762 -176.398 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -105.43 178.36 23.31 Favored Glycine 0 C--N 1.356 1.644 0 O-C-N 119.598 -2.119 . . . . 0.0 116.467 177.727 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 43.6 p-10 -127.31 -92.98 0.48 Allowed 'General case' 0 C--N 1.356 0.882 0 C-N-CA 124.615 1.166 . . . . 0.0 112.5 176.425 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -136.52 -30.0 0.93 Allowed 'General case' 0 C--N 1.358 0.972 0 N-CA-C 114.537 1.31 . . . . 0.0 114.537 -172.182 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 45.5 t30 -92.72 72.09 4.93 Favored 'General case' 0 C--N 1.372 1.547 0 O-C-N 119.743 -1.848 . . . . 0.0 111.918 -176.343 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . 0.377 0.0 OUTLIER -135.77 125.59 25.65 Favored 'General case' 0 C--N 1.351 0.673 0 CA-C-O 124.517 2.103 . . . . 0.0 110.238 174.606 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 20.2 m-30 -105.0 137.83 42.15 Favored 'General case' 0 N--CA 1.441 -0.905 0 C-N-CA 128.69 2.796 . . . . 0.0 107.795 -176.526 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 30.9 mt-30 -74.73 -45.65 42.61 Favored 'General case' 0 C--N 1.368 1.41 0 N-CA-C 114.734 1.383 . . . . 0.0 114.734 -177.413 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 30.1 p -129.56 172.23 11.78 Favored 'General case' 0 C--N 1.353 0.744 0 N-CA-C 105.529 -2.026 . . . . 0.0 105.529 175.747 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 18.6 tt -59.55 -28.07 39.08 Favored 'Isoleucine or valine' 0 C--N 1.365 1.281 0 C-N-CA 128.869 2.868 . . . . 0.0 117.05 178.985 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -84.75 -8.9 82.09 Favored Glycine 0 C--N 1.361 1.956 0 N-CA-C 115.961 1.144 . . . . 0.0 115.961 -177.226 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -88.49 -1.93 58.32 Favored 'General case' 0 C--N 1.362 1.123 0 C-N-CA 126.06 1.744 . . . . 0.0 111.248 176.274 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 33.9 t -85.05 -47.79 9.86 Favored 'General case' 0 C--N 1.355 0.821 0 C-N-CA 128.333 2.653 . . . . 0.0 112.983 -178.191 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.442 ' HB2' ' HD2' ' A' ' 60' ' ' LYS 0.338 0.0 OUTLIER -85.79 -25.27 26.45 Favored 'General case' 0 C--O 1.234 0.277 0 C-N-CA 128.64 2.776 . . . . 0.0 111.815 -179.916 . . . . . . . . 4 4 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.67 -25.39 63.88 Favored 'General case' 0 C--N 1.373 1.601 0 C-N-CA 125.857 1.663 . . . . 0.0 113.794 171.696 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.423 ' HD2' ' CD1' ' A' ' 6' ' ' TYR . 23.5 mtmt -98.49 -32.1 11.64 Favored 'General case' 0 C--N 1.362 1.116 0 C-N-CA 125.034 1.334 . . . . 0.0 111.636 172.695 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . 0.438 ' SG ' ' HB2' ' A' ' 6' ' ' TYR . 87.7 m -124.33 11.46 8.71 Favored 'General case' 0 C--N 1.362 1.132 0 N-CA-C 120.12 3.378 . . . . 0.0 120.12 -172.167 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 17.3 mt -132.15 -17.97 2.65 Favored 'General case' 0 N--CA 1.477 0.879 0 CA-C-N 124.579 3.354 . . . . 0.0 112.102 170.214 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 76.61 56.09 4.34 Favored Glycine 0 C--N 1.359 1.831 0 C-N-CA 128.034 2.73 . . . . 0.0 112.381 -171.601 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . 0.442 ' HD2' ' HB2' ' A' ' 54' ' ' ARG . 13.7 ptpt . . . . . 0 C--O 1.258 1.526 0 N-CA-C 102.892 -3.003 . . . . 0.0 102.892 -176.373 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 19.3 t90 . . . . . 0 N--CA 1.436 -1.171 0 CA-C-O 122.706 1.241 . . . . 0.0 109.753 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 35.3 mt-30 -138.75 147.6 55.09 Favored Pre-proline 0 C--N 1.359 1.016 1 N-CA-C 99.91 -4.107 . . . . 0.0 99.91 169.279 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 5.0 Cg_endo -73.76 123.57 8.61 Favored 'Trans proline' 0 CA--C 1.553 1.444 0 CA-C-N 125.556 3.02 . . . . 0.0 116.03 -169.995 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . 0.563 ' HG2' ' CD2' ' A' ' 6' ' ' TYR . 49.5 Cg_endo -94.11 -116.92 0.0 OUTLIER 'Trans proline' 0 CA--C 1.548 1.221 1 C-N-CA 126.392 4.728 . . . . 0.0 110.362 179.592 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' TRP . . . . . . . . . . . . 0.264 63.9 p-90 -87.06 -57.09 3.09 Favored 'General case' 0 C--N 1.384 2.093 0 C-N-CA 127.977 2.511 . . . . 0.0 115.234 176.249 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.563 ' CD2' ' HG2' ' A' ' 4' ' ' PRO . 0.1 OUTLIER -48.44 -7.77 0.02 OUTLIER 'General case' 0 C--N 1.363 1.162 1 C-N-CA 132.255 4.222 . . . . 0.0 120.663 -174.683 . . . . . . . . 4 4 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.414 ' O ' ' HB2' ' A' ' 27' ' ' TRP . 4.1 m -103.09 -31.67 10.06 Favored 'General case' 0 N--CA 1.442 -0.868 0 N-CA-C 106.829 -1.545 . . . . 0.0 106.829 -177.331 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 26.0 mtmt -98.27 20.77 11.95 Favored 'General case' 0 C--N 1.364 1.231 0 C-N-CA 128.904 2.881 . . . . 0.0 113.206 -175.181 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -104.94 126.36 31.31 Favored Pre-proline 0 C--N 1.362 1.131 0 CA-C-O 115.645 -2.121 . . . . 0.0 108.558 -176.763 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 30.5 Cg_exo -77.19 156.02 33.35 Favored 'Trans proline' 0 C--N 1.374 1.872 0 C-N-CA 125.23 3.954 . . . . 0.0 113.689 -167.22 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 9.4 p -72.52 134.12 30.44 Favored 'Isoleucine or valine' 0 C--N 1.37 1.483 0 N-CA-C 117.966 2.58 . . . . 0.0 117.966 178.379 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.684 ' NE ' HH21 ' A' ' 46' ' ' ARG . 0.0 OUTLIER -106.08 -176.72 3.16 Favored 'General case' 0 C--N 1.355 0.846 0 C-N-CA 129.109 2.964 . . . . 0.0 109.741 179.069 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.451 0.6 OUTLIER -155.49 -55.42 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.355 0.812 0 C-N-CA 126.133 1.773 . . . . 0.0 112.95 162.996 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.366 2.232 0 CA-C-N 119.506 1.048 . . . . 0.0 114.245 -174.152 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 13.6 tptp . . . . . 0 N--CA 1.439 -1.0 1 N-CA-C 99.094 -4.41 . . . . 0.0 99.094 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 3.2 mm100 -93.07 120.22 33.13 Favored 'General case' 0 C--N 1.356 0.866 0 N-CA-C 107.24 -1.392 . . . . 0.0 107.24 178.13 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 29.5 m-85 -109.49 131.27 55.22 Favored 'General case' 0 C--N 1.355 0.806 0 O-C-N 121.033 -1.042 . . . . 0.0 108.271 -179.002 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . 0.444 ' HA ' ' HG ' ' A' ' 36' ' ' LEU . 8.2 t -68.08 127.43 32.85 Favored 'General case' 0 C--N 1.375 1.701 0 CA-C-N 120.708 1.594 . . . . 0.0 115.121 -176.863 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 90.5 p -125.5 -159.62 0.91 Allowed 'General case' 0 C--N 1.348 0.501 0 C-N-CA 126.188 1.795 . . . . 0.0 112.451 -176.544 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 95.4 m-85 -146.94 132.35 18.59 Favored 'General case' 0 C--N 1.366 1.298 0 C-N-CA 129.646 3.178 . . . . 0.0 108.302 176.663 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 7.7 p90 -130.02 154.63 47.22 Favored 'General case' 0 C--N 1.363 1.183 0 CA-C-N 120.692 1.587 . . . . 0.0 107.746 169.757 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 7.8 t80 -102.94 127.47 50.14 Favored 'General case' 0 C--N 1.36 1.04 0 N-CA-C 105.652 -1.981 . . . . 0.0 105.652 -179.768 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 16.8 tptp -109.12 111.35 22.92 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 120.875 -1.14 . . . . 0.0 110.153 -178.058 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' TRP . . . . . 0.414 ' HB2' ' O ' ' A' ' 7' ' ' CYS . 33.7 t-105 -33.98 -58.08 0.45 Allowed 'General case' 0 C--N 1.369 1.453 0 N-CA-C 120.494 3.516 . . . . 0.0 120.494 176.551 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 2.0 p -80.27 -5.92 57.05 Favored 'General case' 0 C--N 1.363 1.173 0 C-N-CA 126.524 1.93 . . . . 0.0 113.868 -179.564 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -94.88 -39.67 10.11 Favored 'General case' 0 C--N 1.363 1.194 0 C-N-CA 124.663 1.185 . . . . 0.0 109.94 173.924 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 11.7 tptm 78.09 17.95 1.19 Allowed 'General case' 0 C--N 1.373 1.619 0 C-N-CA 128.44 2.696 . . . . 0.0 112.241 179.079 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 56.8 mtmt -138.0 167.27 22.12 Favored 'General case' 0 C--N 1.354 0.789 0 C-N-CA 128.469 2.707 . . . . 0.0 110.637 -175.567 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 87.9 m -93.17 119.29 32.2 Favored 'General case' 0 C--N 1.365 1.249 0 C-N-CA 129.528 3.131 . . . . 0.0 111.291 179.434 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 58.3 mt -110.48 139.31 21.42 Favored Pre-proline 0 C--N 1.35 0.591 0 O-C-N 119.949 -1.72 . . . . 0.0 109.788 -179.882 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -87.89 104.62 0.53 Allowed 'Trans proline' 0 N--CA 1.462 -0.346 0 C-N-CA 124.163 3.242 . . . . 0.0 112.12 -178.92 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 1.1 p90 -98.8 -177.95 3.81 Favored 'General case' 0 C--N 1.359 0.982 0 N-CA-C 107.218 -1.401 . . . . 0.0 107.218 173.782 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.444 ' HG ' ' HA ' ' A' ' 21' ' ' SER . 6.8 mp -118.65 145.04 45.77 Favored 'General case' 0 CA--C 1.507 -0.684 0 O-C-N 119.251 -2.156 . . . . 0.0 105.896 176.092 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 25.9 t80 -106.86 138.67 42.59 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 126.408 1.883 . . . . 0.0 110.164 177.851 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 2.7 m -92.85 -5.33 51.21 Favored 'General case' 0 C--N 1.376 1.724 0 N-CA-C 116.475 2.028 . . . . 0.0 116.475 178.073 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 105.82 -58.18 0.46 Allowed Glycine 0 C--N 1.366 2.245 0 CA-C-N 120.415 1.461 . . . . 0.0 115.71 -176.764 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 3.3 m -116.02 134.64 54.74 Favored 'General case' 0 C--N 1.354 0.781 0 N-CA-C 104.323 -2.473 . . . . 0.0 104.323 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 113.35 -10.61 24.2 Favored Glycine 0 C--N 1.362 2.002 0 CA-C-N 120.591 1.541 . . . . 0.0 112.562 -174.599 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -87.43 126.76 8.14 Favored Glycine 0 C--N 1.361 1.932 0 C-N-CA 125.883 1.706 . . . . 0.0 110.206 168.587 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 42.0 p30 -88.48 -78.49 0.33 Allowed 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 127.272 2.229 . . . . 0.0 115.307 -179.52 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -136.84 -27.11 1.02 Allowed 'General case' 0 C--N 1.362 1.151 0 N-CA-C 117.53 2.419 . . . . 0.0 117.53 -176.165 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 55.8 t30 -109.45 78.49 1.14 Allowed 'General case' 0 CA--C 1.55 0.958 0 N-CA-C 117.962 2.578 . . . . 0.0 117.962 -170.635 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.684 HH21 ' NE ' ' A' ' 12' ' ' ARG 0.445 0.2 OUTLIER -146.34 147.96 31.88 Favored 'General case' 0 C--N 1.366 1.312 0 CA-C-N 123.902 3.046 . . . . 0.0 112.67 168.007 . . . . . . . . 4 4 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 7.2 m-85 -108.05 139.08 43.21 Favored 'General case' 0 C--N 1.368 1.409 0 C-N-CA 127.428 2.291 . . . . 0.0 112.416 -168.458 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -81.96 -24.63 35.42 Favored 'General case' 0 C--N 1.374 1.642 0 C-N-CA 126.311 1.844 . . . . 0.0 115.367 -179.61 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 57.3 p -139.54 163.94 31.22 Favored 'General case' 0 C--N 1.36 1.037 0 N-CA-C 105.599 -2.0 . . . . 0.0 105.599 176.519 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 14.1 tt -64.61 -21.52 29.4 Favored 'Isoleucine or valine' 0 C--N 1.367 1.354 0 C-N-CA 126.817 2.047 . . . . 0.0 116.191 179.489 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -84.43 -13.37 73.58 Favored Glycine 0 C--N 1.365 2.148 0 C-N-CA 126.05 1.786 . . . . 0.0 114.618 -179.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -82.76 -12.69 57.33 Favored 'General case' 0 C--N 1.366 1.319 0 O-C-N 120.823 -1.398 . . . . 0.0 111.61 174.577 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 14.9 t -72.71 -48.1 41.54 Favored 'General case' 0 C--N 1.361 1.107 0 C-N-CA 127.628 2.371 . . . . 0.0 112.755 178.045 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 11.0 mtp180 -69.99 -33.16 71.68 Favored 'General case' 0 C--N 1.346 0.424 1 C-N-CA 132.778 4.431 . . . . 0.0 112.994 173.699 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 31.5 ttmt -69.84 -36.94 75.99 Favored 'General case' 0 C--N 1.369 1.421 0 C-N-CA 126.825 2.05 . . . . 0.0 113.213 178.83 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 6.0 mtmm -89.09 -31.64 17.92 Favored 'General case' 0 C--N 1.367 1.366 0 C-N-CA 124.918 1.287 . . . . 0.0 111.91 172.88 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 56.4 m -127.33 8.85 6.59 Favored 'General case' 0 C--N 1.365 1.247 0 N-CA-C 121.558 3.91 . . . . 0.0 121.558 -173.557 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 14.1 mt -136.54 -32.41 0.83 Allowed 'General case' 0 C--N 1.359 1.018 1 CA-C-N 126.984 4.447 . . . . 0.0 115.228 169.392 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 86.46 55.31 2.48 Favored Glycine 0 C--N 1.359 1.827 0 CA-C-N 119.577 1.08 . . . . 0.0 112.279 -169.634 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 1.3 ptpp? . . . . . 0 C--O 1.258 1.527 0 N-CA-C 103.264 -2.865 . . . . 0.0 103.264 -176.594 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 3.4 t90 . . . . . 0 N--CA 1.433 -1.299 0 N-CA-C 105.996 -1.853 . . . . 0.0 105.996 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 30.4 mt-30 -136.38 144.86 49.35 Favored Pre-proline 0 N--CA 1.443 -0.789 0 N-CA-C 100.322 -3.955 . . . . 0.0 100.322 173.585 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . 0.41 ' HA ' ' HD3' ' A' ' 4' ' ' PRO . 47.1 Cg_endo -76.0 125.83 8.92 Favored 'Trans proline' 0 CA--C 1.558 1.701 0 C-N-CA 123.369 2.712 . . . . 0.0 114.5 -168.461 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . 0.498 ' HG2' ' CD2' ' A' ' 6' ' ' TYR . 40.5 Cg_endo -96.59 -114.38 0.0 OUTLIER 'Trans proline' 0 CA--C 1.547 1.168 1 C-N-CA 126.886 5.058 . . . . 0.0 111.345 -176.395 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' TRP . . . . . 0.506 ' CE3' ' CD1' ' A' ' 6' ' ' TYR 0.29 45.9 p-90 -86.74 -69.71 0.66 Allowed 'General case' 0 C--N 1.382 1.998 0 C-N-CA 127.623 2.369 . . . . 0.0 114.867 178.469 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.506 ' CD1' ' CE3' ' A' ' 5' ' ' TRP . 0.1 OUTLIER -33.14 -45.09 0.13 Allowed 'General case' 0 C--N 1.36 1.046 1 C-N-CA 132.995 4.518 . . . . 0.0 119.137 -173.397 . . . . . . . . 4 4 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.6 m -65.84 -41.79 91.31 Favored 'General case' 0 N--CA 1.448 -0.57 0 C-N-CA 128.235 2.614 . . . . 0.0 112.148 -179.827 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 44.2 mtpt -93.95 -7.97 41.42 Favored 'General case' 0 C--N 1.363 1.154 0 C-N-CA 129.073 2.949 . . . . 0.0 112.368 -179.278 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.437 ' HA ' ' HD3' ' A' ' 10' ' ' PRO . 0.6 OUTLIER -80.89 123.44 82.23 Favored Pre-proline 0 C--N 1.363 1.183 0 CA-C-O 116.326 -1.797 . . . . 0.0 112.738 -172.676 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . 0.437 ' HD3' ' HA ' ' A' ' 9' ' ' GLU . 50.7 Cg_exo -70.86 147.78 56.5 Favored 'Trans proline' 0 CA--C 1.54 0.779 0 C-N-CA 123.525 2.817 . . . . 0.0 115.479 -163.801 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 3.5 p -78.8 131.99 33.21 Favored 'Isoleucine or valine' 0 C--N 1.363 1.177 0 C-N-CA 125.375 1.47 . . . . 0.0 110.659 176.236 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 38.3 mtt-85 -136.23 152.03 50.31 Favored 'General case' 0 C--N 1.359 0.995 0 N-CA-C 106.408 -1.701 . . . . 0.0 106.408 -173.812 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.385 14.5 tt -125.18 -54.03 2.14 Favored 'Isoleucine or valine' 0 C--N 1.375 1.706 0 CA-C-N 120.988 1.722 . . . . 0.0 112.733 179.209 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.434 ' HA2' ' HA3' ' A' ' 41' ' ' GLY . . . . . . . . 0 C--N 1.357 1.716 0 CA-C-N 119.564 1.074 . . . . 0.0 112.168 173.84 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.491 ' NZ ' ' H ' ' A' ' 19' ' ' GLN . 4.8 tptp . . . . . 0 N--CA 1.45 -0.458 0 N-CA-C 104.898 -2.26 . . . . 0.0 104.898 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . 0.491 ' H ' ' NZ ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -145.82 102.22 3.64 Favored 'General case' 0 C--N 1.358 0.949 0 O-C-N 119.433 -2.042 . . . . 0.0 109.721 174.261 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 58.4 m-85 -93.71 147.21 23.25 Favored 'General case' 0 C--N 1.358 0.962 0 C-N-CA 127.644 2.378 . . . . 0.0 108.168 175.304 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 3.8 t -72.88 114.01 10.55 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 126.324 1.85 . . . . 0.0 115.175 -176.703 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 88.0 p -129.96 161.71 30.3 Favored 'General case' 0 C--N 1.367 1.327 0 N-CA-C 114.679 1.363 . . . . 0.0 114.679 -178.952 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . 0.413 ' HB2' ' HB2' ' A' ' 47' ' ' PHE . 91.8 m-85 -135.97 148.16 48.34 Favored 'General case' 0 CA--C 1.51 -0.594 0 N-CA-C 107.392 -1.336 . . . . 0.0 107.392 176.224 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 2.6 p90 -137.72 153.8 49.72 Favored 'General case' 0 C--N 1.358 0.945 0 C-N-CA 125.751 1.62 . . . . 0.0 108.996 176.183 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 15.7 t80 -96.32 135.81 37.66 Favored 'General case' 0 C--N 1.362 1.137 0 O-C-N 120.727 -1.233 . . . . 0.0 108.353 178.429 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.63 102.97 14.86 Favored 'General case' 0 N--CA 1.441 -0.914 0 O-C-N 121.799 -0.563 . . . . 0.0 110.813 178.882 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 10.6 t-105 -39.68 -47.02 1.95 Allowed 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 130.061 3.345 . . . . 0.0 118.196 169.484 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . 0.278 4.0 p -86.48 -23.23 26.04 Favored 'General case' 0 C--N 1.363 1.169 0 CA-C-O 118.147 -0.93 . . . . 0.0 112.774 176.875 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -82.07 -37.09 26.92 Favored 'General case' 0 C--N 1.376 1.753 0 CA-C-N 121.884 2.129 . . . . 0.0 114.854 173.705 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . 0.292 0.8 OUTLIER 81.96 22.28 0.27 Allowed 'General case' 0 C--N 1.371 1.503 0 C-N-CA 127.876 2.471 . . . . 0.0 111.8 -177.153 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 53.5 mtmt -143.94 169.68 17.34 Favored 'General case' 0 C--N 1.357 0.897 0 C-N-CA 127.174 2.189 . . . . 0.0 108.712 -177.182 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 80.0 m -91.52 145.24 24.78 Favored 'General case' 0 C--N 1.357 0.899 0 C-N-CA 127.108 2.163 . . . . 0.0 112.414 -179.452 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 31.2 mt -123.65 145.01 45.95 Favored Pre-proline 0 C--N 1.36 1.035 0 C-N-CA 125.374 1.47 . . . . 0.0 111.013 176.667 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -86.55 145.12 7.97 Favored 'Trans proline' 0 C--N 1.348 0.513 0 C-N-CA 124.492 3.462 . . . . 0.0 111.842 169.603 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . 0.273 13.5 p90 -141.27 -160.03 1.03 Allowed 'General case' 0 C--N 1.344 0.332 0 N-CA-C 105.787 -1.931 . . . . 0.0 105.787 170.896 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 58.5 mt -141.56 154.5 45.5 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 104.756 -2.313 . . . . 0.0 104.756 175.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 3.3 t80 -115.46 129.11 56.45 Favored 'General case' 0 CA--C 1.567 1.628 0 C-N-CA 125.457 1.503 . . . . 0.0 110.767 177.833 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 49.1 m -98.73 16.06 23.34 Favored 'General case' 0 C--N 1.382 2.01 0 N-CA-C 115.262 1.579 . . . . 0.0 115.262 -178.766 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 76.53 -56.47 3.36 Favored Glycine 0 C--N 1.352 1.469 0 O-C-N 120.133 -1.604 . . . . 0.0 116.257 178.936 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 14.4 m -79.45 34.23 0.26 Allowed 'General case' 0 C--N 1.358 0.954 0 C-N-CA 127.574 2.35 . . . . 0.0 115.666 179.744 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . 0.434 ' HA3' ' HA2' ' A' ' 14' ' ' GLY . . . 173.17 49.67 0.05 OUTLIER Glycine 0 CA--C 1.482 -1.976 0 O-C-N 120.556 -1.34 . . . . 0.0 114.078 174.607 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -104.53 128.06 9.32 Favored Glycine 0 C--N 1.354 1.572 0 N-CA-C 109.432 -1.467 . . . . 0.0 109.432 169.797 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 45.6 p30 -77.33 -57.5 3.8 Favored 'General case' 0 C--N 1.361 1.099 0 N-CA-C 116.331 1.974 . . . . 0.0 116.331 -178.668 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -177.35 -21.95 0.01 OUTLIER 'General case' 0 C--N 1.354 0.778 0 C-N-CA 126.886 2.074 . . . . 0.0 111.926 -178.286 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 39.3 t30 -96.96 89.24 4.77 Favored 'General case' 0 CA--C 1.555 1.146 0 O-C-N 119.283 -2.136 . . . . 0.0 116.416 -174.247 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . 0.355 0.0 OUTLIER -150.42 129.64 12.78 Favored 'General case' 0 C--N 1.355 0.833 0 O-C-N 120.689 -1.257 . . . . 0.0 110.42 168.033 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . 0.413 ' HB2' ' HB2' ' A' ' 23' ' ' PHE . 27.0 m-85 -99.89 150.98 21.83 Favored 'General case' 0 N--CA 1.447 -0.587 0 C-N-CA 126.46 1.904 . . . . 0.0 106.683 175.807 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -78.33 -38.33 42.46 Favored 'General case' 0 C--N 1.363 1.162 0 C-N-CA 125.718 1.607 . . . . 0.0 113.163 -178.299 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 75.5 p -129.95 165.31 22.36 Favored 'General case' 0 C--N 1.357 0.923 0 C-N-CA 125.189 1.395 . . . . 0.0 107.324 175.518 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 13.0 tt -71.98 -10.16 13.66 Favored 'Isoleucine or valine' 0 C--N 1.363 1.185 0 C-N-CA 126.501 1.92 . . . . 0.0 114.673 175.088 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -91.25 -10.62 62.11 Favored Glycine 0 C--N 1.365 2.181 0 O-C-N 120.178 -1.576 . . . . 0.0 114.101 176.664 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 -86.13 -41.16 14.96 Favored 'General case' 0 C--N 1.364 1.228 0 C-N-CA 125.81 1.644 . . . . 0.0 110.887 174.326 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . 0.258 4.1 t -42.51 -47.45 5.1 Favored 'General case' 0 C--N 1.365 1.267 0 C-N-CA 128.952 2.901 . . . . 0.0 116.306 -175.908 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 10.0 ptt180 -69.42 -19.79 63.79 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 129.646 3.178 . . . . 0.0 117.37 174.671 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 8.6 mptt -79.84 -6.12 56.76 Favored 'General case' 0 C--N 1.375 1.694 0 O-C-N 119.493 -2.005 . . . . 0.0 113.495 178.193 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.423 ' HD3' ' CE1' ' A' ' 6' ' ' TYR . 5.6 mtmm -111.16 -21.78 11.76 Favored 'General case' 0 C--N 1.354 0.773 0 O-C-N 120.32 -1.487 . . . . 0.0 110.38 176.816 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 57.4 m -131.3 8.38 4.66 Favored 'General case' 0 C--N 1.364 1.224 0 N-CA-C 116.736 2.125 . . . . 0.0 116.736 -171.0 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 11.6 mt -130.91 -13.51 3.6 Favored 'General case' 0 N--CA 1.476 0.85 0 CA-C-N 123.64 2.927 . . . . 0.0 111.675 172.528 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 73.52 59.68 4.04 Favored Glycine 0 C--N 1.359 1.828 0 C-N-CA 127.999 2.714 . . . . 0.0 112.863 -169.601 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 19.2 mtpt . . . . . 0 C--O 1.262 1.762 0 C-N-CA 124.721 1.208 . . . . 0.0 107.767 -178.83 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 1' ' ' TRP . . . . . 0.458 ' CZ2' ' HB3' ' A' ' 3' ' ' PRO . 4.4 t90 . . . . . 0 N--CA 1.433 -1.298 0 N-CA-C 107.456 -1.313 . . . . 0.0 107.456 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 25.0 mm-40 -147.57 150.66 37.54 Favored Pre-proline 0 C--N 1.351 0.669 1 N-CA-C 98.281 -4.711 . . . . 0.0 98.281 173.674 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . 0.48 ' HB2' ' HD2' ' A' ' 8' ' ' LYS . 66.2 Cg_endo -82.65 123.08 3.65 Favored 'Trans proline' 0 CA--C 1.558 1.717 0 CA-C-N 124.168 2.524 . . . . 0.0 114.906 -165.194 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . 0.451 ' HD3' ' HA ' ' A' ' 3' ' ' PRO . 27.7 Cg_exo -73.79 -110.31 0.01 OUTLIER 'Trans proline' 0 C--N 1.365 1.416 1 C-N-CA 126.96 5.107 . . . . 0.0 112.827 173.088 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' TRP . . . . . 0.55 ' CE3' ' CD2' ' A' ' 6' ' ' TYR 0.298 17.5 p-90 -88.91 -76.52 0.4 Allowed 'General case' 0 C--N 1.375 1.687 0 N-CA-C 116.419 2.007 . . . . 0.0 116.419 178.968 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.55 ' CD2' ' CE3' ' A' ' 5' ' ' TRP . 0.0 OUTLIER -29.65 -51.88 0.12 Allowed 'General case' 0 C--N 1.36 1.062 1 C-N-CA 135.173 5.389 . . . . 0.0 118.404 -171.391 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.425 ' O ' ' HB2' ' A' ' 27' ' ' TRP . 0.0 OUTLIER -53.12 -41.65 65.25 Favored 'General case' 0 N--CA 1.443 -0.795 1 C-N-CA 131.732 4.013 . . . . 0.0 112.503 178.739 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.48 ' HD2' ' HB2' ' A' ' 3' ' ' PRO . 0.0 OUTLIER -108.82 17.56 21.7 Favored 'General case' 0 C--N 1.367 1.362 0 C-N-CA 127.366 2.266 . . . . 0.0 111.702 -178.451 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.434 ' HA ' ' HD3' ' A' ' 10' ' ' PRO . 4.4 tp10 -93.61 133.11 28.61 Favored Pre-proline 0 C--N 1.361 1.108 0 CA-C-O 116.488 -1.72 . . . . 0.0 112.041 -173.172 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . 0.434 ' HD3' ' HA ' ' A' ' 9' ' ' GLU . 51.9 Cg_exo -70.24 125.95 12.45 Favored 'Trans proline' 0 CA--C 1.54 0.797 0 CA-C-N 125.276 2.92 . . . . 0.0 116.23 -164.73 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 10.1 p -68.9 139.73 20.04 Favored 'Isoleucine or valine' 0 C--N 1.367 1.339 0 C-N-CA 127.453 2.301 . . . . 0.0 114.041 178.582 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 61.8 mtt180 -145.73 120.61 9.97 Favored 'General case' 0 C--N 1.368 1.408 0 C-N-CA 126.297 1.839 . . . . 0.0 111.643 -173.487 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 14.4 tt -88.84 -32.33 5.8 Favored 'Isoleucine or valine' 0 C--N 1.371 1.532 0 CA-C-N 121.245 1.839 . . . . 0.0 113.783 179.691 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.351 1.393 0 C-N-CA 126.139 1.828 . . . . 0.0 115.279 179.902 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 53.8 tptt . . . . . 0 CA--C 1.519 -0.23 0 N-CA-C 101.682 -3.451 . . . . 0.0 101.682 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -118.54 105.52 11.73 Favored 'General case' 0 C--N 1.353 0.734 0 N-CA-C 106.488 -1.671 . . . . 0.0 106.488 173.181 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 22.5 m-85 -96.56 144.35 26.71 Favored 'General case' 0 C--N 1.362 1.116 0 C-N-CA 126.564 1.946 . . . . 0.0 109.77 -177.698 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 7.0 t -69.76 113.31 6.89 Favored 'General case' 0 C--N 1.369 1.441 0 N-CA-C 115.488 1.662 . . . . 0.0 115.488 -178.288 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 78.3 p -120.7 -166.25 1.31 Allowed 'General case' 0 C--N 1.359 0.988 0 C-N-CA 126.321 1.849 . . . . 0.0 113.431 -179.396 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 29.6 m-85 -148.35 149.58 32.05 Favored 'General case' 0 C--N 1.359 0.986 1 C-N-CA 131.877 4.071 . . . . 0.0 109.008 174.487 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 10.5 p90 -144.11 150.8 38.69 Favored 'General case' 0 C--N 1.362 1.113 0 C-N-CA 127.96 2.504 . . . . 0.0 110.986 175.685 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 9.2 t80 -98.24 119.1 36.32 Favored 'General case' 0 C--N 1.381 1.951 0 N-CA-C 106.916 -1.512 . . . . 0.0 106.916 177.071 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 9.4 tptt -103.74 110.44 22.54 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 125.538 1.535 . . . . 0.0 109.124 -179.256 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' TRP . . . . . 0.425 ' HB2' ' O ' ' A' ' 7' ' ' CYS . 33.2 t-105 -44.99 -49.88 10.98 Favored 'General case' 0 C--N 1.362 1.142 0 C-N-CA 131.14 3.776 . . . . 0.0 117.695 176.502 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 10.8 p -82.46 3.75 26.99 Favored 'General case' 0 C--N 1.36 1.059 0 C-N-CA 125.973 1.709 . . . . 0.0 113.617 -179.565 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -107.25 -46.49 3.87 Favored 'General case' 0 C--N 1.357 0.929 0 C-N-CA 125.604 1.562 . . . . 0.0 108.49 173.114 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . 0.309 0.2 OUTLIER 81.11 24.6 0.27 Allowed 'General case' 0 C--N 1.367 1.346 0 C-N-CA 128.845 2.858 . . . . 0.0 112.352 179.098 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 83.0 tttt -149.82 163.83 36.97 Favored 'General case' 0 N--CA 1.441 -0.902 0 N-CA-C 106.178 -1.786 . . . . 0.0 106.178 179.573 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 89.6 m -79.27 130.07 35.09 Favored 'General case' 0 C--N 1.358 0.957 0 C-N-CA 128.169 2.588 . . . . 0.0 113.927 175.805 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 80.8 mt -120.87 147.9 47.25 Favored Pre-proline 0 C--N 1.355 0.807 0 C-N-CA 124.591 1.157 . . . . 0.0 110.172 179.883 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -85.87 125.14 2.7 Favored 'Trans proline' 0 C--N 1.351 0.666 0 C-N-CA 124.454 3.436 . . . . 0.0 111.587 173.248 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -114.87 -168.86 1.44 Allowed 'General case' 0 C--N 1.354 0.764 0 N-CA-C 103.962 -2.607 . . . . 0.0 103.962 167.34 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 19.6 mt -119.25 155.82 31.05 Favored 'General case' 0 N--CA 1.441 -0.922 0 O-C-N 119.324 -2.11 . . . . 0.0 106.493 175.248 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 22.0 t80 -117.69 137.36 52.72 Favored 'General case' 0 N--CA 1.471 0.611 0 O-C-N 121.055 -1.028 . . . . 0.0 110.187 175.295 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 2.8 t -111.78 37.13 3.03 Favored 'General case' 0 C--N 1.375 1.715 0 N-CA-C 114.758 1.392 . . . . 0.0 114.758 175.721 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 72.29 -45.25 0.96 Allowed Glycine 0 C--N 1.36 1.897 0 N-CA-C 121.329 3.292 . . . . 0.0 121.329 161.986 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -116.43 165.94 12.64 Favored 'General case' 0 C--N 1.347 0.487 0 C-N-CA 126.694 1.998 . . . . 0.0 105.654 173.869 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 90.26 -33.63 4.45 Favored Glycine 0 N--CA 1.484 1.89 0 O-C-N 119.565 -1.959 . . . . 0.0 116.027 177.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -60.59 -174.51 1.11 Allowed Glycine 0 C--N 1.37 2.43 0 N-CA-C 120.696 3.039 . . . . 0.0 120.696 179.76 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . 0.531 ' H ' ' NH1' ' A' ' 46' ' ' ARG 0.272 26.2 p30 -136.39 -103.78 0.21 Allowed 'General case' 0 C--N 1.355 0.813 0 O-C-N 120.779 -1.424 . . . . 0.0 112.818 -179.648 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -155.33 5.03 0.21 Allowed 'General case' 0 C--N 1.35 0.627 0 O-C-N 120.873 -1.142 . . . . 0.0 113.271 -173.672 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 49.3 t30 -95.88 53.55 1.42 Allowed 'General case' 0 C--N 1.365 1.241 0 O-C-N 118.766 -2.459 . . . . 0.0 108.172 175.109 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.531 ' NH1' ' H ' ' A' ' 43' ' ' ASN . 0.0 OUTLIER -139.94 144.25 37.0 Favored 'General case' 0 N--CA 1.443 -0.798 0 N-CA-C 107.862 -1.162 . . . . 0.0 107.862 -177.463 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 52.8 m-85 -131.1 134.01 46.19 Favored 'General case' 0 N--CA 1.449 -0.494 0 C-N-CA 127.705 2.402 . . . . 0.0 107.358 -169.856 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.69 -16.93 61.67 Favored 'General case' 0 C--N 1.373 1.625 0 N-CA-C 116.699 2.111 . . . . 0.0 116.699 -177.35 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 40.9 p -146.29 -176.97 5.38 Favored 'General case' 0 C--N 1.352 0.685 0 N-CA-C 103.752 -2.684 . . . . 0.0 103.752 177.267 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 15.0 tt -76.59 -27.07 16.89 Favored 'Isoleucine or valine' 0 C--N 1.367 1.343 0 O-C-N 120.081 -1.637 . . . . 0.0 114.072 175.794 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -90.4 20.57 36.91 Favored Glycine 0 C--N 1.365 2.185 0 O-C-N 120.598 -1.314 . . . . 0.0 115.486 -171.688 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -112.87 -14.77 13.02 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 126.82 2.048 . . . . 0.0 108.587 171.51 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 15.9 t -87.07 -43.29 12.42 Favored 'General case' 0 C--N 1.361 1.067 0 C-N-CA 126.989 2.116 . . . . 0.0 115.748 -174.775 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . 0.301 0.0 OUTLIER -82.51 -24.75 33.98 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 126.623 1.969 . . . . 0.0 115.07 -175.546 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 28.2 ttmt -71.88 -15.98 62.12 Favored 'General case' 0 C--N 1.357 0.925 0 C-N-CA 127.497 2.319 . . . . 0.0 115.564 176.61 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.444 ' HD2' ' CD2' ' A' ' 6' ' ' TYR . 9.3 mtmm -100.81 -24.9 14.29 Favored 'General case' 0 C--N 1.36 1.058 0 C-N-CA 126.31 1.844 . . . . 0.0 112.357 175.458 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 43.6 m -137.54 26.68 2.82 Favored 'General case' 0 C--N 1.355 0.825 0 N-CA-C 116.935 2.198 . . . . 0.0 116.935 -167.305 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 16.7 mt -146.0 -23.73 0.45 Allowed 'General case' 0 N--CA 1.471 0.625 0 CA-C-N 120.546 1.521 . . . . 0.0 112.396 170.924 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 82.43 63.26 1.79 Allowed Glycine 0 C--N 1.36 1.904 0 C-N-CA 128.561 2.981 . . . . 0.0 112.576 -168.323 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 14.0 ptmt . . . . . 0 C--O 1.258 1.55 0 CA-C-O 116.284 -1.817 . . . . 0.0 106.723 -176.088 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 70.0 t90 . . . . . 0 N--CA 1.433 -1.281 0 N-CA-C 106.541 -1.651 . . . . 0.0 106.541 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 68.1 mt-30 -144.11 152.32 54.34 Favored Pre-proline 0 CA--C 1.512 -0.489 1 N-CA-C 97.996 -4.816 . . . . 0.0 97.996 172.352 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . 0.486 ' HA ' ' HD3' ' A' ' 4' ' ' PRO . 1.5 Cg_endo -79.83 122.16 4.8 Favored 'Trans proline' 0 N--CA 1.452 -0.956 0 CA-C-N 124.207 2.538 . . . . 0.0 112.618 -170.351 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . 0.486 ' HD3' ' HA ' ' A' ' 3' ' ' PRO . 16.2 Cg_exo -85.25 -116.08 0.01 OUTLIER 'Trans proline' 0 C--N 1.359 1.103 0 C-N-CA 124.913 3.742 . . . . 0.0 111.185 179.677 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' TRP . . . . . 0.501 ' CE2' ' CE2' ' A' ' 6' ' ' TYR . 42.6 p-90 -81.72 -72.53 0.43 Allowed 'General case' 0 C--N 1.375 1.68 0 C-N-CA 124.941 1.296 . . . . 0.0 114.021 -179.746 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.501 ' CE2' ' CE2' ' A' ' 5' ' ' TRP . 0.0 OUTLIER -33.35 -43.89 0.12 Allowed 'General case' 0 C--N 1.361 1.09 1 C-N-CA 134.273 5.029 . . . . 0.0 117.206 -179.853 . . . . . . . . 4 4 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.5 m -83.19 -15.72 49.39 Favored 'General case' 0 N--CA 1.44 -0.956 0 C-N-CA 127.636 2.374 . . . . 0.0 114.173 -173.728 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 67.8 mttm -125.52 32.23 5.37 Favored 'General case' 0 C--N 1.357 0.928 0 C-N-CA 126.892 2.077 . . . . 0.0 105.904 178.537 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 5.9 tm-20 -94.15 141.38 23.54 Favored Pre-proline 0 C--N 1.366 1.3 0 C-N-CA 125.106 1.362 . . . . 0.0 109.862 -176.299 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -89.84 142.37 3.97 Favored 'Trans proline' 0 N--CA 1.448 -1.16 0 C-N-CA 124.858 3.706 . . . . 0.0 108.074 177.609 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . 0.397 3.0 p -77.05 122.32 31.33 Favored 'Isoleucine or valine' 0 C--N 1.362 1.141 0 O-C-N 119.21 -2.182 . . . . 0.0 116.559 -173.659 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.476 ' HB2' HH22 ' A' ' 46' ' ' ARG . 11.0 mtm-85 -102.78 117.73 35.29 Favored 'General case' 0 N--CA 1.443 -0.809 0 C-N-CA 129.855 3.262 . . . . 0.0 109.778 -179.454 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 10.2 tt -90.52 -31.82 5.25 Favored 'Isoleucine or valine' 0 C--N 1.366 1.294 0 CA-C-N 121.103 1.774 . . . . 0.0 111.09 171.535 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.358 1.773 0 C-N-CA 123.933 0.778 . . . . 0.0 114.087 -177.621 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.503 -0.852 0 N-CA-C 100.831 -3.766 . . . . 0.0 100.831 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 7.1 mm-40 -92.82 113.25 25.47 Favored 'General case' 0 C--N 1.356 0.873 0 N-CA-C 106.699 -1.593 . . . . 0.0 106.699 -178.21 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 67.2 m-85 -106.98 141.85 37.53 Favored 'General case' 0 C--N 1.355 0.845 0 C-N-CA 125.147 1.379 . . . . 0.0 110.674 -174.435 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 24.6 t -70.5 104.62 2.81 Favored 'General case' 0 C--N 1.368 1.389 0 C-N-CA 125.704 1.602 . . . . 0.0 112.686 177.826 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 64.7 p -99.75 -161.17 0.85 Allowed 'General case' 0 C--N 1.349 0.544 0 C-N-CA 125.802 1.641 . . . . 0.0 112.151 177.866 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . 0.453 ' HA ' ' HA ' ' A' ' 34' ' ' PRO . 98.8 m-85 -148.2 132.99 17.96 Favored 'General case' 0 C--N 1.355 0.818 0 C-N-CA 127.237 2.215 . . . . 0.0 105.633 169.69 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 13.2 p90 -125.73 150.36 47.77 Favored 'General case' 0 CA--C 1.516 -0.327 0 C-N-CA 125.676 1.59 . . . . 0.0 109.638 177.414 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 10.8 t80 -91.01 118.97 30.81 Favored 'General case' 0 C--N 1.367 1.369 0 N-CA-C 103.447 -2.797 . . . . 0.0 103.447 176.921 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.94 115.86 27.98 Favored 'General case' 0 N--CA 1.431 -1.413 0 C-N-CA 123.236 0.615 . . . . 0.0 109.727 -176.895 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 48.1 t-105 -51.46 -45.75 62.83 Favored 'General case' 0 C--N 1.366 1.284 0 C-N-CA 128.628 2.771 . . . . 0.0 117.788 -178.324 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 17.3 p -84.75 -3.66 58.69 Favored 'General case' 0 C--N 1.352 0.676 0 C-N-CA 124.64 1.176 . . . . 0.0 113.778 179.922 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -100.79 -45.97 5.3 Favored 'General case' 0 C--N 1.361 1.085 0 C-N-CA 124.641 1.176 . . . . 0.0 113.631 176.675 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . 0.316 67.2 mmtt 85.15 20.55 0.11 Allowed 'General case' 0 C--N 1.368 1.383 0 C-N-CA 128.757 2.823 . . . . 0.0 112.161 -176.312 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.586 ' HZ3' ' H ' ' A' ' 32' ' ' CYS . 2.4 mmmp? -145.64 179.33 7.5 Favored 'General case' 0 C--N 1.355 0.812 0 C-N-CA 128.197 2.599 . . . . 0.0 109.979 -179.771 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.586 ' H ' ' HZ3' ' A' ' 31' ' ' LYS . 73.9 m -105.93 129.51 54.06 Favored 'General case' 0 C--N 1.358 0.977 0 C-N-CA 127.991 2.516 . . . . 0.0 115.085 -171.602 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 59.2 mt -120.37 144.55 38.45 Favored Pre-proline 0 C--N 1.357 0.916 0 O-C-N 119.707 -1.871 . . . . 0.0 110.505 -179.899 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.453 ' HA ' ' HA ' ' A' ' 23' ' ' PHE . 89.3 Cg_endo -81.39 110.19 2.19 Favored 'Trans proline' 0 C--N 1.351 0.677 0 C-N-CA 124.879 3.719 . . . . 0.0 113.797 176.414 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . 0.293 2.8 p90 -102.71 168.59 9.15 Favored 'General case' 0 C--N 1.363 1.175 0 CA-C-O 122.115 0.959 . . . . 0.0 109.751 174.644 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 61.0 mt -94.78 125.3 39.34 Favored 'General case' 0 C--N 1.351 0.634 0 N-CA-C 107.357 -1.349 . . . . 0.0 107.357 174.021 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 5.4 t80 -112.74 137.11 51.54 Favored 'General case' 0 C--N 1.35 0.603 0 C-N-CA 125.333 1.453 . . . . 0.0 109.055 179.31 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -90.77 9.97 27.92 Favored 'General case' 0 C--N 1.371 1.503 0 N-CA-C 116.758 2.132 . . . . 0.0 116.758 -177.318 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 93.4 -44.05 2.47 Favored Glycine 0 C--N 1.361 1.922 0 N-CA-C 119.056 2.383 . . . . 0.0 119.056 168.46 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -124.15 145.7 49.13 Favored 'General case' 0 C--N 1.35 0.603 0 N-CA-C 106.242 -1.762 . . . . 0.0 106.242 175.348 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 117.54 -41.06 2.16 Favored Glycine 0 C--N 1.361 1.932 0 C-N-CA 124.462 1.029 . . . . 0.0 113.744 -179.541 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -67.18 -171.23 4.9 Favored Glycine 0 C--N 1.36 1.878 0 N-CA-C 122.305 3.682 . . . . 0.0 122.305 -176.292 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . 0.475 HD22 ' CZ ' ' A' ' 12' ' ' ARG . 6.8 p30 -124.87 -115.75 0.29 Allowed 'General case' 0 C--N 1.359 1.002 0 C-N-CA 125.201 1.4 . . . . 0.0 111.214 -178.921 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -141.49 19.61 2.21 Favored 'General case' 0 C--N 1.364 1.232 0 O-C-N 119.952 -1.717 . . . . 0.0 112.483 178.271 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . 0.467 ' H ' HH11 ' A' ' 46' ' ' ARG . 49.9 t30 -91.25 36.59 0.93 Allowed 'General case' 0 CA--C 1.564 1.515 0 O-C-N 119.919 -1.738 . . . . 0.0 108.892 172.318 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.476 HH22 ' HB2' ' A' ' 12' ' ' ARG . 0.0 OUTLIER -137.91 97.81 3.5 Favored 'General case' 0 C--N 1.361 1.091 0 C-N-CA 127.839 2.456 . . . . 0.0 105.982 -178.341 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . 0.425 ' HB2' ' HB2' ' A' ' 23' ' ' PHE . 24.7 m-85 -94.24 153.22 18.16 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 111.679 -2.51 . . . . 0.0 111.895 -169.47 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . 0.262 0.0 OUTLIER -68.86 -43.56 75.14 Favored 'General case' 0 C--N 1.376 1.736 0 C-N-CA 125.786 1.635 . . . . 0.0 114.762 -179.806 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 72.2 p -137.88 162.28 34.42 Favored 'General case' 0 C--N 1.351 0.632 0 C-N-CA 127.996 2.518 . . . . 0.0 105.396 177.382 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 15.0 tt -66.45 -11.13 12.64 Favored 'Isoleucine or valine' 0 C--N 1.36 1.054 0 C-N-CA 127.577 2.351 . . . . 0.0 116.324 178.269 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -90.56 -9.09 65.07 Favored Glycine 0 C--N 1.367 2.295 0 C-N-CA 125.532 1.539 . . . . 0.0 114.259 174.385 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 12.8 tt0 -92.72 -14.09 28.45 Favored 'General case' 0 C--N 1.358 0.948 0 C-N-CA 125.304 1.442 . . . . 0.0 112.414 176.875 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 40.6 t -64.97 -41.28 95.58 Favored 'General case' 0 C--N 1.361 1.1 0 C-N-CA 129.137 2.975 . . . . 0.0 114.911 179.791 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 12.0 mtp180 -71.15 -21.41 62.18 Favored 'General case' 0 CA--C 1.532 0.282 1 C-N-CA 134.323 5.049 . . . . 0.0 115.767 178.595 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 49.1 mtmt -82.89 -19.79 36.69 Favored 'General case' 0 C--N 1.36 1.025 0 O-C-N 120.235 -1.541 . . . . 0.0 114.004 -178.796 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 10.6 mtmm -100.4 -30.18 11.98 Favored 'General case' 0 C--N 1.361 1.097 0 C-N-CA 126.711 2.005 . . . . 0.0 109.553 174.241 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . 0.48 ' SG ' ' HB2' ' A' ' 6' ' ' TYR . 96.3 m -124.32 10.08 8.6 Favored 'General case' 0 C--N 1.359 0.989 0 N-CA-C 119.737 3.236 . . . . 0.0 119.737 -172.654 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . 0.259 15.6 mt -131.86 -11.13 3.43 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-N 125.081 3.582 . . . . 0.0 113.065 169.233 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 70.61 52.17 17.2 Favored Glycine 0 C--N 1.365 2.179 0 C-N-CA 128.606 3.003 . . . . 0.0 113.43 -172.869 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 13.6 ptpt . . . . . 0 C--O 1.262 1.725 0 N-CA-C 104.959 -2.238 . . . . 0.0 104.959 -175.064 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 83.4 t90 . . . . . 0 N--CA 1.435 -1.182 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 23.6 mm-40 -147.35 154.58 45.68 Favored Pre-proline 0 C--N 1.352 0.683 1 N-CA-C 98.905 -4.48 . . . . 0.0 98.905 171.45 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . 0.487 ' HA ' ' HD3' ' A' ' 4' ' ' PRO . 3.2 Cg_exo -79.71 118.34 3.81 Favored 'Trans proline' 0 CA--C 1.541 0.844 0 CA-C-N 124.974 2.812 . . . . 0.0 114.335 -167.174 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . 0.487 ' HD3' ' HA ' ' A' ' 3' ' ' PRO . 14.0 Cg_exo -88.63 -109.42 0.0 OUTLIER 'Trans proline' 0 C--N 1.365 1.407 0 C-N-CA 125.045 3.83 . . . . 0.0 110.184 -175.953 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' TRP . . . . . 0.468 ' CE3' ' CD2' ' A' ' 6' ' ' TYR 0.272 45.1 p-90 -88.25 -72.26 0.54 Allowed 'General case' 0 C--N 1.372 1.558 0 N-CA-C 116.188 1.922 . . . . 0.0 116.188 -179.476 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.499 ' CE2' ' HD3' ' A' ' 56' ' ' LYS . 0.0 OUTLIER -30.85 -49.67 0.13 Allowed 'General case' 0 C--N 1.359 0.981 1 C-N-CA 135.672 5.589 . . . . 0.0 118.182 -175.667 . . . . . . . . 4 4 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.403 ' O ' ' HB2' ' A' ' 27' ' ' TRP . 1.8 m -57.99 -40.96 82.0 Favored 'General case' 0 C--N 1.349 0.572 0 C-N-CA 127.657 2.383 . . . . 0.0 114.116 -176.811 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 24.4 mtpp -105.55 22.26 15.8 Favored 'General case' 0 C--N 1.363 1.163 0 C-N-CA 126.283 1.833 . . . . 0.0 110.255 177.049 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -93.91 123.1 60.49 Favored Pre-proline 0 C--N 1.369 1.439 0 O-C-N 119.685 -1.885 . . . . 0.0 110.295 -174.709 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 80.3 Cg_exo -59.1 124.48 15.74 Favored 'Trans proline' 0 C--N 1.36 1.155 0 C-N-CA 124.758 3.639 . . . . 0.0 116.766 -165.023 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 9.9 p -88.02 126.66 41.45 Favored 'Isoleucine or valine' 0 C--N 1.37 1.479 0 C-N-CA 124.997 1.319 . . . . 0.0 111.328 -179.818 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.62 ' HB2' HH21 ' A' ' 46' ' ' ARG . 32.6 mtt180 -134.76 135.61 42.01 Favored 'General case' 0 N--CA 1.438 -1.047 0 C-N-CA 128.423 2.689 . . . . 0.0 111.158 -175.436 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 11.9 tt -95.41 -39.25 9.62 Favored 'Isoleucine or valine' 0 C--N 1.37 1.487 0 C-N-CA 127.428 2.291 . . . . 0.0 112.58 175.598 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.364 2.085 0 C-N-CA 128.022 2.725 . . . . 0.0 116.983 -174.229 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 14.5 ptmm? . . . . . 0 CA--C 1.506 -0.745 0 N-CA-C 103.643 -2.725 . . . . 0.0 103.643 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.6 mm100 -93.27 108.81 20.37 Favored 'General case' 0 C--N 1.358 0.941 0 O-C-N 120.397 -1.439 . . . . 0.0 110.985 -176.577 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 83.1 m-85 -95.34 155.06 16.9 Favored 'General case' 0 C--N 1.354 0.803 0 C-N-CA 126.796 2.038 . . . . 0.0 109.638 -176.2 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 11.3 t -71.08 116.3 11.21 Favored 'General case' 0 C--N 1.369 1.416 0 C-N-CA 127.095 2.158 . . . . 0.0 114.35 -178.589 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 51.5 p -141.58 171.33 14.21 Favored 'General case' 0 C--N 1.353 0.749 0 N-CA-C 114.934 1.457 . . . . 0.0 114.934 -175.038 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 82.2 m-85 -135.88 158.11 45.19 Favored 'General case' 0 C--N 1.354 0.77 0 C-N-CA 128.839 2.856 . . . . 0.0 111.853 177.709 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 23.0 p90 -147.47 156.03 42.47 Favored 'General case' 0 C--N 1.368 1.406 0 C-N-CA 126.412 1.885 . . . . 0.0 110.771 176.029 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . 0.454 ' CD2' ' HB2' ' A' ' 57' ' ' CYS . 5.4 t80 -94.82 128.53 41.63 Favored 'General case' 0 C--N 1.376 1.728 0 N-CA-C 106.334 -1.728 . . . . 0.0 106.334 172.392 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -107.42 113.66 27.16 Favored 'General case' 0 N--CA 1.426 -1.638 0 C-N-CA 126.844 2.058 . . . . 0.0 108.135 -176.709 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' TRP . . . . . 0.403 ' HB2' ' O ' ' A' ' 7' ' ' CYS . 32.0 t-105 -49.46 -55.74 12.13 Favored 'General case' 0 C--N 1.359 0.998 0 C-N-CA 130.649 3.58 . . . . 0.0 117.942 -178.27 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.9 p -77.41 -14.72 59.64 Favored 'General case' 0 C--N 1.358 0.954 0 C-N-CA 126.327 1.851 . . . . 0.0 113.503 -178.347 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -88.35 -38.59 15.01 Favored 'General case' 0 C--N 1.363 1.17 0 C-N-CA 124.359 1.064 . . . . 0.0 111.732 174.317 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 60.2 mmtt 74.24 21.51 2.44 Favored 'General case' 0 C--N 1.372 1.548 0 C-N-CA 126.964 2.105 . . . . 0.0 112.682 -179.295 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 38.2 ttpt -147.76 166.92 26.06 Favored 'General case' 0 N--CA 1.437 -1.124 0 C-N-CA 126.852 2.061 . . . . 0.0 106.967 -174.433 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 74.9 m -90.94 144.84 25.26 Favored 'General case' 0 C--N 1.361 1.07 0 C-N-CA 126.044 1.738 . . . . 0.0 112.705 178.187 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 89.3 mt -131.87 148.88 71.66 Favored Pre-proline 0 C--N 1.36 1.052 0 C-N-CA 126.855 2.062 . . . . 0.0 109.559 179.238 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -83.98 152.01 12.7 Favored 'Trans proline' 0 C--N 1.352 0.735 0 C-N-CA 124.776 3.65 . . . . 0.0 111.591 166.532 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.424 ' CZ ' ' HD2' ' A' ' 46' ' ' ARG 0.317 0.8 OUTLIER -138.49 -156.22 0.67 Allowed 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 104.085 -2.561 . . . . 0.0 104.085 170.269 . . . . . . . . 4 4 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 48.1 mt -141.08 148.75 40.66 Favored 'General case' 0 CA--C 1.502 -0.901 1 N-CA-C 99.761 -4.163 . . . . 0.0 99.761 176.241 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -124.07 135.65 53.71 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 119.705 1.139 . . . . 0.0 109.759 -178.123 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.9 m -79.68 -10.76 59.84 Favored 'General case' 0 C--N 1.369 1.437 0 N-CA-C 119.433 3.124 . . . . 0.0 119.433 -176.592 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 128.79 -59.14 0.69 Allowed Glycine 0 C--N 1.358 1.795 0 CA-C-N 121.803 2.092 . . . . 0.0 114.464 -178.087 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 30.8 p -144.15 56.82 1.32 Allowed 'General case' 0 C--N 1.35 0.594 0 C-N-CA 125.794 1.638 . . . . 0.0 106.856 -179.364 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -121.16 -48.36 0.29 Allowed Glycine 0 C--N 1.356 1.641 0 C-N-CA 125.637 1.589 . . . . 0.0 110.002 -177.936 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -83.2 153.99 31.22 Favored Glycine 0 C--N 1.361 1.928 0 N-CA-C 116.048 1.179 . . . . 0.0 116.048 177.256 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . 0.477 ' H ' ' NH2' ' A' ' 46' ' ' ARG 0.422 10.2 p30 -95.3 -101.25 0.16 Allowed 'General case' 0 CA--C 1.55 0.947 0 N-CA-C 115.676 1.732 . . . . 0.0 115.676 179.696 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -129.39 9.08 5.55 Favored 'General case' 0 C--N 1.369 1.421 0 N-CA-C 117.476 2.399 . . . . 0.0 117.476 -170.341 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 33.7 t30 -109.65 30.29 6.79 Favored 'General case' 0 C--N 1.364 1.224 0 O-C-N 119.761 -1.837 . . . . 0.0 106.642 176.223 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.62 HH21 ' HB2' ' A' ' 12' ' ' ARG . 43.2 mmt-85 -111.42 123.2 49.74 Favored 'General case' 0 C--N 1.368 1.4 0 CA-C-O 124.821 2.248 . . . . 0.0 109.702 -177.59 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 15.6 m-85 -113.55 148.28 36.41 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-N 112.207 -2.27 . . . . 0.0 112.167 -172.494 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -82.79 -27.64 30.82 Favored 'General case' 0 C--N 1.37 1.484 0 C-N-CA 125.931 1.692 . . . . 0.0 114.621 -179.85 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 61.9 p -137.65 173.54 11.54 Favored 'General case' 0 C--N 1.356 0.872 0 N-CA-C 106.588 -1.634 . . . . 0.0 106.588 177.827 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 14.0 tt -67.51 -27.96 40.37 Favored 'Isoleucine or valine' 0 C--N 1.365 1.26 0 C-N-CA 128.226 2.61 . . . . 0.0 114.764 179.003 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -94.35 5.3 70.91 Favored Glycine 0 C--N 1.361 1.947 0 O-C-N 121.251 -0.905 . . . . 0.0 114.464 -173.339 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -91.71 -21.96 20.46 Favored 'General case' 0 C--N 1.359 0.981 0 CA-C-O 122.227 1.013 . . . . 0.0 110.213 172.745 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 40.0 t -64.41 -51.75 61.65 Favored 'General case' 0 C--N 1.359 1.012 0 C-N-CA 130.101 3.36 . . . . 0.0 116.593 -178.709 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.405 ' HB3' ' HG3' ' A' ' 60' ' ' LYS . 4.4 mtp180 -68.65 -29.7 68.24 Favored 'General case' 0 C--N 1.344 0.334 1 C-N-CA 132.051 4.14 . . . . 0.0 116.915 -175.883 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 56.9 tttm -78.72 -10.15 59.66 Favored 'General case' 0 C--N 1.357 0.934 0 C-N-CA 126.625 1.97 . . . . 0.0 113.937 -179.759 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.499 ' HD3' ' CE2' ' A' ' 6' ' ' TYR . 31.6 mttt -98.4 -36.42 9.97 Favored 'General case' 0 C--N 1.359 1.004 0 C-N-CA 127.217 2.207 . . . . 0.0 111.39 175.946 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . 0.454 ' HB2' ' CD2' ' A' ' 25' ' ' PHE . 27.8 m -126.52 15.43 7.64 Favored 'General case' 0 C--N 1.357 0.902 0 N-CA-C 118.147 2.647 . . . . 0.0 118.147 -168.763 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 18.3 mt -140.47 -20.07 0.85 Allowed 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 122.596 2.453 . . . . 0.0 113.631 174.915 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 82.69 56.58 2.75 Favored Glycine 0 C--N 1.363 2.081 0 C-N-CA 126.794 2.14 . . . . 0.0 112.279 -172.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . 0.405 ' HG3' ' HB3' ' A' ' 54' ' ' ARG . 15.9 ptmt . . . . . 0 C--O 1.261 1.697 0 CA-C-O 116.62 -1.657 . . . . 0.0 107.394 -175.294 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 21.0 t90 . . . . . 0 N--CA 1.436 -1.165 0 CA-C-O 122.721 1.248 . . . . 0.0 110.397 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 80.7 mt-30 -140.23 151.99 65.94 Favored Pre-proline 0 C--N 1.357 0.896 1 N-CA-C 99.264 -4.347 . . . . 0.0 99.264 172.482 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . 0.447 ' HA ' ' HD3' ' A' ' 4' ' ' PRO . 4.8 Cg_exo -81.2 117.69 3.2 Favored 'Trans proline' 0 CA--C 1.551 1.341 0 CA-C-N 126.14 3.228 . . . . 0.0 117.047 -164.275 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . 0.447 ' HD3' ' HA ' ' A' ' 3' ' ' PRO . 17.1 Cg_exo -77.56 -117.01 0.01 OUTLIER 'Trans proline' 0 C--N 1.366 1.454 1 C-N-CA 126.003 4.469 . . . . 0.0 114.199 176.931 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' TRP . . . . . 0.483 ' CE2' ' CE1' ' A' ' 6' ' ' TYR . 52.0 p-90 -87.22 -68.01 0.78 Allowed 'General case' 0 C--N 1.374 1.657 0 C-N-CA 126.339 1.856 . . . . 0.0 115.011 -179.565 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.483 ' CE1' ' CE2' ' A' ' 5' ' ' TRP . 0.1 OUTLIER -31.73 -60.53 0.24 Allowed 'General case' 0 C--N 1.359 0.985 1 C-N-CA 134.296 5.038 . . . . 0.0 118.58 -173.818 . . . . . . . . 4 4 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.405 ' O ' ' HB2' ' A' ' 27' ' ' TRP . 3.3 m -52.87 -40.24 63.27 Favored 'General case' 0 CA--C 1.497 -1.07 1 C-N-CA 131.987 4.115 . . . . 0.0 116.34 -176.129 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . 0.273 57.0 tttm -113.87 22.11 14.28 Favored 'General case' 0 N--CA 1.428 -1.569 0 C-N-CA 128.385 2.674 . . . . 0.0 108.166 -174.404 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.431 ' HA ' ' HD3' ' A' ' 10' ' ' PRO . 14.6 tp10 -95.36 138.74 21.85 Favored Pre-proline 0 C--N 1.374 1.64 0 O-C-N 120.325 -1.484 . . . . 0.0 112.148 -174.327 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . 0.431 ' HD3' ' HA ' ' A' ' 9' ' ' GLU . 46.5 Cg_exo -70.05 110.18 2.55 Favored 'Trans proline' 0 C--N 1.363 1.333 0 C-N-CA 124.227 3.285 . . . . 0.0 112.555 -174.518 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 8.6 p -72.95 132.13 33.86 Favored 'Isoleucine or valine' 0 C--N 1.36 1.031 0 C-N-CA 128.057 2.543 . . . . 0.0 110.519 178.303 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . 0.252 41.1 mmt-85 -132.28 136.54 47.01 Favored 'General case' 0 CA--C 1.496 -1.123 0 C-N-CA 126.16 1.784 . . . . 0.0 106.645 -169.87 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.302 16.7 tt -97.67 -41.01 10.51 Favored 'Isoleucine or valine' 0 C--N 1.37 1.473 0 CA-C-N 119.924 1.238 . . . . 0.0 111.494 175.279 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.362 1.982 0 C-N-CA 124.351 0.977 . . . . 0.0 115.303 172.914 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 1.5 tpmt? . . . . . 0 N--CA 1.445 -0.711 0 CA-C-O 121.381 0.61 . . . . 0.0 109.809 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 13.8 mm-40 -147.06 112.43 5.56 Favored 'General case' 0 N--CA 1.441 -0.907 0 C-N-CA 128.767 2.827 . . . . 0.0 105.104 169.357 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 82.9 m-85 -104.63 133.02 50.18 Favored 'General case' 0 C--N 1.354 0.768 0 O-C-N 119.886 -1.759 . . . . 0.0 107.609 174.424 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . 0.455 ' HA ' ' HG ' ' A' ' 36' ' ' LEU . 5.1 t -69.49 125.72 27.58 Favored 'General case' 0 C--N 1.377 1.777 0 CA-C-N 122.179 2.263 . . . . 0.0 115.337 179.831 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 4.5 p -138.49 -169.37 2.58 Favored 'General case' 0 C--N 1.352 0.691 0 C-N-CA 128.043 2.537 . . . . 0.0 111.805 -173.297 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 79.9 m-85 -140.3 153.03 46.32 Favored 'General case' 0 C--N 1.359 0.979 0 C-N-CA 129.569 3.148 . . . . 0.0 112.008 176.042 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . 0.288 4.1 p90 -144.18 163.48 33.48 Favored 'General case' 0 C--N 1.376 1.73 0 C-N-CA 127.038 2.135 . . . . 0.0 109.816 170.683 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 16.0 t80 -99.53 128.32 45.63 Favored 'General case' 0 C--N 1.369 1.418 0 C-N-CA 125.693 1.597 . . . . 0.0 108.918 -179.07 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.503 ' NZ ' ' H ' ' A' ' 28' ' ' THR . 0.0 OUTLIER -91.29 112.17 23.97 Favored 'General case' 0 C--N 1.372 1.569 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 175.25 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' TRP . . . . . 0.456 ' N ' ' HZ2' ' A' ' 26' ' ' LYS . 16.9 t-105 -61.29 -40.67 95.01 Favored 'General case' 0 C--N 1.349 0.552 0 C-N-CA 128.918 2.887 . . . . 0.0 115.057 177.813 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.503 ' H ' ' NZ ' ' A' ' 26' ' ' LYS 0.318 46.4 p -83.24 -25.54 31.59 Favored 'General case' 0 C--N 1.36 1.03 0 C-N-CA 123.626 0.771 . . . . 0.0 112.504 176.402 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.4 ' HB3' ' HB3' ' A' ' 26' ' ' LYS . . . -82.19 -39.76 22.69 Favored 'General case' 0 C--N 1.379 1.864 0 CA-C-N 120.826 1.648 . . . . 0.0 114.036 172.351 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . 0.274 24.3 tptt 84.09 25.77 0.1 Allowed 'General case' 0 C--N 1.365 1.269 0 C-N-CA 129.007 2.923 . . . . 0.0 113.417 178.841 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 23.6 tptp -147.39 170.39 17.46 Favored 'General case' 0 C--N 1.357 0.895 0 C-N-CA 126.035 1.734 . . . . 0.0 106.786 179.822 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 78.8 m -85.61 142.16 29.29 Favored 'General case' 0 C--N 1.355 0.824 0 C-N-CA 127.786 2.434 . . . . 0.0 113.458 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 13.8 mt -127.14 149.71 70.24 Favored Pre-proline 0 C--N 1.356 0.879 0 C-N-CA 125.566 1.547 . . . . 0.0 109.388 178.382 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 65.3 Cg_endo -82.36 154.28 16.26 Favored 'Trans proline' 0 C--N 1.348 0.55 0 C-N-CA 123.928 3.085 . . . . 0.0 111.066 164.07 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 1.4 p90 -152.35 171.76 17.52 Favored 'General case' 0 N--CA 1.448 -0.559 1 N-CA-C 99.659 -4.2 . . . . 0.0 99.659 170.899 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.455 ' HG ' ' HA ' ' A' ' 21' ' ' SER . 7.8 mp -110.65 156.98 20.23 Favored 'General case' 0 N--CA 1.44 -0.942 0 N-CA-C 105.436 -2.061 . . . . 0.0 105.436 174.001 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 3.1 t80 -119.5 130.32 55.15 Favored 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 126.609 1.964 . . . . 0.0 108.332 179.603 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 43.2 m -83.78 -33.22 25.04 Favored 'General case' 0 C--N 1.361 1.097 0 N-CA-C 115.842 1.794 . . . . 0.0 115.842 178.891 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 121.37 -67.13 0.45 Allowed Glycine 0 C--N 1.355 1.601 0 C-N-CA 125.286 1.422 . . . . 0.0 113.682 -176.57 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 18.3 p -93.78 124.23 37.64 Favored 'General case' 0 C--N 1.355 0.833 0 O-C-N 120.652 -1.499 . . . . 0.0 110.106 179.096 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 105.53 -16.11 44.95 Favored Glycine 0 C--N 1.361 1.935 0 O-C-N 121.564 -0.71 . . . . 0.0 112.616 -175.904 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -81.19 165.85 47.48 Favored Glycine 0 C--N 1.364 2.126 0 CA-C-N 118.671 1.236 . . . . 0.0 114.722 173.079 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -155.22 118.52 4.42 Favored 'General case' 0 C--N 1.36 1.058 0 N-CA-C 116.24 1.941 . . . . 0.0 116.24 -178.963 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . 41.77 -34.63 0.0 OUTLIER 'General case' 0 C--N 1.368 1.373 2 N-CA-C 124.213 4.894 . . . . 0.0 124.213 170.828 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 53.7 t30 -93.25 72.13 4.53 Favored 'General case' 0 C--N 1.36 1.047 0 C-N-CA 125.715 1.606 . . . . 0.0 109.87 -175.598 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 5.4 ptp180 -148.3 131.38 16.32 Favored 'General case' 0 CA--C 1.508 -0.671 0 CA-C-O 123.916 1.817 . . . . 0.0 108.734 176.636 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . 0.422 ' CD2' ' HA ' ' A' ' 53' ' ' CYS . 13.9 m-85 -106.34 142.24 36.33 Favored 'General case' 0 C--N 1.349 0.571 0 C-N-CA 126.696 1.998 . . . . 0.0 109.322 -174.02 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.43 -37.4 60.42 Favored 'General case' 0 C--N 1.372 1.572 0 N-CA-C 114.965 1.468 . . . . 0.0 114.965 -178.332 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 72.8 p -123.29 -179.63 4.38 Favored 'General case' 0 C--N 1.361 1.081 0 C-N-CA 127.079 2.151 . . . . 0.0 107.863 175.561 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 18.6 tt -76.77 -16.28 14.78 Favored 'Isoleucine or valine' 0 C--N 1.364 1.206 0 C-N-CA 127.91 2.484 . . . . 0.0 113.594 174.513 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -96.59 -8.28 57.39 Favored Glycine 0 C--N 1.366 2.241 0 O-C-N 120.454 -1.404 . . . . 0.0 115.252 -178.779 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 14.0 tp10 -85.87 -18.8 31.77 Favored 'General case' 0 C--N 1.362 1.147 0 C-N-CA 125.509 1.524 . . . . 0.0 111.603 175.078 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . 0.422 ' HA ' ' CD2' ' A' ' 47' ' ' PHE . 52.9 t -63.51 -61.47 2.31 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 128.312 2.645 . . . . 0.0 114.779 179.99 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 6.7 ptt180 -68.92 -13.41 62.41 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 129.953 3.301 . . . . 0.0 118.632 -177.844 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 17.6 mmtp -68.34 -52.78 29.46 Favored 'General case' 0 C--N 1.366 1.309 0 C-N-CA 126.452 1.901 . . . . 0.0 112.647 176.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.455 ' HD2' ' CD1' ' A' ' 6' ' ' TYR . 32.3 mtmt -68.7 -24.63 64.51 Favored 'General case' 0 C--N 1.356 0.858 0 C-N-CA 130.419 3.488 . . . . 0.0 113.623 176.971 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 90.7 m -128.37 5.39 5.73 Favored 'General case' 0 C--N 1.359 0.981 0 N-CA-C 119.166 3.024 . . . . 0.0 119.166 -170.04 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 13.5 mt -134.99 -15.58 1.99 Allowed 'General case' 0 N--CA 1.473 0.696 0 CA-C-N 123.15 2.704 . . . . 0.0 111.267 172.441 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 75.9 63.65 2.39 Favored Glycine 0 C--N 1.363 2.03 0 C-N-CA 128.252 2.834 . . . . 0.0 112.47 -168.391 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 14.2 ptmt . . . . . 0 C--O 1.262 1.724 0 CA-C-O 115.655 -2.117 . . . . 0.0 107.134 -176.442 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 5.5 t90 . . . . . 0 N--CA 1.433 -1.292 0 N-CA-C 106.014 -1.847 . . . . 0.0 106.014 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 32.4 mt-30 -139.45 148.55 56.87 Favored Pre-proline 0 C--N 1.355 0.825 1 N-CA-C 100.008 -4.071 . . . . 0.0 100.008 172.093 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -74.23 124.23 8.85 Favored 'Trans proline' 0 CA--C 1.555 1.533 0 C-N-CA 123.491 2.794 . . . . 0.0 115.516 -169.562 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . 0.524 ' HG2' ' CD2' ' A' ' 6' ' ' TYR . 43.2 Cg_endo -93.3 -113.4 0.0 OUTLIER 'Trans proline' 0 CA--C 1.549 1.227 1 C-N-CA 126.569 4.846 . . . . 0.0 111.174 -179.446 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' TRP . . . . . 0.47 ' CE3' ' CD1' ' A' ' 6' ' ' TYR 0.272 47.7 p-90 -86.49 -70.62 0.59 Allowed 'General case' 0 C--N 1.383 2.023 0 C-N-CA 126.929 2.091 . . . . 0.0 114.483 178.591 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.524 ' CD2' ' HG2' ' A' ' 4' ' ' PRO . 0.1 OUTLIER -31.72 -55.66 0.28 Allowed 'General case' 0 C--N 1.36 1.061 1 C-N-CA 133.277 4.631 . . . . 0.0 118.887 -173.663 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 3.2 m -59.52 -33.21 71.09 Favored 'General case' 0 CA--C 1.498 -1.038 0 C-N-CA 130.215 3.406 . . . . 0.0 117.638 -173.95 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . 0.303 65.3 tttm -117.14 18.31 14.59 Favored 'General case' 0 N--CA 1.436 -1.152 0 C-N-CA 128.978 2.911 . . . . 0.0 107.958 -176.232 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.402 ' HA ' ' HD3' ' A' ' 10' ' ' PRO . 23.3 tp10 -93.64 131.46 32.24 Favored Pre-proline 0 C--N 1.366 1.291 0 O-C-N 120.398 -1.439 . . . . 0.0 112.919 -173.419 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . 0.402 ' HD3' ' HA ' ' A' ' 9' ' ' GLU . 77.9 Cg_exo -63.63 119.27 6.26 Favored 'Trans proline' 0 C--N 1.362 1.239 0 C-N-CA 124.368 3.379 . . . . 0.0 116.452 -167.348 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 11.1 p -69.11 141.14 17.74 Favored 'Isoleucine or valine' 0 C--N 1.359 0.989 0 C-N-CA 125.308 1.443 . . . . 0.0 114.256 178.815 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.515 ' HB2' HH22 ' A' ' 46' ' ' ARG . 9.5 mmm180 -131.07 -160.56 1.05 Allowed 'General case' 0 N--CA 1.438 -1.045 0 C-N-CA 126.06 1.744 . . . . 0.0 110.969 -174.911 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 11.1 tt -159.07 -35.8 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.427 -1.576 0 C-N-CA 128.283 2.633 . . . . 0.0 109.454 171.663 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.459 ' H ' ' NH2' ' A' ' 12' ' ' ARG . . . . . . . . 0 C--N 1.356 1.682 0 N-CA-C 108.574 -1.811 . . . . 0.0 108.574 -173.054 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 76.0 tttt . . . . . 0 CA--C 1.509 -0.615 0 N-CA-C 108.159 -1.052 . . . . 0.0 108.159 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 10.0 mp0 -100.18 122.7 43.42 Favored 'General case' 0 C--N 1.355 0.809 0 C-N-CA 125.923 1.689 . . . . 0.0 108.218 179.376 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 7.1 m-85 -110.27 134.91 51.79 Favored 'General case' 0 C--N 1.359 0.997 0 N-CA-C 104.62 -2.363 . . . . 0.0 104.62 177.909 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 3.8 t -69.36 141.02 54.29 Favored 'General case' 0 C--N 1.365 1.282 0 CA-C-N 121.809 2.095 . . . . 0.0 116.172 -175.207 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 20.1 p -138.19 -171.15 2.96 Favored 'General case' 0 C--N 1.358 0.976 0 C-N-CA 126.849 2.06 . . . . 0.0 111.108 179.385 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 -139.91 147.06 40.03 Favored 'General case' 0 C--N 1.362 1.109 0 C-N-CA 127.37 2.268 . . . . 0.0 110.709 172.577 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 9.7 p90 -137.85 162.9 32.78 Favored 'General case' 0 C--N 1.373 1.607 0 C-N-CA 126.411 1.884 . . . . 0.0 109.558 172.723 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . 0.407 ' CZ ' ' HG ' ' A' ' 58' ' ' LEU . 11.7 t80 -100.19 127.05 46.53 Favored 'General case' 0 C--N 1.362 1.11 0 O-C-N 120.598 -1.314 . . . . 0.0 107.726 179.694 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.648 ' HD2' HD11 ' A' ' 33' ' ' LEU . 36.4 tttm -86.62 104.93 16.51 Favored 'General case' 0 C--N 1.371 1.528 0 O-C-N 121.335 -0.853 . . . . 0.0 111.102 178.126 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 43.3 t-105 -52.01 -46.49 64.96 Favored 'General case' 0 C--N 1.364 1.197 0 C-N-CA 128.863 2.865 . . . . 0.0 116.811 -176.279 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 2.2 p -88.32 1.25 55.0 Favored 'General case' 0 C--N 1.349 0.57 0 C-N-CA 125.53 1.532 . . . . 0.0 113.578 179.567 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -109.87 -40.27 4.83 Favored 'General case' 0 C--N 1.36 1.057 0 O-C-N 120.95 -1.094 . . . . 0.0 111.54 176.402 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . 0.253 26.9 tptt 86.39 27.16 0.05 OUTLIER 'General case' 0 C--N 1.363 1.187 0 C-N-CA 127.953 2.501 . . . . 0.0 113.54 179.523 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 61.4 tttp -146.48 159.55 43.26 Favored 'General case' 0 C--N 1.356 0.886 0 C-N-CA 125.422 1.489 . . . . 0.0 108.102 -178.321 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 76.5 m -79.72 140.77 36.85 Favored 'General case' 0 C--N 1.364 1.214 0 C-N-CA 127.717 2.407 . . . . 0.0 112.449 177.03 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.648 HD11 ' HD2' ' A' ' 26' ' ' LYS . 19.1 mt -128.32 157.38 74.68 Favored Pre-proline 0 C--N 1.355 0.807 0 C-N-CA 126.209 1.804 . . . . 0.0 109.183 177.274 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -88.11 167.77 6.67 Favored 'Trans proline' 0 N--CA 1.455 -0.745 0 C-N-CA 123.815 3.01 . . . . 0.0 111.412 167.976 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 5.4 p90 -163.32 -176.71 4.91 Favored 'General case' 0 N--CA 1.445 -0.683 0 N-CA-C 102.005 -3.331 . . . . 0.0 102.005 172.61 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -125.21 147.01 49.26 Favored 'General case' 0 N--CA 1.423 -1.808 0 N-CA-C 104.929 -2.249 . . . . 0.0 104.929 173.916 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.404 ' CZ ' ' HA2' ' A' ' 39' ' ' GLY . 36.8 t80 -111.1 137.69 48.45 Favored 'General case' 0 CA--C 1.533 0.302 0 N-CA-C 104.607 -2.368 . . . . 0.0 104.607 173.316 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 77.5 p -104.78 -2.3 25.01 Favored 'General case' 0 C--N 1.365 1.266 0 C-N-CA 125.521 1.528 . . . . 0.0 112.386 -178.665 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . 0.404 ' HA2' ' CZ ' ' A' ' 37' ' ' PHE . . . 94.11 -59.6 2.0 Favored Glycine 0 C--N 1.356 1.643 0 O-C-N 120.029 -1.669 . . . . 0.0 115.252 170.419 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.9 m -73.09 62.27 0.63 Allowed 'General case' 0 C--N 1.354 0.802 0 C-N-CA 127.876 2.471 . . . . 0.0 116.036 -176.432 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 127.77 34.79 0.54 Allowed Glycine 0 C--N 1.357 1.737 0 N-CA-C 119.344 2.497 . . . . 0.0 119.344 168.687 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -94.31 170.98 30.49 Favored Glycine 0 C--N 1.368 2.316 0 CA-C-N 121.793 2.796 . . . . 0.0 111.524 175.937 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . 0.312 27.2 p30 -88.9 -99.17 0.09 Allowed 'General case' 0 C--N 1.365 1.262 0 N-CA-C 117.297 2.332 . . . . 0.0 117.297 -178.087 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -144.78 -9.38 0.62 Allowed 'General case' 0 C--N 1.353 0.719 0 O-C-N 120.461 -1.399 . . . . 0.0 114.175 -171.989 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 61.3 t30 -94.93 77.44 3.59 Favored 'General case' 0 C--N 1.357 0.895 0 O-C-N 119.97 -1.706 . . . . 0.0 114.313 -177.781 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.515 HH22 ' HB2' ' A' ' 12' ' ' ARG 0.406 0.0 OUTLIER -145.17 145.03 31.19 Favored 'General case' 0 C--N 1.357 0.898 0 CA-C-O 124.542 2.115 . . . . 0.0 113.745 169.229 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 12.0 m-85 -111.32 133.68 53.47 Favored 'General case' 0 C--N 1.353 0.744 0 C-N-CA 128.025 2.53 . . . . 0.0 108.249 -177.386 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 4.2 mp0 -74.44 -55.04 6.41 Favored 'General case' 0 C--N 1.371 1.523 0 C-N-CA 126.492 1.917 . . . . 0.0 113.132 -178.095 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 9.8 p -111.69 160.79 16.93 Favored 'General case' 0 C--N 1.354 0.804 0 N-CA-C 104.958 -2.238 . . . . 0.0 104.958 174.939 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 16.4 tt -59.49 -30.13 43.81 Favored 'Isoleucine or valine' 0 C--N 1.361 1.095 0 N-CA-C 117.42 2.378 . . . . 0.0 117.42 -175.026 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -96.22 13.59 65.6 Favored Glycine 0 C--N 1.357 1.73 0 O-C-N 119.926 -1.734 . . . . 0.0 115.293 -179.168 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 16.1 tp10 -89.84 -4.58 57.52 Favored 'General case' 0 C--N 1.364 1.22 0 CA-C-O 122.899 1.333 . . . . 0.0 109.845 171.107 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 18.7 t -79.78 -39.03 31.8 Favored 'General case' 0 C--N 1.359 1.0 1 C-N-CA 132.687 4.395 . . . . 0.0 112.843 179.668 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 55.2 mtp180 -69.01 -47.31 65.8 Favored 'General case' 0 C--N 1.34 0.17 1 C-N-CA 133.925 4.89 . . . . 0.0 117.486 -178.532 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 87.3 tttt -66.94 -30.88 71.14 Favored 'General case' 0 C--N 1.362 1.13 0 C-N-CA 127.827 2.451 . . . . 0.0 113.727 -178.878 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.412 ' HD2' ' CD1' ' A' ' 6' ' ' TYR . 20.3 mtmm -87.88 -36.05 17.39 Favored 'General case' 0 C--N 1.359 1.02 0 C-N-CA 127.876 2.47 . . . . 0.0 112.192 174.636 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 97.6 m -127.04 2.82 6.52 Favored 'General case' 0 C--N 1.369 1.427 0 N-CA-C 120.725 3.602 . . . . 0.0 120.725 -171.725 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.407 ' HG ' ' CZ ' ' A' ' 25' ' ' PHE . 14.7 mt -130.4 -26.28 2.32 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 122.215 2.28 . . . . 0.0 110.756 170.365 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 88.9 52.64 2.73 Favored Glycine 0 C--N 1.361 1.963 0 C-N-CA 128.646 3.022 . . . . 0.0 111.327 -172.278 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 19.3 ptmt . . . . . 0 C--O 1.259 1.59 0 CA-C-N 118.377 1.089 . . . . 0.0 111.033 -172.934 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 84.7 t90 . . . . . 0 N--CA 1.434 -1.229 0 CA-C-O 122.149 0.976 . . . . 0.0 108.681 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 24.2 mm-40 -144.32 148.48 41.1 Favored Pre-proline 0 C--N 1.349 0.584 1 N-CA-C 98.296 -4.705 . . . . 0.0 98.296 170.733 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . 0.426 ' HA ' ' HD3' ' A' ' 4' ' ' PRO . 2.9 Cg_endo -74.47 120.33 6.17 Favored 'Trans proline' 0 CA--C 1.555 1.548 0 CA-C-N 124.701 2.715 . . . . 0.0 116.023 -168.511 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . 0.426 ' HD3' ' HA ' ' A' ' 3' ' ' PRO . 24.1 Cg_exo -77.41 -120.22 0.01 OUTLIER 'Trans proline' 0 C--N 1.369 1.657 1 C-N-CA 126.968 5.112 . . . . 0.0 113.587 175.639 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' TRP . . . . . 0.482 ' CE3' ' CD1' ' A' ' 6' ' ' TYR . 0.4 OUTLIER -86.66 -68.16 0.76 Allowed 'General case' 0 C--N 1.379 1.885 0 C-N-CA 126.955 2.102 . . . . 0.0 113.432 177.557 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.482 ' CD1' ' CE3' ' A' ' 5' ' ' TRP . 0.1 OUTLIER -31.13 -51.46 0.17 Allowed 'General case' 0 C--N 1.363 1.191 1 C-N-CA 133.97 4.908 . . . . 0.0 117.591 -172.844 . . . . . . . . 4 4 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.41 ' O ' ' HB2' ' A' ' 27' ' ' TRP . 2.9 m -57.87 -43.49 86.04 Favored 'General case' 0 CA--C 1.511 -0.519 0 C-N-CA 129.925 3.29 . . . . 0.0 116.007 -175.708 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 26.7 mtpp -103.8 17.38 24.23 Favored 'General case' 0 C--N 1.357 0.904 0 C-N-CA 127.231 2.212 . . . . 0.0 109.908 177.261 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.462 ' HA ' ' HD3' ' A' ' 10' ' ' PRO . 29.7 tp10 -90.22 127.06 54.76 Favored Pre-proline 0 C--N 1.361 1.072 0 O-C-N 120.468 -1.395 . . . . 0.0 112.234 -170.893 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . 0.462 ' HD3' ' HA ' ' A' ' 9' ' ' GLU . 50.0 Cg_exo -67.88 122.51 9.64 Favored 'Trans proline' 0 C--N 1.364 1.371 0 C-N-CA 124.08 3.186 . . . . 0.0 114.43 -165.977 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 7.8 p -69.78 134.06 30.78 Favored 'Isoleucine or valine' 0 C--N 1.357 0.918 0 C-N-CA 126.692 1.997 . . . . 0.0 112.674 -179.767 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 46.8 mtt180 -135.05 125.18 25.99 Favored 'General case' 0 C--N 1.359 0.981 0 CA-C-O 117.134 -1.412 . . . . 0.0 109.109 -175.486 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.267 17.3 tt -96.2 -38.73 8.63 Favored 'Isoleucine or valine' 0 C--N 1.37 1.486 0 CA-C-N 120.16 1.345 . . . . 0.0 112.106 175.398 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.357 1.7 0 C-N-CA 125.805 1.669 . . . . 0.0 113.846 177.348 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 16.6 tppt? . . . . . 0 N--CA 1.439 -1.024 0 N-CA-C 104.192 -2.521 . . . . 0.0 104.192 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 6.5 mp0 -147.94 118.83 7.61 Favored 'General case' 0 N--CA 1.433 -1.303 0 N-CA-C 105.054 -2.202 . . . . 0.0 105.054 171.843 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 73.5 m-85 -103.4 145.07 30.54 Favored 'General case' 0 C--N 1.353 0.723 0 N-CA-C 105.718 -1.956 . . . . 0.0 105.718 171.04 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 3.7 t -72.75 142.65 48.13 Favored 'General case' 0 C--N 1.371 1.534 0 CA-C-N 122.063 2.211 . . . . 0.0 115.146 -177.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 80.6 p -146.82 -169.38 3.28 Favored 'General case' 0 C--N 1.361 1.089 0 C-N-CA 125.553 1.541 . . . . 0.0 113.606 -175.948 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 62.0 m-85 -145.63 149.28 34.22 Favored 'General case' 0 C--N 1.361 1.095 0 C-N-CA 130.384 3.474 . . . . 0.0 110.777 175.929 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 9.4 p90 -143.49 154.46 43.67 Favored 'General case' 0 C--N 1.365 1.271 0 C-N-CA 127.44 2.296 . . . . 0.0 109.691 174.456 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 11.5 t80 -94.49 121.87 36.48 Favored 'General case' 0 C--N 1.371 1.523 0 N-CA-C 106.269 -1.752 . . . . 0.0 106.269 177.404 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.11 102.56 14.37 Favored 'General case' 0 N--CA 1.431 -1.383 0 CA-C-O 122.032 0.92 . . . . 0.0 110.282 178.709 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' TRP . . . . . 0.41 ' HB2' ' O ' ' A' ' 7' ' ' CYS . 14.9 t-105 -48.11 -46.36 33.99 Favored 'General case' 0 C--N 1.355 0.824 0 C-N-CA 130.26 3.424 . . . . 0.0 118.266 -174.93 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 3.0 p -79.08 -18.6 53.08 Favored 'General case' 0 C--N 1.358 0.941 0 C-N-CA 125.675 1.59 . . . . 0.0 112.98 179.191 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -87.54 -40.81 13.95 Favored 'General case' 0 C--N 1.366 1.324 0 C-N-CA 124.401 1.08 . . . . 0.0 111.18 172.936 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . 0.297 0.0 OUTLIER 77.45 30.2 0.51 Allowed 'General case' 0 C--N 1.363 1.179 0 C-N-CA 128.94 2.896 . . . . 0.0 113.41 179.349 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 53.2 tptt -148.35 167.39 25.34 Favored 'General case' 0 C--N 1.358 0.971 0 C-N-CA 127.247 2.219 . . . . 0.0 107.204 176.899 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 92.7 m -78.67 138.26 38.21 Favored 'General case' 0 C--N 1.357 0.93 0 C-N-CA 128.481 2.713 . . . . 0.0 114.822 178.971 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 12.0 mt -122.95 148.44 54.06 Favored Pre-proline 0 C--N 1.359 1.013 0 C-N-CA 125.846 1.659 . . . . 0.0 109.328 176.19 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 63.3 Cg_endo -82.8 159.5 16.2 Favored 'Trans proline' 0 CA--C 1.535 0.527 0 C-N-CA 123.115 2.543 . . . . 0.0 111.689 167.311 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . 0.317 2.0 p90 -150.97 -160.27 1.15 Allowed 'General case' 0 C--N 1.347 0.468 0 N-CA-C 104.888 -2.264 . . . . 0.0 104.888 169.796 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 18.8 mt -140.87 153.11 45.58 Favored 'General case' 0 N--CA 1.436 -1.128 0 N-CA-C 101.83 -3.396 . . . . 0.0 101.83 175.472 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -121.95 130.59 53.45 Favored 'General case' 0 N--CA 1.469 0.484 0 N-CA-C 105.071 -2.196 . . . . 0.0 105.071 178.035 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 89.3 p -77.84 -82.54 0.09 Allowed 'General case' 0 C--N 1.37 1.48 0 O-C-N 121.13 -0.981 . . . . 0.0 112.2 179.733 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 176.7 -59.6 0.1 Allowed Glycine 0 CA--C 1.488 -1.597 0 N-CA-C 108.99 -1.644 . . . . 0.0 108.99 173.565 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 20.2 p -83.73 79.42 9.47 Favored 'General case' 0 C--N 1.359 1.018 0 C-N-CA 126.692 1.997 . . . . 0.0 112.963 179.694 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 144.4 19.36 0.19 Allowed Glycine 0 C--N 1.352 1.425 0 N-CA-C 116.933 1.533 . . . . 0.0 116.933 174.557 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -71.14 176.07 38.06 Favored Glycine 0 C--N 1.366 2.204 0 N-CA-C 119.711 2.645 . . . . 0.0 119.711 175.692 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . 0.445 ' H ' ' CZ ' ' A' ' 46' ' ' ARG . 36.0 t-20 -136.76 -156.68 0.72 Allowed 'General case' 0 C--N 1.353 0.726 0 C-N-CA 125.392 1.477 . . . . 0.0 109.114 -174.596 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -99.44 -15.87 18.57 Favored 'General case' 0 C--N 1.354 0.784 0 O-C-N 120.256 -1.527 . . . . 0.0 114.261 -176.869 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 63.0 t30 -94.5 73.83 3.79 Favored 'General case' 0 C--N 1.363 1.165 0 O-C-N 119.653 -1.904 . . . . 0.0 110.396 -178.555 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.445 ' CZ ' ' H ' ' A' ' 43' ' ' ASN 0.303 0.0 OUTLIER -137.21 127.59 26.54 Favored 'General case' 0 C--N 1.352 0.704 0 CA-C-O 124.135 1.921 . . . . 0.0 109.759 172.02 . . . . . . . . 4 4 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 23.4 m-85 -108.06 142.99 37.4 Favored 'General case' 0 C--N 1.353 0.748 0 C-N-CA 127.364 2.266 . . . . 0.0 109.011 -175.248 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 32.5 mt-30 -66.12 -68.63 0.35 Allowed 'General case' 0 C--N 1.365 1.255 0 C-N-CA 128.57 2.748 . . . . 0.0 113.49 -178.544 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 40.9 p -119.12 170.65 8.88 Favored 'General case' 0 C--N 1.354 0.793 0 C-N-CA 124.955 1.302 . . . . 0.0 108.788 176.901 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 16.0 tt -58.72 -26.78 32.72 Favored 'Isoleucine or valine' 0 C--N 1.361 1.105 0 C-N-CA 128.46 2.704 . . . . 0.0 116.297 178.664 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -86.04 -16.9 62.15 Favored Glycine 0 C--N 1.36 1.88 0 O-C-N 120.282 -1.511 . . . . 0.0 116.088 175.35 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 15.2 tp10 -82.9 -25.58 32.33 Favored 'General case' 0 C--N 1.371 1.52 0 CA-C-N 120.358 2.079 . . . . 0.0 111.349 176.313 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 9.6 t -59.84 -44.6 93.99 Favored 'General case' 0 CA--C 1.559 1.293 0 C-N-CA 127.526 2.33 . . . . 0.0 115.955 177.524 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 5.4 ptt180 -82.24 -18.66 41.72 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 126.509 1.923 . . . . 0.0 113.645 178.087 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 36.1 ttmt -75.46 -16.42 60.32 Favored 'General case' 0 C--N 1.361 1.091 0 C-N-CA 126.797 2.039 . . . . 0.0 114.656 178.552 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.426 ' HD2' ' CD1' ' A' ' 6' ' ' TYR . 5.4 ttmt -103.98 -24.33 13.25 Favored 'General case' 0 C--N 1.361 1.098 0 C-N-CA 126.208 1.803 . . . . 0.0 110.82 175.985 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . 0.444 ' SG ' ' HB2' ' A' ' 6' ' ' TYR . 34.4 m -127.21 10.38 6.85 Favored 'General case' 0 C--N 1.364 1.21 0 N-CA-C 118.031 2.604 . . . . 0.0 118.031 -169.14 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 12.1 mt -139.34 -18.67 0.98 Allowed 'General case' 0 C--N 1.35 0.614 0 CA-C-N 121.838 2.108 . . . . 0.0 112.87 172.256 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 82.05 51.53 4.42 Favored Glycine 0 C--N 1.362 1.988 0 C-N-CA 127.589 2.518 . . . . 0.0 111.673 -171.275 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 12.8 mtpt . . . . . 0 C--O 1.262 1.743 0 C-N-CA 124.76 1.224 . . . . 0.0 108.232 -177.024 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 1' ' ' TRP . . . . . 0.5 ' CZ2' ' HB3' ' A' ' 3' ' ' PRO . 83.0 t90 . . . . . 0 N--CA 1.432 -1.338 0 N-CA-C 107.386 -1.339 . . . . 0.0 107.386 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -144.76 148.22 38.6 Favored Pre-proline 0 C--N 1.353 0.728 1 N-CA-C 96.865 -5.235 . . . . 0.0 96.865 172.185 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . 0.5 ' HB3' ' CZ2' ' A' ' 1' ' ' TRP . 90.3 Cg_endo -81.08 123.23 4.47 Favored 'Trans proline' 0 CA--C 1.555 1.553 0 CA-C-N 125.702 3.072 . . . . 0.0 115.259 -165.815 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . 0.46 ' HD3' ' HA ' ' A' ' 3' ' ' PRO . 43.1 Cg_exo -74.52 -115.48 0.01 OUTLIER 'Trans proline' 0 CA--C 1.55 1.301 1 C-N-CA 126.751 4.967 . . . . 0.0 113.828 174.527 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' TRP . . . . . 0.488 ' CE3' ' CD2' ' A' ' 6' ' ' TYR . 21.7 p-90 -87.75 -72.3 0.53 Allowed 'General case' 0 C--N 1.376 1.729 0 C-N-CA 126.71 2.004 . . . . 0.0 115.01 179.882 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.488 ' CD2' ' CE3' ' A' ' 5' ' ' TRP . 0.0 OUTLIER -31.26 -53.99 0.23 Allowed 'General case' 0 C--N 1.356 0.877 1 C-N-CA 133.868 4.867 . . . . 0.0 118.065 -173.378 . . . . . . . . 4 4 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.405 ' O ' ' HB2' ' A' ' 27' ' ' TRP . 1.9 m -54.96 -33.49 62.4 Favored 'General case' 0 CA--C 1.502 -0.901 0 C-N-CA 131.444 3.897 . . . . 0.0 116.488 -176.501 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 11.7 mtpp -113.96 13.73 18.32 Favored 'General case' 0 N--CA 1.439 -0.987 0 C-N-CA 129.978 3.311 . . . . 0.0 109.891 -177.857 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.45 ' HA ' ' HD3' ' A' ' 10' ' ' PRO . 34.7 tp10 -90.67 142.37 27.81 Favored Pre-proline 0 C--N 1.364 1.209 0 O-C-N 120.74 -1.225 . . . . 0.0 114.289 -170.29 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . 0.45 ' HD3' ' HA ' ' A' ' 9' ' ' GLU . 51.7 Cg_exo -68.0 117.7 5.09 Favored 'Trans proline' 0 C--N 1.367 1.531 0 C-N-CA 124.682 3.588 . . . . 0.0 115.324 -173.891 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 14.5 p -69.72 128.02 32.48 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.938 0 C-N-CA 128.387 2.675 . . . . 0.0 111.885 176.138 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.433 ' HB2' HH22 ' A' ' 46' ' ' ARG . 2.2 mmp_? -142.36 122.58 13.84 Favored 'General case' 0 C--N 1.366 1.313 0 C-N-CA 125.65 1.58 . . . . 0.0 113.546 -170.708 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 12.9 tt -86.78 -42.22 15.35 Favored 'Isoleucine or valine' 0 C--N 1.376 1.757 0 C-N-CA 127.873 2.469 . . . . 0.0 115.931 -179.692 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.362 2.003 0 O-C-N 121.279 -0.888 . . . . 0.0 114.161 -173.451 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.606 ' HG3' ' H ' ' A' ' 19' ' ' GLN . 14.8 tptp . . . . . 0 CA--C 1.504 -0.811 0 N-CA-C 104.37 -2.456 . . . . 0.0 104.37 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . 0.606 ' H ' ' HG3' ' A' ' 18' ' ' LYS . 9.6 mm-40 -131.93 110.02 10.49 Favored 'General case' 0 N--CA 1.432 -1.328 0 N-CA-C 101.183 -3.636 . . . . 0.0 101.183 171.254 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 30.7 m-85 -106.83 138.45 42.98 Favored 'General case' 0 C--N 1.354 0.788 0 C-N-CA 125.794 1.638 . . . . 0.0 108.099 178.234 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . 0.452 ' HA ' ' HG ' ' A' ' 36' ' ' LEU . 3.9 t -65.71 120.96 13.92 Favored 'General case' 0 C--N 1.371 1.513 0 N-CA-C 117.554 2.427 . . . . 0.0 117.554 -175.053 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -116.53 -168.24 1.42 Allowed 'General case' 0 C--N 1.37 1.487 0 C-N-CA 128.541 2.736 . . . . 0.0 111.232 177.171 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 23.6 m-85 -150.34 150.41 31.41 Favored 'General case' 0 C--N 1.355 0.835 0 C-N-CA 129.494 3.118 . . . . 0.0 108.191 174.258 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 8.9 p90 -145.14 166.14 26.28 Favored 'General case' 0 C--N 1.356 0.889 0 C-N-CA 126.325 1.85 . . . . 0.0 109.684 171.998 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . 0.44 ' CD2' ' HB2' ' A' ' 57' ' ' CYS . 19.0 t80 -98.02 125.72 43.11 Favored 'General case' 0 C--N 1.36 1.045 0 O-C-N 120.026 -1.671 . . . . 0.0 108.814 176.655 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 26.7 ttpt -85.05 103.15 13.81 Favored 'General case' 0 C--N 1.379 1.862 0 O-C-N 120.152 -1.593 . . . . 0.0 108.57 173.92 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' TRP . . . . . 0.405 ' HB2' ' O ' ' A' ' 7' ' ' CYS . 26.1 t-105 -46.07 -43.52 14.67 Favored 'General case' 0 C--N 1.358 0.951 0 C-N-CA 129.904 3.282 . . . . 0.0 117.528 -176.917 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 4.0 p -82.36 -29.83 30.71 Favored 'General case' 0 C--N 1.35 0.59 0 C-N-CA 127.787 2.435 . . . . 0.0 113.885 179.727 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -82.63 -23.69 34.18 Favored 'General case' 0 C--N 1.37 1.494 0 CA-C-N 120.935 1.698 . . . . 0.0 113.853 176.608 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . 0.261 30.5 mmmt 73.23 23.01 2.7 Favored 'General case' 0 C--N 1.367 1.328 0 C-N-CA 126.929 2.092 . . . . 0.0 112.246 -176.842 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.519 ' NZ ' HH12 ' A' ' 54' ' ' ARG . 6.8 mmtm -146.21 164.6 31.77 Favored 'General case' 0 C--N 1.365 1.246 0 C-N-CA 125.655 1.582 . . . . 0.0 112.684 -177.06 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 68.5 m -89.9 141.28 28.8 Favored 'General case' 0 C--N 1.359 1.005 0 C-N-CA 127.501 2.32 . . . . 0.0 116.321 -173.863 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 39.3 mt -127.44 145.59 55.14 Favored Pre-proline 0 C--N 1.363 1.183 0 C-N-CA 125.034 1.334 . . . . 0.0 110.741 -179.083 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 62.2 Cg_endo -84.54 143.17 9.66 Favored 'Trans proline' 0 CA--C 1.536 0.606 0 C-N-CA 123.474 2.783 . . . . 0.0 111.07 167.138 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 1.6 p90 -142.35 159.83 41.45 Favored 'General case' 0 C--N 1.349 0.569 0 N-CA-C 101.098 -3.667 . . . . 0.0 101.098 170.964 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.452 ' HG ' ' HA ' ' A' ' 21' ' ' SER . 6.9 mp -104.82 158.5 16.48 Favored 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 125.655 1.582 . . . . 0.0 107.75 178.39 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 9.0 t80 -125.55 144.2 50.67 Favored 'General case' 0 CA--C 1.557 1.228 0 C-N-CA 127.55 2.34 . . . . 0.0 110.088 179.749 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.9 t -84.86 -19.64 32.06 Favored 'General case' 0 C--N 1.376 1.724 0 N-CA-C 117.834 2.531 . . . . 0.0 117.834 -179.722 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 119.3 -30.71 5.7 Favored Glycine 0 C--N 1.361 1.966 0 C-N-CA 126.265 1.888 . . . . 0.0 116.333 172.871 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -137.23 142.85 42.05 Favored 'General case' 0 C--N 1.345 0.405 0 N-CA-C 104.756 -2.313 . . . . 0.0 104.756 173.418 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 100.8 10.53 43.05 Favored Glycine 0 C--N 1.365 2.178 0 O-C-N 121.085 -1.01 . . . . 0.0 115.429 -174.341 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -105.82 -171.33 23.51 Favored Glycine 0 C--N 1.358 1.77 0 C-N-CA 124.888 1.232 . . . . 0.0 114.446 177.012 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . 0.489 ' H ' ' CZ ' ' A' ' 46' ' ' ARG 0.311 31.8 p30 -124.3 -106.53 0.34 Allowed 'General case' 0 C--N 1.363 1.168 0 N-CA-C 116.265 1.95 . . . . 0.0 116.265 178.782 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -152.92 6.79 0.39 Allowed 'General case' 0 C--N 1.352 0.711 0 O-C-N 121.256 -0.903 . . . . 0.0 112.686 -172.042 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 55.8 t30 -104.17 46.43 0.92 Allowed 'General case' 0 C--N 1.365 1.28 0 O-C-N 120.574 -1.328 . . . . 0.0 109.406 176.264 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.489 ' CZ ' ' H ' ' A' ' 43' ' ' ASN 0.365 0.0 OUTLIER -132.1 106.93 8.3 Favored 'General case' 0 C--N 1.358 0.971 0 CA-C-O 124.468 2.08 . . . . 0.0 107.508 -179.368 . . . . . . . . 4 4 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 13.0 m-30 -93.02 149.62 21.09 Favored 'General case' 0 C--N 1.346 0.427 0 C-N-CA 128.54 2.736 . . . . 0.0 111.762 -165.573 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 35.8 mt-30 -74.73 -41.55 59.93 Favored 'General case' 0 C--N 1.37 1.495 0 N-CA-C 116.746 2.128 . . . . 0.0 116.746 -172.289 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 48.9 p -136.84 179.02 6.63 Favored 'General case' 0 C--N 1.356 0.849 0 C-N-CA 128.584 2.754 . . . . 0.0 105.54 178.55 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 18.1 tt -75.56 -17.65 15.74 Favored 'Isoleucine or valine' 0 C--N 1.37 1.463 0 O-C-N 120.42 -1.425 . . . . 0.0 113.452 175.596 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -77.25 -18.18 78.56 Favored Glycine 0 C--N 1.366 2.225 0 C-N-CA 125.704 1.621 . . . . 0.0 116.166 175.781 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -83.27 -2.17 54.98 Favored 'General case' 0 C--N 1.365 1.28 0 C-N-CA 126.371 1.868 . . . . 0.0 112.109 177.388 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 4.7 t -94.94 -24.34 17.01 Favored 'General case' 0 C--N 1.356 0.88 0 C-N-CA 128.715 2.806 . . . . 0.0 114.449 179.87 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.519 HH12 ' NZ ' ' A' ' 31' ' ' LYS . 0.0 OUTLIER -84.78 -37.91 20.24 Favored 'General case' 0 C--O 1.237 0.419 1 C-N-CA 132.393 4.277 . . . . 0.0 109.398 179.034 . . . . . . . . 4 4 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 28.0 ttmt -71.71 -28.03 63.42 Favored 'General case' 0 C--N 1.351 0.654 0 C-N-CA 129.303 3.041 . . . . 0.0 113.871 -178.285 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 27.2 mtmt -101.08 -39.18 7.82 Favored 'General case' 0 C--N 1.358 0.941 0 C-N-CA 125.094 1.358 . . . . 0.0 112.592 178.098 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . 0.44 ' HB2' ' CD2' ' A' ' 25' ' ' PHE . 99.2 m -126.49 17.22 7.59 Favored 'General case' 0 C--N 1.358 0.951 0 N-CA-C 116.98 2.215 . . . . 0.0 116.98 -170.13 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 22.5 mt -137.15 -23.05 1.15 Allowed 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 122.518 2.417 . . . . 0.0 112.682 168.666 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 86.78 48.74 4.34 Favored Glycine 0 C--N 1.367 2.268 0 C-N-CA 127.134 2.302 . . . . 0.0 111.524 -175.655 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 13.9 ptmt . . . . . 0 C--O 1.261 1.666 0 CA-C-O 118.572 -0.727 . . . . 0.0 110.544 -173.26 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 11.9 t90 . . . . . 0 N--CA 1.434 -1.239 0 CA-C-O 122.748 1.261 . . . . 0.0 109.294 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -135.75 148.91 67.32 Favored Pre-proline 0 C--N 1.351 0.659 1 N-CA-C 100.148 -4.019 . . . . 0.0 100.148 172.737 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . 0.433 ' HA ' ' HD3' ' A' ' 4' ' ' PRO . 1.4 Cg_endo -77.35 125.38 7.7 Favored 'Trans proline' 0 CA--C 1.554 1.495 0 CA-C-N 124.807 2.753 . . . . 0.0 115.222 -169.026 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . 0.521 ' HG2' ' CD2' ' A' ' 6' ' ' TYR . 38.3 Cg_endo -96.29 -116.09 0.0 OUTLIER 'Trans proline' 0 CA--C 1.549 1.239 1 C-N-CA 126.549 4.833 . . . . 0.0 110.855 -176.473 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' TRP . . . . . 0.471 ' CE3' ' CD1' ' A' ' 6' ' ' TYR 0.274 35.5 p-90 -85.67 -67.59 0.79 Allowed 'General case' 0 C--N 1.38 1.908 0 C-N-CA 126.496 1.918 . . . . 0.0 115.093 178.395 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.521 ' CD2' ' HG2' ' A' ' 4' ' ' PRO . 0.1 OUTLIER -32.71 -53.06 0.33 Allowed 'General case' 0 N--CA 1.48 1.071 1 C-N-CA 132.277 4.231 . . . . 0.0 119.162 -172.353 . . . . . . . . 4 4 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.7 m -60.51 -38.16 83.46 Favored 'General case' 0 N--CA 1.449 -0.514 0 C-N-CA 128.733 2.813 . . . . 0.0 113.277 -179.488 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 39.8 mtpt -104.16 14.01 31.26 Favored 'General case' 0 C--N 1.363 1.17 0 C-N-CA 129.08 2.952 . . . . 0.0 110.579 -177.71 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.425 ' HA ' ' HD3' ' A' ' 10' ' ' PRO . 3.4 tp10 -96.67 127.79 38.28 Favored Pre-proline 0 C--N 1.364 1.217 0 O-C-N 119.853 -1.779 . . . . 0.0 112.015 -172.273 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . 0.425 ' HD3' ' HA ' ' A' ' 9' ' ' GLU . 52.4 Cg_exo -68.16 120.85 7.81 Favored 'Trans proline' 0 C--N 1.358 1.056 0 C-N-CA 124.167 3.245 . . . . 0.0 115.093 -165.881 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 8.1 p -67.85 133.85 31.03 Favored 'Isoleucine or valine' 0 C--N 1.36 1.057 0 C-N-CA 126.568 1.947 . . . . 0.0 113.934 -179.585 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . 0.287 16.5 mmt-85 -134.49 117.9 16.74 Favored 'General case' 0 C--N 1.36 1.04 0 C-N-CA 126.611 1.964 . . . . 0.0 108.494 -171.772 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 21.1 tt -93.18 -40.25 11.74 Favored 'Isoleucine or valine' 0 C--N 1.369 1.443 0 CA-C-N 120.399 1.454 . . . . 0.0 109.453 173.387 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.36 1.895 0 C-N-CA 124.67 1.129 . . . . 0.0 114.533 175.942 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . 0.264 0.0 OUTLIER . . . . . 0 N--CA 1.451 -0.409 0 N-CA-C 104.472 -2.418 . . . . 0.0 104.472 . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -150.11 123.48 9.0 Favored 'General case' 0 C--N 1.351 0.665 0 N-CA-C 103.643 -2.725 . . . . 0.0 103.643 175.314 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 19.6 m-85 -105.84 158.08 17.01 Favored 'General case' 0 C--N 1.36 1.024 0 C-N-CA 126.46 1.904 . . . . 0.0 106.14 177.662 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 2.6 t -82.31 144.59 30.49 Favored 'General case' 0 C--N 1.367 1.331 0 CA-C-N 122.111 2.232 . . . . 0.0 115.964 -176.247 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 61.1 p -146.77 -170.91 3.64 Favored 'General case' 0 C--N 1.364 1.197 0 C-N-CA 127.767 2.427 . . . . 0.0 112.671 -177.471 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 45.1 m-85 -141.05 152.76 45.1 Favored 'General case' 0 C--N 1.358 0.958 0 C-N-CA 129.984 3.313 . . . . 0.0 109.921 171.384 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . 0.303 2.9 p90 -144.68 158.97 43.56 Favored 'General case' 0 C--N 1.365 1.275 0 C-N-CA 126.999 2.12 . . . . 0.0 110.035 172.832 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 12.6 t80 -104.17 130.31 51.93 Favored 'General case' 0 C--N 1.365 1.263 0 N-CA-C 106.931 -1.507 . . . . 0.0 106.931 179.018 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.534 ' NZ ' ' H ' ' A' ' 28' ' ' THR . 0.0 OUTLIER -96.27 112.57 24.27 Favored 'General case' 0 N--CA 1.446 -0.671 0 C-N-CA 125.099 1.36 . . . . 0.0 110.047 179.222 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' TRP . . . . . 0.418 ' N ' ' HZ2' ' A' ' 26' ' ' LYS . 38.2 t-105 -50.47 -48.57 56.62 Favored 'General case' 0 C--N 1.355 0.819 0 C-N-CA 129.553 3.141 . . . . 0.0 116.494 175.007 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.534 ' H ' ' NZ ' ' A' ' 26' ' ' LYS 0.294 39.7 p -82.3 -25.7 33.73 Favored 'General case' 0 C--N 1.36 1.052 0 C-N-CA 124.471 1.109 . . . . 0.0 112.792 178.362 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -78.1 -38.9 43.01 Favored 'General case' 0 C--N 1.378 1.813 0 CA-C-N 120.779 1.627 . . . . 0.0 114.072 172.799 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . 0.301 52.5 mmtt 78.45 21.36 0.8 Allowed 'General case' 0 C--N 1.369 1.418 0 C-N-CA 128.107 2.563 . . . . 0.0 113.547 179.742 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 63.1 tttt -147.6 168.41 22.07 Favored 'General case' 0 C--N 1.355 0.835 0 C-N-CA 126.578 1.951 . . . . 0.0 106.509 -179.931 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 79.1 m -81.21 146.05 30.67 Favored 'General case' 0 C--N 1.358 0.942 0 C-N-CA 126.961 2.104 . . . . 0.0 115.745 179.894 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 12.8 mt -122.83 142.97 39.15 Favored Pre-proline 0 C--N 1.358 0.941 0 C-N-CA 125.75 1.62 . . . . 0.0 109.828 177.086 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 63.7 Cg_endo -85.6 147.32 9.68 Favored 'Trans proline' 0 C--N 1.35 0.645 0 C-N-CA 124.403 3.402 . . . . 0.0 111.077 169.181 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . 0.386 3.4 p90 -145.42 -157.73 0.82 Allowed 'General case' 0 C--N 1.352 0.695 0 CA-C-N 114.95 -1.023 . . . . 0.0 109.41 174.749 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 40.2 mt -140.31 153.85 46.6 Favored 'General case' 0 N--CA 1.436 -1.134 0 C-N-CA 128.31 2.644 . . . . 0.0 104.153 -178.598 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -137.98 127.17 24.42 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 127.817 2.447 . . . . 0.0 108.465 -178.169 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 96.7 p -83.71 4.51 28.42 Favored 'General case' 0 C--N 1.368 1.371 0 N-CA-C 119.714 3.227 . . . . 0.0 119.714 -176.247 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 88.2 -31.25 4.83 Favored Glycine 0 C--N 1.355 1.615 0 C-N-CA 129.252 3.31 . . . . 0.0 120.103 172.58 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -136.22 31.78 2.9 Favored 'General case' 0 CA--C 1.509 -0.597 0 O-C-N 121.441 -1.035 . . . . 0.0 109.931 -175.681 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -150.36 36.91 0.93 Allowed Glycine 0 C--N 1.355 1.599 0 N-CA-C 110.457 -1.057 . . . . 0.0 110.457 176.186 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -101.3 -177.42 28.84 Favored Glycine 0 C--N 1.357 1.739 0 C-N-CA 125.455 1.502 . . . . 0.0 113.99 174.72 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . 0.5 ' H ' ' NH1' ' A' ' 46' ' ' ARG 0.381 42.0 p30 -125.01 -96.0 0.45 Allowed 'General case' 0 C--N 1.356 0.891 0 O-C-N 120.945 -1.327 . . . . 0.0 111.225 174.322 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -145.3 -16.56 0.49 Allowed 'General case' 0 C--N 1.348 0.541 0 C-N-CA 125.205 1.402 . . . . 0.0 112.274 -174.984 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 50.6 t30 -94.11 74.1 4.05 Favored 'General case' 0 C--N 1.363 1.168 0 O-C-N 120.165 -1.584 . . . . 0.0 111.738 -177.939 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.5 ' NH1' ' H ' ' A' ' 43' ' ' ASN 0.295 0.0 OUTLIER -137.27 130.55 31.03 Favored 'General case' 0 C--N 1.352 0.674 0 CA-C-O 124.271 1.986 . . . . 0.0 108.868 173.638 . . . . . . . . 4 4 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . 0.441 ' CD2' ' HA ' ' A' ' 53' ' ' CYS . 21.7 m-85 -111.31 141.94 44.18 Favored 'General case' 0 CA--C 1.507 -0.685 0 C-N-CA 127.914 2.486 . . . . 0.0 108.598 -174.763 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 31.0 mt-30 -67.35 -64.63 0.82 Allowed 'General case' 0 C--N 1.363 1.167 0 C-N-CA 127.097 2.159 . . . . 0.0 114.609 -175.572 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 31.4 p -121.47 171.9 8.46 Favored 'General case' 0 C--N 1.353 0.743 0 C-N-CA 126.492 1.917 . . . . 0.0 107.499 177.791 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 17.7 tt -59.36 -25.71 31.73 Favored 'Isoleucine or valine' 0 C--N 1.363 1.174 0 C-N-CA 127.802 2.441 . . . . 0.0 117.227 178.78 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -88.48 -17.32 57.25 Favored Glycine 0 C--N 1.353 1.503 0 N-CA-C 116.669 1.427 . . . . 0.0 116.669 174.301 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 15.8 tp10 -70.05 -34.62 73.45 Favored 'General case' 0 C--N 1.378 1.835 0 CA-C-N 120.015 1.908 . . . . 0.0 112.016 174.547 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . 0.441 ' HA ' ' CD2' ' A' ' 47' ' ' PHE . 48.7 t -47.92 -44.17 29.67 Favored 'General case' 0 C--N 1.361 1.108 0 C-N-CA 128.575 2.75 . . . . 0.0 116.024 175.444 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 8.4 mtp85 -74.34 -26.67 60.29 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 130.964 3.705 . . . . 0.0 117.385 -179.174 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 12.5 mttp -80.34 -11.72 59.67 Favored 'General case' 0 C--N 1.364 1.225 0 C-N-CA 125.572 1.549 . . . . 0.0 114.815 -179.634 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 9.9 mtmm -103.52 -28.69 11.6 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 126.664 1.986 . . . . 0.0 109.38 175.001 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 53.6 m -125.86 6.68 7.36 Favored 'General case' 0 C--N 1.365 1.265 0 N-CA-C 119.551 3.167 . . . . 0.0 119.551 -170.502 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 16.3 mt -134.54 -15.39 2.14 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 123.435 2.834 . . . . 0.0 113.334 174.826 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 77.49 57.47 3.59 Favored Glycine 0 C--N 1.361 1.931 0 C-N-CA 128.238 2.828 . . . . 0.0 113.02 -171.443 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 16.0 ptpt . . . . . 0 C--O 1.259 1.604 0 N-CA-C 107.889 -1.152 . . . . 0.0 107.889 -176.197 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 1' ' ' TRP . . . . . 0.515 ' CZ2' ' HB3' ' A' ' 3' ' ' PRO . 81.0 t90 . . . . . 0 N--CA 1.434 -1.263 0 N-CA-C 107.099 -1.445 . . . . 0.0 107.099 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 81.2 mt-30 -149.38 149.0 28.02 Favored Pre-proline 0 C--N 1.355 0.829 1 N-CA-C 97.549 -4.982 . . . . 0.0 97.549 174.22 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . 0.515 ' HB3' ' CZ2' ' A' ' 1' ' ' TRP . 60.5 Cg_endo -86.95 118.84 1.48 Allowed 'Trans proline' 0 CA--C 1.557 1.635 0 CA-C-N 125.045 2.838 . . . . 0.0 115.845 -162.997 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . 0.445 ' HD3' ' HA ' ' A' ' 3' ' ' PRO . 30.0 Cg_exo -76.09 -110.53 0.01 OUTLIER 'Trans proline' 0 C--N 1.362 1.287 1 C-N-CA 126.552 4.834 . . . . 0.0 114.658 178.942 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' TRP . . . . . 0.487 ' CE3' ' CD2' ' A' ' 6' ' ' TYR 0.316 36.5 p-90 -88.46 -70.47 0.64 Allowed 'General case' 0 C--N 1.379 1.854 0 C-N-CA 126.671 1.988 . . . . 0.0 116.334 -178.695 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.487 ' CD2' ' CE3' ' A' ' 5' ' ' TRP . 0.0 OUTLIER -32.06 -55.76 0.31 Allowed 'General case' 0 C--N 1.36 1.042 1 C-N-CA 135.74 5.616 . . . . 0.0 118.07 -173.338 . . . . . . . . 4 4 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.434 ' O ' ' HB2' ' A' ' 27' ' ' TRP . 0.1 OUTLIER -55.13 -39.78 69.8 Favored 'General case' 0 N--CA 1.444 -0.769 0 C-N-CA 130.287 3.435 . . . . 0.0 114.553 -179.8 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 10.1 mtpp -105.12 13.5 30.65 Favored 'General case' 0 C--N 1.356 0.867 0 C-N-CA 127.559 2.344 . . . . 0.0 110.56 -178.074 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.436 ' HB3' ' HB2' ' A' ' 45' ' ' ASN . 3.7 tp10 -93.46 132.84 29.35 Favored Pre-proline 0 C--N 1.368 1.385 0 O-C-N 120.012 -1.68 . . . . 0.0 112.458 -171.884 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . 0.4 ' HD3' ' HA ' ' A' ' 9' ' ' GLU . 53.4 Cg_exo -66.46 122.71 10.2 Favored 'Trans proline' 0 C--N 1.359 1.091 0 C-N-CA 124.054 3.17 . . . . 0.0 116.88 -165.957 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 8.4 p -72.52 132.53 33.27 Favored 'Isoleucine or valine' 0 C--N 1.36 1.026 0 C-N-CA 125.882 1.673 . . . . 0.0 111.743 175.924 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . 0.251 1.6 mmp_? -146.41 124.43 12.07 Favored 'General case' 0 C--N 1.353 0.751 0 CA-C-O 115.063 -2.399 . . . . 0.0 112.956 -168.822 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.278 6.5 tt -88.44 -35.16 7.63 Favored 'Isoleucine or valine' 0 C--N 1.384 2.097 0 CA-C-N 124.922 3.51 . . . . 0.0 115.179 177.64 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.358 1.764 0 N-CA-C 117.388 1.715 . . . . 0.0 117.388 175.081 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.548 ' HG3' ' H ' ' A' ' 19' ' ' GLN . 20.5 tptp . . . . . 0 CA--C 1.509 -0.596 0 N-CA-C 102.025 -3.324 . . . . 0.0 102.025 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . 0.548 ' H ' ' HG3' ' A' ' 18' ' ' LYS . 23.4 mp0 -133.75 113.23 12.08 Favored 'General case' 0 N--CA 1.438 -1.068 0 N-CA-C 101.983 -3.34 . . . . 0.0 101.983 170.979 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 33.1 m-85 -107.18 141.66 38.11 Favored 'General case' 0 C--N 1.355 0.845 0 O-C-N 120.484 -1.385 . . . . 0.0 107.921 179.65 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.7 t -66.39 122.65 18.01 Favored 'General case' 0 C--N 1.372 1.573 0 N-CA-C 117.695 2.48 . . . . 0.0 117.695 -176.619 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 1.2 t -120.73 -175.68 3.08 Favored 'General case' 0 C--N 1.363 1.159 0 C-N-CA 129.157 2.983 . . . . 0.0 109.175 -178.881 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 37.0 m-85 -146.12 141.62 27.71 Favored 'General case' 0 C--N 1.349 0.56 0 C-N-CA 129.854 3.262 . . . . 0.0 104.312 170.716 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 16.0 p90 -124.57 148.87 47.56 Favored 'General case' 0 C--N 1.358 0.967 0 N-CA-C 107.499 -1.297 . . . . 0.0 107.499 172.102 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 10.4 t80 -94.76 126.11 39.86 Favored 'General case' 0 C--N 1.363 1.189 0 N-CA-C 104.129 -2.545 . . . . 0.0 104.129 175.639 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -100.0 113.32 25.82 Favored 'General case' 0 N--CA 1.425 -1.682 0 C-N-CA 125.569 1.548 . . . . 0.0 108.85 -175.232 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' TRP . . . . . 0.434 ' HB2' ' O ' ' A' ' 7' ' ' CYS . 45.8 t-105 -53.54 -46.96 70.38 Favored 'General case' 0 C--N 1.361 1.097 0 C-N-CA 129.544 3.138 . . . . 0.0 117.457 -177.922 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 11.0 p -83.49 -5.54 59.19 Favored 'General case' 0 C--N 1.353 0.749 0 C-N-CA 124.542 1.137 . . . . 0.0 113.604 179.456 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -97.06 -47.93 5.59 Favored 'General case' 0 C--N 1.363 1.188 0 C-N-CA 124.819 1.247 . . . . 0.0 111.868 174.993 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . 0.294 0.7 OUTLIER 83.45 26.38 0.11 Allowed 'General case' 0 C--N 1.366 1.287 0 C-N-CA 127.672 2.389 . . . . 0.0 112.489 -178.333 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 7.8 tmtm? -147.78 164.22 34.3 Favored 'General case' 0 C--N 1.356 0.868 0 C-N-CA 128.008 2.523 . . . . 0.0 107.344 179.197 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 64.6 m -81.98 118.81 23.27 Favored 'General case' 0 C--N 1.363 1.195 0 C-N-CA 129.739 3.216 . . . . 0.0 114.606 178.831 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 29.6 mt -105.26 145.73 31.35 Favored Pre-proline 0 C--N 1.354 0.8 0 O-C-N 119.83 -1.794 . . . . 0.0 111.203 177.924 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 69.2 Cg_endo -86.92 144.28 7.24 Favored 'Trans proline' 0 N--CA 1.46 -0.452 0 C-N-CA 123.129 2.552 . . . . 0.0 112.245 173.481 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -149.03 171.16 16.83 Favored 'General case' 0 N--CA 1.444 -0.755 0 N-CA-C 101.338 -3.579 . . . . 0.0 101.338 170.255 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 8.4 mp -111.72 156.23 22.23 Favored 'General case' 0 N--CA 1.449 -0.519 0 C-N-CA 125.967 1.707 . . . . 0.0 106.882 178.398 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 8.3 t80 -116.95 139.69 50.35 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 127.137 2.175 . . . . 0.0 112.157 -179.104 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.3 t -92.76 -4.97 52.18 Favored 'General case' 0 C--N 1.377 1.786 0 N-CA-C 117.401 2.371 . . . . 0.0 117.401 178.291 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 106.21 -44.04 1.56 Allowed Glycine 0 C--N 1.366 2.197 0 CA-C-N 120.908 1.686 . . . . 0.0 116.541 170.856 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -133.69 139.37 46.38 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 103.634 -2.728 . . . . 0.0 103.634 177.322 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 103.09 -12.2 55.69 Favored Glycine 0 C--N 1.358 1.775 0 O-C-N 121.329 -0.857 . . . . 0.0 113.606 -173.75 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -102.93 177.24 25.27 Favored Glycine 0 C--N 1.361 1.922 0 C-N-CA 127.707 2.575 . . . . 0.0 112.622 177.052 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 15.1 p30 -119.72 -100.13 0.44 Allowed 'General case' 0 C--N 1.365 1.269 0 N-CA-C 115.446 1.647 . . . . 0.0 115.446 179.241 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -158.75 17.87 0.2 Allowed 'General case' 0 C--N 1.363 1.19 0 N-CA-C 114.981 1.475 . . . . 0.0 114.981 -172.155 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . 0.436 ' HB2' ' HB3' ' A' ' 9' ' ' GLU . 36.6 t30 -106.69 55.64 0.66 Allowed 'General case' 0 C--N 1.366 1.315 0 N-CA-C 104.401 -2.444 . . . . 0.0 104.401 172.47 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 7.0 ptp180 -144.07 105.31 4.24 Favored 'General case' 0 CA--C 1.5 -0.95 0 CA-C-O 124.721 2.201 . . . . 0.0 106.442 -172.08 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 18.4 m-85 -107.14 133.53 51.61 Favored 'General case' 0 N--CA 1.434 -1.241 0 CA-C-N 111.87 -2.423 . . . . 0.0 109.04 -169.849 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 30.9 mt-30 -55.23 -40.0 70.37 Favored 'General case' 0 C--N 1.355 0.845 0 C-N-CA 130.221 3.409 . . . . 0.0 116.605 -177.223 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 81.9 p -136.3 174.08 11.01 Favored 'General case' 0 C--N 1.356 0.862 0 C-N-CA 127.551 2.341 . . . . 0.0 107.656 178.163 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 18.6 tt -68.32 -13.04 16.52 Favored 'Isoleucine or valine' 0 C--N 1.36 1.049 0 C-N-CA 129.36 3.064 . . . . 0.0 116.883 177.58 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -99.61 -25.27 9.36 Favored Glycine 0 C--N 1.353 1.501 0 N-CA-C 116.72 1.448 . . . . 0.0 116.72 176.646 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -68.79 -21.77 64.31 Favored 'General case' 0 N--CA 1.491 1.611 0 CA-C-N 120.254 2.027 . . . . 0.0 113.188 176.509 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 22.7 t -70.84 -23.7 62.38 Favored 'General case' 0 CA--C 1.557 1.222 0 C-N-CA 129.105 2.962 . . . . 0.0 113.593 173.659 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 47.3 mtm180 -86.07 -30.79 22.32 Favored 'General case' 0 C--N 1.354 0.8 0 N-CA-C 116.719 2.118 . . . . 0.0 116.719 -175.102 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 84.1 tttt -77.29 -10.12 59.24 Favored 'General case' 0 C--N 1.369 1.439 0 C-N-CA 126.397 1.879 . . . . 0.0 113.6 -177.509 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 31.6 mtmt -102.06 -30.38 11.21 Favored 'General case' 0 N--CA 1.442 -0.856 0 C-N-CA 126.648 1.979 . . . . 0.0 114.132 -178.878 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . 0.43 ' SG ' ' HB2' ' A' ' 6' ' ' TYR . 47.3 m -139.4 25.46 2.43 Favored 'General case' 0 C--N 1.36 1.031 0 O-C-N 120.652 -1.28 . . . . 0.0 114.275 -166.644 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 18.3 mt -145.98 -27.62 0.43 Allowed 'General case' 0 C--N 1.345 0.405 0 O-C-N 120.625 -1.297 . . . . 0.0 111.735 174.436 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 86.61 57.58 2.06 Favored Glycine 0 C--N 1.364 2.094 0 C-N-CA 126.739 2.114 . . . . 0.0 112.706 -173.169 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 15.6 ptmt . . . . . 0 C--O 1.262 1.754 0 N-CA-C 106.433 -1.691 . . . . 0.0 106.433 -176.274 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 84.8 t90 . . . . . 0 N--CA 1.436 -1.166 0 CA-C-O 122.141 0.972 . . . . 0.0 108.496 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 18.6 mm-40 -143.92 149.73 47.08 Favored Pre-proline 0 N--CA 1.442 -0.844 1 N-CA-C 98.596 -4.594 . . . . 0.0 98.596 170.486 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 23.7 Cg_endo -71.88 123.27 9.2 Favored 'Trans proline' 0 CA--C 1.559 1.761 0 C-N-CA 123.655 2.903 . . . . 0.0 114.747 -170.092 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.528 ' HG2' ' CD2' ' A' ' 6' ' ' TYR . 43.7 Cg_endo -92.07 -113.93 0.0 OUTLIER 'Trans proline' 0 CA--C 1.543 0.931 1 C-N-CA 127.263 5.309 . . . . 0.0 110.196 -178.006 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . 0.443 ' CE3' ' CD1' ' A' ' 6' ' ' TYR . 4.6 p-90 -85.55 -70.46 0.59 Allowed 'General case' 0 C--N 1.38 1.911 0 C-N-CA 126.817 2.047 . . . . 0.0 114.48 177.029 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.528 ' CD2' ' HG2' ' A' ' 4' ' ' PRO . 0.1 OUTLIER -31.18 -52.27 0.19 Allowed 'General case' 0 C--N 1.365 1.24 1 C-N-CA 132.992 4.517 . . . . 0.0 118.411 -170.811 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 2.3 m -58.75 -40.31 83.49 Favored 'General case' 0 C--N 1.35 0.613 0 C-N-CA 127.567 2.347 . . . . 0.0 114.633 -177.334 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 27.8 mtpp -98.24 15.21 25.17 Favored 'General case' 0 C--N 1.359 0.993 0 C-N-CA 125.9 1.68 . . . . 0.0 111.533 177.616 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 16.9 tt0 -92.27 125.42 56.45 Favored Pre-proline 0 C--N 1.364 1.199 0 O-C-N 119.176 -2.202 . . . . 0.0 110.735 -173.518 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_exo -62.21 145.36 96.22 Favored 'Trans proline' 0 CA--C 1.547 1.126 0 C-N-CA 124.28 3.32 . . . . 0.0 117.508 -169.525 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 7.8 p -79.74 130.88 35.37 Favored 'Isoleucine or valine' 0 C--N 1.369 1.417 0 C-N-CA 123.48 0.712 . . . . 0.0 110.673 174.086 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 22.8 mmt85 -128.91 133.4 47.87 Favored 'General case' 0 C--N 1.35 0.617 0 N-CA-C 104.736 -2.32 . . . . 0.0 104.736 -173.543 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.315 19.4 tt -99.02 -45.04 12.18 Favored 'Isoleucine or valine' 0 C--N 1.369 1.414 0 CA-C-N 122.769 2.531 . . . . 0.0 111.355 175.577 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 93.32 -169.55 30.58 Favored Glycine 0 C--N 1.358 1.761 0 C-N-CA 124.438 1.018 . . . . 0.0 111.348 -170.353 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 57.7 m -156.58 102.75 2.07 Favored 'General case' 0 C--N 1.357 0.904 0 O-C-N 118.257 -2.908 . . . . 0.0 113.418 -178.76 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 2.9 p -168.25 146.53 4.34 Favored 'General case' 0 C--N 1.352 0.677 0 N-CA-C 103.513 -2.773 . . . . 0.0 103.513 175.663 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 41.4 mmtm -77.74 44.36 0.45 Allowed 'General case' 0 C--N 1.359 1.014 0 N-CA-C 121.033 3.716 . . . . 0.0 121.033 -165.035 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 25.6 tttp -149.11 141.7 24.4 Favored 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 103.381 -2.822 . . . . 0.0 103.381 171.598 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -126.19 134.08 51.36 Favored 'General case' 0 C--N 1.357 0.917 0 CA-C-N 121.746 2.066 . . . . 0.0 107.766 178.386 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 25.8 m-85 -107.29 146.03 32.01 Favored 'General case' 0 C--N 1.356 0.851 0 C-N-CA 128.094 2.558 . . . . 0.0 109.215 177.093 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.8 t -70.4 136.73 49.85 Favored 'General case' 0 C--N 1.371 1.532 0 N-CA-C 117.902 2.556 . . . . 0.0 117.902 -175.717 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 33.9 p -145.63 161.36 40.01 Favored 'General case' 0 C--N 1.359 1.009 0 C-N-CA 124.79 1.236 . . . . 0.0 113.787 -176.577 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . 0.408 ' HB2' ' HB2' ' A' ' 47' ' ' PHE . 94.3 m-85 -132.49 134.65 45.29 Favored 'General case' 0 C--N 1.343 0.303 0 C-N-CA 126.121 1.768 . . . . 0.0 107.479 177.048 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 29.2 p90 -114.95 144.18 43.99 Favored 'General case' 0 C--N 1.366 1.294 0 N-CA-C 106.772 -1.566 . . . . 0.0 106.772 175.725 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . 0.451 ' HA ' ' HA ' ' A' ' 32' ' ' CYS . 11.9 t80 -89.55 119.12 29.7 Favored 'General case' 0 C--N 1.374 1.646 0 CA-C-N 122.274 2.306 . . . . 0.0 105.692 -179.467 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.542 ' NZ ' ' H ' ' A' ' 28' ' ' THR . 0.5 OUTLIER -89.03 116.41 27.29 Favored 'General case' 0 N--CA 1.429 -1.5 0 C-N-CA 125.303 1.441 . . . . 0.0 109.577 -176.71 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -64.99 -39.63 93.75 Favored 'General case' 0 C--N 1.343 0.317 0 N-CA-C 118.332 2.716 . . . . 0.0 118.332 -172.84 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.542 ' H ' ' NZ ' ' A' ' 26' ' ' LYS . 17.4 p -89.89 -2.86 58.28 Favored 'General case' 0 C--N 1.359 0.98 0 O-C-N 120.523 -1.36 . . . . 0.0 111.496 176.498 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -96.64 -46.88 6.14 Favored 'General case' 0 C--N 1.364 1.22 0 C-N-CA 125.196 1.398 . . . . 0.0 114.183 175.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . 0.296 18.8 tptt 89.3 19.42 0.04 OUTLIER 'General case' 0 C--N 1.368 1.385 0 C-N-CA 126.778 2.031 . . . . 0.0 113.333 -178.242 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 8.1 ptpp? -147.86 169.4 19.9 Favored 'General case' 0 C--N 1.352 0.698 0 C-N-CA 126.486 1.914 . . . . 0.0 108.237 176.728 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.451 ' HA ' ' HA ' ' A' ' 25' ' ' PHE . 74.0 m -90.86 141.33 28.93 Favored 'General case' 0 C--N 1.367 1.357 0 O-C-N 120.513 -1.367 . . . . 0.0 111.668 175.941 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.2 mt -110.93 146.03 33.63 Favored Pre-proline 0 C--N 1.347 0.48 0 N-CA-C 107.77 -1.196 . . . . 0.0 107.77 178.913 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 69.3 Cg_endo -86.58 149.52 8.76 Favored 'Trans proline' 0 N--CA 1.458 -0.606 0 C-N-CA 123.882 3.055 . . . . 0.0 112.797 -179.758 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 5.9 p90 -146.0 -161.52 1.33 Allowed 'General case' 0 N--CA 1.444 -0.774 0 N-CA-C 104.462 -2.422 . . . . 0.0 104.462 171.713 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 84.9 mt -141.96 148.23 38.27 Favored 'General case' 0 N--CA 1.433 -1.321 0 N-CA-C 101.048 -3.686 . . . . 0.0 101.048 173.815 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.412 ' CZ ' ' HA2' ' A' ' 39' ' ' GLY . 2.9 t80 -109.77 138.09 46.63 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 127.497 2.319 . . . . 0.0 106.44 176.925 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 51.8 m -78.62 -43.05 27.26 Favored 'General case' 0 C--N 1.373 1.601 0 CA-C-O 122.935 1.35 . . . . 0.0 111.899 178.615 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . 0.412 ' HA2' ' CZ ' ' A' ' 37' ' ' PHE . . . 125.12 -51.8 0.82 Allowed Glycine 0 C--N 1.349 1.265 0 C-N-CA 125.953 1.74 . . . . 0.0 109.772 -175.43 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 8.0 m -80.27 65.61 5.49 Favored 'General case' 0 C--N 1.357 0.903 0 N-CA-C 116.758 2.133 . . . . 0.0 116.758 -175.156 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 128.82 57.79 0.11 Allowed Glycine 0 C--N 1.37 2.425 0 N-CA-C 118.812 2.285 . . . . 0.0 118.812 173.325 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -103.2 -159.87 25.26 Favored Glycine 0 C--N 1.37 2.434 0 CA-C-N 119.992 1.896 . . . . 0.0 114.423 174.585 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . 0.568 ' H ' ' NH1' ' A' ' 46' ' ' ARG 0.304 46.9 p30 -136.93 -106.6 0.2 Allowed 'General case' 0 C--N 1.356 0.854 0 O-C-N 121.303 -1.116 . . . . 0.0 111.351 -179.809 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -167.75 29.32 0.03 OUTLIER 'General case' 0 C--N 1.355 0.805 0 C-N-CA 124.49 1.116 . . . . 0.0 111.888 -177.734 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 51.9 t-20 -105.94 34.26 3.4 Favored 'General case' 0 C--N 1.37 1.482 0 N-CA-C 105.442 -2.058 . . . . 0.0 105.442 173.523 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.568 ' NH1' ' H ' ' A' ' 43' ' ' ASN . 0.8 OUTLIER -121.91 110.6 16.06 Favored 'General case' 0 C--N 1.358 0.949 0 CA-C-O 125.172 2.415 . . . . 0.0 111.272 -172.554 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . 0.41 ' CE1' ' HE3' ' A' ' 56' ' ' LYS . 84.6 m-85 -92.59 127.23 38.01 Favored 'General case' 0 N--CA 1.445 -0.71 0 C-N-CA 129.569 3.148 . . . . 0.0 106.622 179.729 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.92 -17.35 59.79 Favored 'General case' 0 C--N 1.37 1.49 0 N-CA-C 117.025 2.232 . . . . 0.0 117.025 -173.982 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 31.2 p -142.74 171.49 13.98 Favored 'General case' 0 C--N 1.357 0.917 0 N-CA-C 102.649 -3.093 . . . . 0.0 102.649 175.989 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 6.7 tt -85.67 7.43 2.09 Favored 'Isoleucine or valine' 0 C--N 1.363 1.163 0 O-C-N 119.648 -1.907 . . . . 0.0 113.407 176.297 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -97.75 -13.82 42.46 Favored Glycine 0 C--N 1.362 2.012 0 O-C-N 119.596 -1.94 . . . . 0.0 113.498 178.024 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -85.87 -29.8 23.41 Favored 'General case' 0 C--N 1.359 0.99 0 C-N-CA 126.533 1.933 . . . . 0.0 110.114 175.363 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 6.8 t -37.75 -58.4 0.91 Allowed 'General case' 0 C--N 1.372 1.584 1 C-N-CA 133.302 4.641 . . . . 0.0 116.362 179.654 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.69 -12.11 60.9 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 130.399 3.479 . . . . 0.0 116.836 -178.778 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -86.26 -12.04 50.69 Favored 'General case' 0 C--N 1.368 1.392 0 O-C-N 119.8 -1.813 . . . . 0.0 114.458 -176.863 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.41 ' HE3' ' CE1' ' A' ' 47' ' ' PHE . 18.7 mtmt -105.02 -34.13 8.09 Favored 'General case' 0 C--N 1.352 0.68 0 C-N-CA 125.525 1.53 . . . . 0.0 110.53 177.572 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 17.8 m -124.17 15.49 9.12 Favored 'General case' 0 C--N 1.358 0.956 0 N-CA-C 117.236 2.31 . . . . 0.0 117.236 -169.073 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 15.0 mt -137.37 -26.55 0.99 Allowed 'General case' 0 N--CA 1.472 0.656 0 O-C-N 119.349 -2.095 . . . . 0.0 112.981 175.507 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 85.4 55.06 2.67 Favored Glycine 0 C--N 1.363 2.052 0 C-N-CA 127.911 2.672 . . . . 0.0 112.86 -171.922 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 8.6 ptpt . . . . . 0 C--O 1.263 1.774 0 CA-C-O 116.26 -1.828 . . . . 0.0 106.539 -178.229 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 20.8 t90 . . . . . 0 N--CA 1.432 -1.35 0 N-CA-C 106.224 -1.769 . . . . 0.0 106.224 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 37.1 mt-30 -143.42 143.25 23.36 Favored Pre-proline 0 C--N 1.351 0.648 1 N-CA-C 99.034 -4.432 . . . . 0.0 99.034 175.128 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.436 ' HA ' ' HD3' ' A' ' 4' ' ' PRO . 28.8 Cg_endo -72.37 114.86 4.12 Favored 'Trans proline' 0 CA--C 1.555 1.528 0 C-N-CA 124.776 3.65 . . . . 0.0 117.846 -165.623 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.436 ' HD3' ' HA ' ' A' ' 3' ' ' PRO . 33.3 Cg_exo -77.76 -115.88 0.01 OUTLIER 'Trans proline' 0 C--N 1.371 1.722 1 C-N-CA 127.201 5.267 . . . . 0.0 114.428 177.318 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . 0.467 ' CE2' ' CE2' ' A' ' 6' ' ' TYR . 5.0 p-90 -85.44 -68.87 0.7 Allowed 'General case' 0 C--N 1.38 1.902 0 C-N-CA 128.129 2.572 . . . . 0.0 114.874 -178.164 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.467 ' CE2' ' CE2' ' A' ' 5' ' ' TRP . 0.1 OUTLIER -31.67 -56.98 0.28 Allowed 'General case' 0 CA--C 1.492 -1.288 1 C-N-CA 133.717 4.807 . . . . 0.0 116.989 -172.222 . . . . . . . . 4 4 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -56.53 -44.52 80.91 Favored 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 129.158 2.983 . . . . 0.0 115.239 -178.109 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 45.8 mttm -93.18 -13.94 27.77 Favored 'General case' 0 C--N 1.358 0.943 0 C-N-CA 128.921 2.889 . . . . 0.0 113.638 -177.662 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.439 ' HA ' ' HD3' ' A' ' 10' ' ' PRO . 0.1 OUTLIER -71.41 135.6 84.14 Favored Pre-proline 0 C--N 1.361 1.074 0 C-N-CA 127.581 2.352 . . . . 0.0 113.25 -175.06 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.439 ' HD3' ' HA ' ' A' ' 9' ' ' GLU . 72.0 Cg_exo -65.63 131.01 26.41 Favored 'Trans proline' 0 C--N 1.358 1.077 0 C-N-CA 124.232 3.288 . . . . 0.0 118.959 -167.119 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 8.2 p -77.33 124.39 35.65 Favored 'Isoleucine or valine' 0 C--N 1.368 1.395 0 C-N-CA 127.825 2.45 . . . . 0.0 113.912 175.535 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -147.37 133.12 18.94 Favored 'General case' 0 C--N 1.367 1.344 0 C-N-CA 126.951 2.1 . . . . 0.0 112.906 -174.228 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.287 7.2 tt -88.26 -48.4 15.0 Favored 'Isoleucine or valine' 0 C--N 1.372 1.562 0 N-CA-C 117.619 2.451 . . . . 0.0 117.619 179.795 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 83.94 -167.21 43.66 Favored Glycine 0 C--N 1.364 2.122 0 N-CA-C 117.411 1.724 . . . . 0.0 117.411 -170.231 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 17.8 m -171.24 76.03 0.06 Allowed 'General case' 0 C--N 1.361 1.084 0 O-C-N 119.695 -2.062 . . . . 0.0 105.816 179.389 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 2.8 t -125.13 -71.76 0.69 Allowed 'General case' 0 C--N 1.354 0.79 0 CA-C-N 114.677 -1.147 . . . . 0.0 111.869 -174.784 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 31.1 mmmt -96.7 -80.08 0.44 Allowed 'General case' 0 C--N 1.349 0.553 0 C-N-CA 124.179 0.992 . . . . 0.0 112.835 -174.609 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 12.0 ptmm? -146.87 -145.61 0.17 Allowed 'General case' 0 CA--C 1.503 -0.843 0 N-CA-C 102.328 -3.212 . . . . 0.0 102.328 178.608 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 5.1 mm100 -126.04 112.35 15.77 Favored 'General case' 0 N--CA 1.438 -1.058 0 N-CA-C 100.475 -3.898 . . . . 0.0 100.475 170.333 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 50.0 m-85 -94.4 144.23 25.73 Favored 'General case' 0 C--N 1.364 1.224 0 C-N-CA 126.385 1.874 . . . . 0.0 108.804 -179.654 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 4.9 t -67.54 112.74 4.87 Favored 'General case' 0 C--N 1.367 1.333 0 C-N-CA 126.723 2.009 . . . . 0.0 115.918 -175.764 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 4.6 p -120.26 -167.11 1.4 Allowed 'General case' 0 C--N 1.365 1.248 0 CA-C-O 123.263 1.506 . . . . 0.0 112.924 177.611 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 14.8 m-85 -148.99 136.82 20.58 Favored 'General case' 0 N--CA 1.446 -0.667 0 C-N-CA 129.236 3.014 . . . . 0.0 103.706 170.846 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 9.9 p90 -119.57 152.06 37.63 Favored 'General case' 0 C--N 1.364 1.216 0 CA-C-N 123.074 2.67 . . . . 0.0 109.684 173.102 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 19.6 t80 -94.01 121.66 35.71 Favored 'General case' 0 C--N 1.363 1.158 0 N-CA-C 106.45 -1.685 . . . . 0.0 106.45 -179.157 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.487 ' HD3' HD11 ' A' ' 33' ' ' LEU . 4.9 ttpp -90.9 108.59 19.94 Favored 'General case' 0 C--N 1.367 1.35 0 C-N-CA 123.48 0.712 . . . . 0.0 109.109 176.235 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 11.1 t-105 -52.09 -38.95 58.96 Favored 'General case' 0 C--N 1.355 0.823 0 C-N-CA 128.68 2.792 . . . . 0.0 117.1 -177.925 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 2.1 p -79.42 -30.09 42.17 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 129.686 3.194 . . . . 0.0 113.486 -179.397 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -86.1 -37.31 18.95 Favored 'General case' 0 C--N 1.365 1.273 0 C-N-CA 124.72 1.208 . . . . 0.0 111.473 177.748 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . 0.326 1.5 tptp 80.01 26.39 0.34 Allowed 'General case' 0 C--N 1.361 1.082 0 C-N-CA 127.693 2.397 . . . . 0.0 112.801 -178.621 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.5 tmtt? -147.52 177.27 9.39 Favored 'General case' 0 C--N 1.363 1.171 0 C-N-CA 125.827 1.651 . . . . 0.0 110.87 175.476 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 61.8 m -93.17 122.53 35.65 Favored 'General case' 0 C--N 1.363 1.161 0 C-N-CA 129.043 2.937 . . . . 0.0 114.394 -175.731 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.487 HD11 ' HD3' ' A' ' 26' ' ' LYS . 19.2 mt -104.42 142.44 24.63 Favored Pre-proline 0 C--N 1.358 0.96 0 CA-C-O 117.83 -1.081 . . . . 0.0 109.971 177.536 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 96.9 Cg_endo -82.12 127.62 5.39 Favored 'Trans proline' 0 CA--C 1.531 0.334 0 C-N-CA 123.878 3.052 . . . . 0.0 112.273 175.541 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . 0.261 0.2 OUTLIER -141.39 177.45 8.1 Favored 'General case' 0 C--N 1.35 0.621 0 N-CA-C 102.325 -3.213 . . . . 0.0 102.325 169.512 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 1.1 mp -117.88 165.56 13.53 Favored 'General case' 0 N--CA 1.44 -0.96 0 C-N-CA 125.27 1.428 . . . . 0.0 107.263 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.429 ' CE2' ' HA2' ' A' ' 39' ' ' GLY . 30.3 t80 -123.01 136.52 54.88 Favored 'General case' 0 CA--C 1.551 1.011 0 C-N-CA 125.578 1.551 . . . . 0.0 112.071 178.882 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.9 t -88.08 -24.6 23.38 Favored 'General case' 0 C--N 1.38 1.9 0 CA-C-N 122.073 2.215 . . . . 0.0 114.315 173.422 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . 0.429 ' HA2' ' CE2' ' A' ' 37' ' ' PHE . . . 118.23 -58.66 0.51 Allowed Glycine 0 C--N 1.361 1.93 0 C-N-CA 125.78 1.657 . . . . 0.0 114.166 175.411 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -102.81 115.91 31.52 Favored 'General case' 0 C--N 1.351 0.635 0 C-N-CA 126.307 1.843 . . . . 0.0 106.654 178.721 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 134.46 -45.86 1.09 Allowed Glycine 0 CA--C 1.49 -1.528 0 N-CA-C 109.861 -1.296 . . . . 0.0 109.861 -174.435 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -93.45 -165.93 37.71 Favored Glycine 0 C--N 1.36 1.907 0 O-C-N 121.13 -1.217 . . . . 0.0 113.932 173.263 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . 0.392 3.9 p30 -134.37 -99.81 0.25 Allowed 'General case' 0 C--N 1.353 0.734 0 O-C-N 121.177 -1.19 . . . . 0.0 113.466 179.916 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -150.79 24.4 0.76 Allowed 'General case' 0 C--N 1.374 1.635 0 N-CA-C 117.022 2.23 . . . . 0.0 117.022 -171.059 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . 0.581 ' H ' HH11 ' A' ' 46' ' ' ARG . 40.2 t30 -101.7 48.2 0.89 Allowed 'General case' 0 N--CA 1.491 1.587 0 N-CA-C 105.106 -2.183 . . . . 0.0 105.106 171.458 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.581 HH11 ' H ' ' A' ' 45' ' ' ASN . 0.0 OUTLIER -146.3 118.42 8.3 Favored 'General case' 0 CA--C 1.492 -1.276 0 N-CA-C 104.275 -2.491 . . . . 0.0 104.275 -176.131 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . 0.446 ' CD2' ' HA ' ' A' ' 53' ' ' CYS . 21.8 m-85 -107.23 129.41 54.87 Favored 'General case' 0 N--CA 1.429 -1.49 0 C-N-CA 127.681 2.392 . . . . 0.0 107.524 -165.261 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 23.4 mp0 -70.06 -30.45 67.71 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 126.249 1.82 . . . . 0.0 115.558 -169.107 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 1.4 p -146.21 168.3 21.37 Favored 'General case' 0 C--N 1.352 0.696 0 N-CA-C 104.272 -2.492 . . . . 0.0 104.272 176.268 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 2.3 tt -84.23 138.31 19.4 Favored 'Isoleucine or valine' 0 C--N 1.37 1.484 0 C-N-CA 125.576 1.55 . . . . 0.0 108.246 176.288 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 117.17 -50.06 0.82 Allowed Glycine 0 C--N 1.364 2.105 0 N-CA-C 107.49 -2.244 . . . . 0.0 107.49 -157.367 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 16.2 tp10 -77.71 -20.03 54.24 Favored 'General case' 0 C--N 1.366 1.324 0 N-CA-C 115.813 1.783 . . . . 0.0 115.813 -178.297 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . 0.446 ' HA ' ' CD2' ' A' ' 47' ' ' PHE . 52.7 t -77.57 -42.03 36.75 Favored 'General case' 0 C--N 1.361 1.094 0 C-N-CA 128.509 2.723 . . . . 0.0 112.882 177.923 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 72.5 mtm180 -74.52 -45.73 43.85 Favored 'General case' 0 N--CA 1.447 -0.609 1 C-N-CA 133.732 4.813 . . . . 0.0 112.466 179.96 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 69.8 tttt -82.63 55.03 2.83 Favored 'General case' 0 C--N 1.373 1.609 0 CA-C-O 123.616 1.674 . . . . 0.0 111.852 174.198 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 22.1 mtmt -167.77 -47.03 0.02 OUTLIER 'General case' 0 N--CA 1.444 -0.763 0 C-N-CA 129.977 3.311 . . . . 0.0 105.171 -178.547 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . 0.441 ' SG ' ' HB2' ' A' ' 6' ' ' TYR . 56.3 m -121.65 7.87 10.03 Favored 'General case' 0 C--N 1.357 0.914 0 N-CA-C 119.579 3.178 . . . . 0.0 119.579 -172.942 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 18.7 mt -133.83 -8.6 2.75 Favored 'General case' 0 N--CA 1.481 1.115 0 CA-C-N 125.646 3.839 . . . . 0.0 114.066 175.288 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 67.82 59.35 6.61 Favored Glycine 0 C--N 1.359 1.832 0 C-N-CA 128.262 2.839 . . . . 0.0 113.863 -171.449 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 2.5 ptpp? . . . . . 0 C--O 1.264 1.824 0 N-CA-C 102.366 -3.198 . . . . 0.0 102.366 -175.396 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' TRP . . . . . 0.508 ' CZ2' ' HB3' ' A' ' 3' ' ' PRO . 9.6 t90 . . . . . 0 N--CA 1.433 -1.32 0 N-CA-C 108.076 -1.083 . . . . 0.0 108.076 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 16.6 mm-40 -142.02 150.09 54.78 Favored Pre-proline 0 C--N 1.353 0.758 1 N-CA-C 98.382 -4.673 . . . . 0.0 98.382 171.07 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.508 ' HB3' ' CZ2' ' A' ' 1' ' ' TRP . 87.5 Cg_endo -80.76 132.79 8.91 Favored 'Trans proline' 0 CA--C 1.563 1.933 0 CA-C-N 124.291 2.568 . . . . 0.0 113.455 -166.8 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.508 ' HG2' ' CD2' ' A' ' 6' ' ' TYR . 44.7 Cg_endo -94.46 -113.22 0.0 OUTLIER 'Trans proline' 0 CA--C 1.546 1.119 1 C-N-CA 127.114 5.209 . . . . 0.0 110.784 -178.053 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . 0.433 ' CE3' ' CD1' ' A' ' 6' ' ' TYR 0.265 52.7 p-90 -86.98 -69.71 0.66 Allowed 'General case' 0 C--N 1.384 2.103 0 C-N-CA 128.097 2.559 . . . . 0.0 114.926 178.902 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.508 ' CD2' ' HG2' ' A' ' 4' ' ' PRO . 0.0 OUTLIER -32.8 -51.59 0.3 Allowed 'General case' 0 C--N 1.368 1.386 1 C-N-CA 132.472 4.309 . . . . 0.0 117.575 -174.168 . . . . . . . . 4 4 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 3.0 m -60.75 -28.7 68.9 Favored 'General case' 0 CA--C 1.507 -0.708 0 C-N-CA 129.275 3.03 . . . . 0.0 118.127 -175.305 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . 0.25 61.2 tttm -118.41 17.72 13.74 Favored 'General case' 0 C--N 1.355 0.81 0 C-N-CA 128.276 2.63 . . . . 0.0 108.487 -178.218 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.478 ' HA ' ' HD3' ' A' ' 10' ' ' PRO . 22.9 tp10 -94.86 127.78 41.9 Favored Pre-proline 0 C--N 1.36 1.041 0 O-C-N 119.263 -2.148 . . . . 0.0 112.722 -173.428 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.478 ' HD3' ' HA ' ' A' ' 9' ' ' GLU . 38.2 Cg_exo -72.99 140.9 32.22 Favored 'Trans proline' 0 C--N 1.352 0.746 0 C-N-CA 123.903 3.069 . . . . 0.0 113.45 -169.814 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -81.41 153.07 4.18 Favored 'Isoleucine or valine' 0 C--N 1.362 1.109 0 N-CA-C 115.426 1.639 . . . . 0.0 115.426 178.871 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -147.0 119.8 8.65 Favored 'General case' 0 N--CA 1.438 -1.034 0 C-N-CA 125.369 1.468 . . . . 0.0 111.14 -178.281 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.285 11.7 tt -74.02 -40.7 52.25 Favored 'Isoleucine or valine' 0 C--N 1.357 0.894 0 N-CA-C 115.413 1.634 . . . . 0.0 115.413 175.829 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 124.21 -166.38 16.81 Favored Glycine 0 C--N 1.352 1.419 0 N-CA-C 109.617 -1.393 . . . . 0.0 109.617 -178.933 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 15.4 m -106.3 -5.32 19.2 Favored 'General case' 0 C--N 1.357 0.925 0 N-CA-C 115.272 1.582 . . . . 0.0 115.272 -179.109 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 81.4 m -111.03 170.48 8.08 Favored 'General case' 0 C--N 1.359 1.008 0 O-C-N 119.871 -1.768 . . . . 0.0 110.355 -178.808 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.467 ' NZ ' HE21 ' A' ' 19' ' ' GLN . 4.2 mmmp? -111.05 58.27 0.62 Allowed 'General case' 0 C--N 1.356 0.87 0 C-N-CA 125.432 1.493 . . . . 0.0 110.707 177.007 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 38.3 ttmt -134.25 124.97 26.81 Favored 'General case' 0 CA--C 1.504 -0.823 1 N-CA-C 99.545 -4.243 . . . . 0.0 99.545 174.394 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.467 HE21 ' NZ ' ' A' ' 17' ' ' LYS . 0.0 OUTLIER -130.31 128.04 40.71 Favored 'General case' 0 C--N 1.354 0.768 0 C-N-CA 123.873 0.869 . . . . 0.0 112.339 -170.071 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 26.8 m-85 -112.04 135.33 52.82 Favored 'General case' 0 C--N 1.358 0.966 0 C-N-CA 127.294 2.238 . . . . 0.0 107.7 177.184 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . 0.483 ' HA ' ' HG ' ' A' ' 36' ' ' LEU 0.277 4.0 t -69.26 132.31 46.27 Favored 'General case' 0 C--N 1.375 1.684 0 N-CA-C 116.492 2.034 . . . . 0.0 116.492 -177.133 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 3.2 p -146.06 -172.08 3.85 Favored 'General case' 0 N--CA 1.448 -0.538 0 C-N-CA 127.633 2.373 . . . . 0.0 110.312 -173.029 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 48.6 m-85 -145.27 153.37 41.22 Favored 'General case' 0 C--N 1.35 0.628 0 C-N-CA 128.631 2.772 . . . . 0.0 110.733 177.083 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . 0.251 12.5 p90 -131.98 154.93 48.83 Favored 'General case' 0 C--N 1.373 1.624 0 C-N-CA 125.292 1.437 . . . . 0.0 108.671 168.106 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 16.2 t80 -94.97 111.88 23.63 Favored 'General case' 0 C--N 1.365 1.268 0 O-C-N 119.716 -1.865 . . . . 0.0 107.966 -179.477 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -83.38 107.03 15.62 Favored 'General case' 0 C--N 1.363 1.195 0 O-C-N 120.366 -1.459 . . . . 0.0 111.83 -176.51 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 41.1 t-105 -46.05 -53.59 9.95 Favored 'General case' 0 C--N 1.357 0.931 1 C-N-CA 132.155 4.182 . . . . 0.0 117.746 -171.546 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.5 p -81.27 -15.74 54.63 Favored 'General case' 0 C--N 1.353 0.723 0 C-N-CA 126.657 1.983 . . . . 0.0 113.084 179.686 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -88.79 -37.63 15.27 Favored 'General case' 0 C--N 1.366 1.299 0 C-N-CA 124.175 0.99 . . . . 0.0 112.044 174.304 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . 0.301 12.0 mmmm 77.25 27.03 0.68 Allowed 'General case' 0 C--N 1.366 1.309 0 C-N-CA 129.562 3.145 . . . . 0.0 113.327 -178.519 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 52.1 pttt -146.45 163.97 33.97 Favored 'General case' 0 C--N 1.355 0.811 0 C-N-CA 125.807 1.643 . . . . 0.0 110.502 -179.572 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 89.4 m -80.48 126.34 31.09 Favored 'General case' 0 C--N 1.359 0.991 0 C-N-CA 128.308 2.643 . . . . 0.0 115.222 -177.247 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 13.2 mt -112.19 147.58 37.26 Favored Pre-proline 0 C--N 1.36 1.039 0 O-C-N 120.461 -1.4 . . . . 0.0 108.725 176.298 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -86.57 142.54 7.02 Favored 'Trans proline' 0 C--N 1.344 0.311 1 C-N-CA 125.542 4.161 . . . . 0.0 111.444 170.976 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -145.7 165.12 29.68 Favored 'General case' 0 N--CA 1.439 -0.993 1 N-CA-C 98.313 -4.699 . . . . 0.0 98.313 169.691 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.483 ' HG ' ' HA ' ' A' ' 21' ' ' SER . 7.8 mp -109.72 149.93 29.04 Favored 'General case' 0 N--CA 1.44 -0.942 0 N-CA-C 104.428 -2.434 . . . . 0.0 104.428 174.922 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -100.51 138.15 37.96 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 126.953 2.101 . . . . 0.0 109.129 176.598 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 9.2 t -107.66 119.0 38.21 Favored 'General case' 0 C--N 1.363 1.179 0 N-CA-C 104.585 -2.376 . . . . 0.0 104.585 171.521 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -68.93 19.58 0.43 Allowed Glycine 0 N--CA 1.479 1.515 0 C-N-CA 127.681 2.563 . . . . 0.0 119.134 -178.397 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 78.7 m -114.12 56.22 0.72 Allowed 'General case' 0 C--N 1.354 0.791 0 C-N-CA 128.943 2.897 . . . . 0.0 108.825 172.355 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 118.29 54.77 0.28 Allowed Glycine 0 C--N 1.359 1.842 0 N-CA-C 120.367 2.907 . . . . 0.0 120.367 171.107 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -86.47 -176.72 49.62 Favored Glycine 0 C--N 1.37 2.466 0 CA-C-N 121.48 2.64 . . . . 0.0 116.412 175.12 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . 0.5 ' H ' ' CZ ' ' A' ' 46' ' ' ARG 0.355 30.2 p30 -113.07 -112.88 0.34 Allowed 'General case' 0 C--N 1.362 1.136 0 O-C-N 119.923 -1.927 . . . . 0.0 114.435 179.887 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -141.64 -9.31 0.94 Allowed 'General case' 0 C--N 1.354 0.761 0 O-C-N 120.406 -1.434 . . . . 0.0 112.894 -174.814 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 61.7 t30 -101.53 57.2 0.84 Allowed 'General case' 0 C--N 1.365 1.261 0 O-C-N 120.19 -1.568 . . . . 0.0 109.969 -179.409 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.5 ' CZ ' ' H ' ' A' ' 43' ' ' ASN 0.37 0.0 OUTLIER -131.06 130.53 43.35 Favored 'General case' 0 CA--C 1.498 -1.033 0 CA-C-O 124.415 2.055 . . . . 0.0 110.197 178.292 . . . . . . . . 4 4 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 10.5 m-85 -114.75 131.42 56.78 Favored 'General case' 0 C--N 1.35 0.593 0 C-N-CA 128.388 2.675 . . . . 0.0 106.894 -177.258 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -85.99 -27.08 25.07 Favored 'General case' 0 C--N 1.371 1.523 0 CA-C-N 121.62 2.009 . . . . 0.0 115.579 -177.311 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 23.9 p -125.19 155.72 39.57 Favored 'General case' 0 C--N 1.351 0.667 0 N-CA-C 104.8 -2.296 . . . . 0.0 104.8 177.497 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 16.4 tt -58.87 -32.17 46.59 Favored 'Isoleucine or valine' 0 C--N 1.36 1.046 0 N-CA-C 117.347 2.351 . . . . 0.0 117.347 -177.621 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . 0.404 ' HA2' ' HD3' ' A' ' 54' ' ' ARG . . . -91.37 1.68 76.84 Favored Glycine 0 C--N 1.358 1.782 0 O-C-N 120.187 -1.571 . . . . 0.0 115.795 178.222 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 15.6 tp10 -82.28 -20.23 37.93 Favored 'General case' 0 C--N 1.365 1.248 0 O-C-N 120.896 -1.355 . . . . 0.0 110.67 170.774 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 19.7 t -72.12 -30.19 64.82 Favored 'General case' 0 C--N 1.363 1.162 0 C-N-CA 129.07 2.948 . . . . 0.0 112.86 175.573 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.404 ' HD3' ' HA2' ' A' ' 51' ' ' GLY . 43.8 mtp180 -76.16 -48.56 20.12 Favored 'General case' 0 C--N 1.355 0.81 0 C-N-CA 127.697 2.399 . . . . 0.0 114.875 176.461 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 30.8 ttmt -82.15 59.92 4.67 Favored 'General case' 0 C--N 1.361 1.075 0 C-N-CA 127.809 2.444 . . . . 0.0 111.841 -174.266 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.421 ' HG2' ' CZ ' ' A' ' 6' ' ' TYR . 23.9 mtmt -179.62 -39.81 0.01 OUTLIER 'General case' 0 N--CA 1.439 -0.993 0 C-N-CA 130.854 3.662 . . . . 0.0 106.09 -176.11 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . 0.409 ' O ' ' CZ2' ' A' ' 1' ' ' TRP . 67.7 m -125.01 7.38 7.98 Favored 'General case' 0 C--N 1.364 1.238 0 N-CA-C 119.862 3.282 . . . . 0.0 119.862 -170.503 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 14.7 mt -140.58 -8.97 1.09 Allowed 'General case' 0 N--CA 1.476 0.834 0 CA-C-N 124.124 3.147 . . . . 0.0 114.466 169.713 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 71.41 51.32 17.42 Favored Glycine 0 C--N 1.356 1.654 0 C-N-CA 128.107 2.765 . . . . 0.0 113.395 -171.923 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 12.3 ptpt . . . . . 0 C--O 1.26 1.629 0 N-CA-C 103.707 -2.701 . . . . 0.0 103.707 -174.195 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 23.3 t90 . . . . . 0 N--CA 1.433 -1.297 0 N-CA-C 108.254 -1.017 . . . . 0.0 108.254 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 23.5 mm-40 -144.14 144.06 24.7 Favored Pre-proline 0 C--N 1.353 0.726 0 N-CA-C 100.482 -3.895 . . . . 0.0 100.482 174.927 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 19.9 Cg_endo -72.69 122.59 8.34 Favored 'Trans proline' 0 CA--C 1.557 1.631 0 CA-C-N 124.782 2.744 . . . . 0.0 116.441 -169.257 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.487 ' HG2' ' CD2' ' A' ' 6' ' ' TYR . 38.2 Cg_endo -91.78 -123.15 0.01 OUTLIER 'Trans proline' 0 CA--C 1.555 1.533 1 C-N-CA 127.034 5.156 . . . . 0.0 111.81 178.694 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . 0.469 ' CE3' ' CD1' ' A' ' 6' ' ' TYR 0.336 54.7 p-90 -73.09 -74.14 0.18 Allowed 'General case' 0 C--N 1.384 2.076 0 C-N-CA 126.521 1.928 . . . . 0.0 114.44 178.538 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.487 ' CD2' ' HG2' ' A' ' 4' ' ' PRO . 0.1 OUTLIER -32.04 -51.46 0.24 Allowed 'General case' 0 C--N 1.363 1.169 1 C-N-CA 132.183 4.193 . . . . 0.0 117.469 -175.619 . . . . . . . . 4 4 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.428 ' O ' ' HB2' ' A' ' 27' ' ' TRP . 1.1 m -71.5 -8.01 51.19 Favored 'General case' 0 CA--C 1.51 -0.587 0 C-N-CA 129.885 3.274 . . . . 0.0 115.747 -176.902 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 47.8 mttp -134.81 11.63 3.67 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 128.118 2.567 . . . . 0.0 107.242 -179.604 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.408 ' HA ' ' HD3' ' A' ' 10' ' ' PRO . 34.9 tp10 -96.85 134.42 23.08 Favored Pre-proline 0 C--N 1.364 1.228 0 N-CA-C 115.092 1.515 . . . . 0.0 115.092 -167.849 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.408 ' HD3' ' HA ' ' A' ' 9' ' ' GLU . 72.0 Cg_exo -66.35 121.1 8.32 Favored 'Trans proline' 0 C--N 1.365 1.433 0 C-N-CA 124.707 3.604 . . . . 0.0 116.182 -169.495 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 14.3 p -69.39 136.46 26.2 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.908 0 C-N-CA 127.642 2.377 . . . . 0.0 112.885 177.584 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 61.6 mtp180 -146.33 126.09 13.46 Favored 'General case' 0 C--N 1.359 1.02 0 C-N-CA 125.237 1.415 . . . . 0.0 111.869 -172.274 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 12.9 tt -103.65 -37.27 4.49 Favored 'Isoleucine or valine' 0 C--N 1.37 1.482 0 C-N-CA 126.334 1.854 . . . . 0.0 112.452 175.593 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 70.38 154.7 1.29 Allowed Glycine 0 C--N 1.366 2.195 0 C-N-CA 127.171 2.319 . . . . 0.0 116.95 176.722 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 58.6 p -93.27 71.53 4.49 Favored 'General case' 0 C--N 1.356 0.886 0 O-C-N 120.456 -1.614 . . . . 0.0 112.693 -178.452 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 4.1 t -125.89 -127.55 0.24 Allowed 'General case' 0 C--N 1.353 0.752 0 C-N-CA 123.518 0.727 . . . . 0.0 112.682 -175.974 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 2.3 mtmp? -79.9 -99.4 0.03 OUTLIER 'General case' 0 C--N 1.356 0.886 0 N-CA-C 120.296 3.443 . . . . 0.0 120.296 -172.548 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 15.0 tppt? -122.32 138.58 54.46 Favored 'General case' 0 C--N 1.359 1.019 0 N-CA-C 106.547 -1.649 . . . . 0.0 106.547 -174.153 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . 0.337 4.1 mp0 -93.5 121.15 34.61 Favored 'General case' 0 C--N 1.358 0.946 0 CA-C-O 122.955 1.359 . . . . 0.0 112.075 178.736 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 30.0 m-85 -108.21 150.13 27.66 Favored 'General case' 0 C--N 1.356 0.874 0 C-N-CA 128.148 2.579 . . . . 0.0 106.069 -179.176 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 4.1 t -72.0 143.95 49.01 Favored 'General case' 0 C--N 1.368 1.404 0 N-CA-C 117.127 2.269 . . . . 0.0 117.127 -173.536 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 27.7 p -145.87 -173.28 4.11 Favored 'General case' 0 C--N 1.36 1.062 0 C-N-CA 127.934 2.494 . . . . 0.0 112.458 -177.856 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . 0.517 ' HA ' ' HA ' ' A' ' 34' ' ' PRO . 43.0 m-85 -139.69 153.21 47.19 Favored 'General case' 0 C--N 1.361 1.089 0 C-N-CA 129.454 3.102 . . . . 0.0 111.66 174.876 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . 0.282 10.7 p90 -147.93 161.42 41.36 Favored 'General case' 0 C--N 1.367 1.355 0 C-N-CA 126.437 1.895 . . . . 0.0 110.158 172.134 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . 0.427 ' CD2' ' HB2' ' A' ' 57' ' ' CYS . 27.5 t80 -100.53 127.44 46.9 Favored 'General case' 0 C--N 1.368 1.387 0 O-C-N 120.54 -1.35 . . . . 0.0 108.274 178.438 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.408 ' HB3' ' HB3' ' A' ' 29' ' ' ALA . 1.7 ttpp -85.77 103.17 14.3 Favored 'General case' 0 C--N 1.364 1.21 0 C-N-CA 124.334 1.054 . . . . 0.0 112.04 177.873 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . 0.428 ' HB2' ' O ' ' A' ' 7' ' ' CYS . 35.3 t-105 -50.69 -44.43 57.92 Favored 'General case' 0 C--N 1.35 0.612 0 C-N-CA 129.301 3.04 . . . . 0.0 116.116 179.361 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 3.7 p -87.31 -6.56 58.47 Favored 'General case' 0 C--N 1.36 1.064 0 C-N-CA 125.193 1.397 . . . . 0.0 113.326 178.478 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.408 ' HB3' ' HB3' ' A' ' 26' ' ' LYS . . . -99.51 -38.48 8.76 Favored 'General case' 0 C--N 1.368 1.376 0 CA-C-N 120.561 1.528 . . . . 0.0 112.095 173.701 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . 0.273 30.4 tptt 84.36 23.59 0.11 Allowed 'General case' 0 C--N 1.367 1.351 0 C-N-CA 127.623 2.369 . . . . 0.0 111.616 -176.258 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 55.2 mtmt -145.54 166.43 25.75 Favored 'General case' 0 C--N 1.357 0.92 0 C-N-CA 126.636 1.974 . . . . 0.0 109.55 -177.61 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 75.0 m -89.39 145.8 25.1 Favored 'General case' 0 C--N 1.358 0.938 0 C-N-CA 127.646 2.379 . . . . 0.0 113.293 -178.791 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 44.6 mt -129.09 148.93 71.08 Favored Pre-proline 0 C--N 1.357 0.934 0 C-N-CA 125.296 1.438 . . . . 0.0 109.182 176.298 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.517 ' HA ' ' HA ' ' A' ' 23' ' ' PHE . 18.6 Cg_endo -86.64 162.31 9.34 Favored 'Trans proline' 0 N--CA 1.46 -0.445 0 C-N-CA 123.267 2.645 . . . . 0.0 110.868 165.933 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . 0.352 2.9 p90 -149.55 -159.24 1.01 Allowed 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 113.269 -1.787 . . . . 0.0 108.332 174.775 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 18.8 mt -139.65 144.94 37.88 Favored 'General case' 0 N--CA 1.439 -1.016 0 N-CA-C 103.323 -2.843 . . . . 0.0 103.323 -178.598 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.408 ' CE2' ' HA2' ' A' ' 39' ' ' GLY . 12.3 t80 -121.2 128.97 52.97 Favored 'General case' 0 CA--C 1.551 0.982 0 C-N-CA 128.852 2.861 . . . . 0.0 109.338 -179.792 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 37.7 m -76.52 2.57 13.48 Favored 'General case' 0 C--N 1.388 2.252 0 N-CA-C 115.976 1.843 . . . . 0.0 115.976 -178.318 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . 0.408 ' HA2' ' CE2' ' A' ' 37' ' ' PHE . . . 83.85 -39.45 2.85 Favored Glycine 0 C--N 1.358 1.776 0 N-CA-C 118.374 2.11 . . . . 0.0 118.374 176.3 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -125.51 38.06 4.25 Favored 'General case' 0 C--N 1.35 0.595 0 C-N-CA 124.514 1.125 . . . . 0.0 108.591 178.484 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -147.8 28.31 1.44 Allowed Glycine 0 C--N 1.356 1.655 0 N-CA-C 116.762 1.465 . . . . 0.0 116.762 -176.398 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -105.43 178.36 23.31 Favored Glycine 0 C--N 1.356 1.644 0 O-C-N 119.598 -2.119 . . . . 0.0 116.467 177.727 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 43.6 p-10 -127.31 -92.98 0.48 Allowed 'General case' 0 C--N 1.356 0.882 0 C-N-CA 124.615 1.166 . . . . 0.0 112.5 176.425 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -136.52 -30.0 0.93 Allowed 'General case' 0 C--N 1.358 0.972 0 N-CA-C 114.537 1.31 . . . . 0.0 114.537 -172.182 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 45.5 t30 -92.72 72.09 4.93 Favored 'General case' 0 C--N 1.372 1.547 0 O-C-N 119.743 -1.848 . . . . 0.0 111.918 -176.343 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . 0.377 0.0 OUTLIER -135.77 125.59 25.65 Favored 'General case' 0 C--N 1.351 0.673 0 CA-C-O 124.517 2.103 . . . . 0.0 110.238 174.606 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 20.2 m-30 -105.0 137.83 42.15 Favored 'General case' 0 N--CA 1.441 -0.905 0 C-N-CA 128.69 2.796 . . . . 0.0 107.795 -176.526 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 30.9 mt-30 -74.73 -45.65 42.61 Favored 'General case' 0 C--N 1.368 1.41 0 N-CA-C 114.734 1.383 . . . . 0.0 114.734 -177.413 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 30.1 p -129.56 172.23 11.78 Favored 'General case' 0 C--N 1.353 0.744 0 N-CA-C 105.529 -2.026 . . . . 0.0 105.529 175.747 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 18.6 tt -59.55 -28.07 39.08 Favored 'Isoleucine or valine' 0 C--N 1.365 1.281 0 C-N-CA 128.869 2.868 . . . . 0.0 117.05 178.985 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -84.75 -8.9 82.09 Favored Glycine 0 C--N 1.361 1.956 0 N-CA-C 115.961 1.144 . . . . 0.0 115.961 -177.226 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -88.49 -1.93 58.32 Favored 'General case' 0 C--N 1.362 1.123 0 C-N-CA 126.06 1.744 . . . . 0.0 111.248 176.274 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 33.9 t -85.05 -47.79 9.86 Favored 'General case' 0 C--N 1.355 0.821 0 C-N-CA 128.333 2.653 . . . . 0.0 112.983 -178.191 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.442 ' HB2' ' HD2' ' A' ' 60' ' ' LYS 0.338 0.0 OUTLIER -85.79 -25.27 26.45 Favored 'General case' 0 C--O 1.234 0.277 0 C-N-CA 128.64 2.776 . . . . 0.0 111.815 -179.916 . . . . . . . . 4 4 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.67 -25.39 63.88 Favored 'General case' 0 C--N 1.373 1.601 0 C-N-CA 125.857 1.663 . . . . 0.0 113.794 171.696 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.423 ' HD2' ' CD1' ' A' ' 6' ' ' TYR . 23.5 mtmt -98.49 -32.1 11.64 Favored 'General case' 0 C--N 1.362 1.116 0 C-N-CA 125.034 1.334 . . . . 0.0 111.636 172.695 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . 0.438 ' SG ' ' HB2' ' A' ' 6' ' ' TYR . 87.7 m -124.33 11.46 8.71 Favored 'General case' 0 C--N 1.362 1.132 0 N-CA-C 120.12 3.378 . . . . 0.0 120.12 -172.167 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 17.3 mt -132.15 -17.97 2.65 Favored 'General case' 0 N--CA 1.477 0.879 0 CA-C-N 124.579 3.354 . . . . 0.0 112.102 170.214 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 76.61 56.09 4.34 Favored Glycine 0 C--N 1.359 1.831 0 C-N-CA 128.034 2.73 . . . . 0.0 112.381 -171.601 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . 0.442 ' HD2' ' HB2' ' A' ' 54' ' ' ARG . 13.7 ptpt . . . . . 0 C--O 1.258 1.526 0 N-CA-C 102.892 -3.003 . . . . 0.0 102.892 -176.373 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 19.3 t90 . . . . . 0 N--CA 1.436 -1.171 0 CA-C-O 122.706 1.241 . . . . 0.0 109.753 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 35.3 mt-30 -138.75 147.6 55.09 Favored Pre-proline 0 C--N 1.359 1.016 1 N-CA-C 99.91 -4.107 . . . . 0.0 99.91 169.279 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 5.0 Cg_endo -73.76 123.57 8.61 Favored 'Trans proline' 0 CA--C 1.553 1.444 0 CA-C-N 125.556 3.02 . . . . 0.0 116.03 -169.995 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.563 ' HG2' ' CD2' ' A' ' 6' ' ' TYR . 49.5 Cg_endo -94.11 -116.92 0.0 OUTLIER 'Trans proline' 0 CA--C 1.548 1.221 1 C-N-CA 126.392 4.728 . . . . 0.0 110.362 179.592 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . 0.264 63.9 p-90 -87.06 -57.09 3.09 Favored 'General case' 0 C--N 1.384 2.093 0 C-N-CA 127.977 2.511 . . . . 0.0 115.234 176.249 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.563 ' CD2' ' HG2' ' A' ' 4' ' ' PRO . 0.1 OUTLIER -48.44 -7.77 0.02 OUTLIER 'General case' 0 C--N 1.363 1.162 1 C-N-CA 132.255 4.222 . . . . 0.0 120.663 -174.683 . . . . . . . . 4 4 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.414 ' O ' ' HB2' ' A' ' 27' ' ' TRP . 4.1 m -103.09 -31.67 10.06 Favored 'General case' 0 N--CA 1.442 -0.868 0 N-CA-C 106.829 -1.545 . . . . 0.0 106.829 -177.331 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 26.0 mtmt -98.27 20.77 11.95 Favored 'General case' 0 C--N 1.364 1.231 0 C-N-CA 128.904 2.881 . . . . 0.0 113.206 -175.181 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -104.94 126.36 31.31 Favored Pre-proline 0 C--N 1.362 1.131 0 CA-C-O 115.645 -2.121 . . . . 0.0 108.558 -176.763 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 30.5 Cg_exo -77.19 156.02 33.35 Favored 'Trans proline' 0 C--N 1.374 1.872 0 C-N-CA 125.23 3.954 . . . . 0.0 113.689 -167.22 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 9.4 p -72.52 134.12 30.44 Favored 'Isoleucine or valine' 0 C--N 1.37 1.483 0 N-CA-C 117.966 2.58 . . . . 0.0 117.966 178.379 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.684 ' NE ' HH21 ' A' ' 46' ' ' ARG . 0.0 OUTLIER -106.08 -176.72 3.16 Favored 'General case' 0 C--N 1.355 0.846 0 C-N-CA 129.109 2.964 . . . . 0.0 109.741 179.069 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.451 0.6 OUTLIER -155.49 -55.42 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.355 0.812 0 C-N-CA 126.133 1.773 . . . . 0.0 112.95 162.996 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 77.11 -152.26 39.91 Favored Glycine 0 C--N 1.366 2.232 0 CA-C-N 119.506 1.048 . . . . 0.0 114.245 -174.152 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 18.5 m -176.66 134.73 0.22 Allowed 'General case' 0 CA--C 1.504 -0.804 1 N-CA-C 100.163 -4.014 . . . . 0.0 100.163 175.73 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -176.03 -63.77 0.01 OUTLIER 'General case' 0 C--N 1.354 0.775 0 CA-C-O 123.066 1.412 . . . . 0.0 109.401 -175.68 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 29.7 mmmt -105.29 -98.46 0.33 Allowed 'General case' 0 C--N 1.352 0.705 0 CA-C-N 113.653 -1.612 . . . . 0.0 112.051 -173.738 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 13.6 tptp -147.78 166.41 27.62 Favored 'General case' 0 N--CA 1.439 -1.0 1 N-CA-C 99.094 -4.41 . . . . 0.0 99.094 -177.369 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 3.2 mm100 -93.07 120.22 33.13 Favored 'General case' 0 C--N 1.356 0.866 0 N-CA-C 107.24 -1.392 . . . . 0.0 107.24 178.13 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 29.5 m-85 -109.49 131.27 55.22 Favored 'General case' 0 C--N 1.355 0.806 0 O-C-N 121.033 -1.042 . . . . 0.0 108.271 -179.002 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . 0.444 ' HA ' ' HG ' ' A' ' 36' ' ' LEU . 8.2 t -68.08 127.43 32.85 Favored 'General case' 0 C--N 1.375 1.701 0 CA-C-N 120.708 1.594 . . . . 0.0 115.121 -176.863 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 90.5 p -125.5 -159.62 0.91 Allowed 'General case' 0 C--N 1.348 0.501 0 C-N-CA 126.188 1.795 . . . . 0.0 112.451 -176.544 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 95.4 m-85 -146.94 132.35 18.59 Favored 'General case' 0 C--N 1.366 1.298 0 C-N-CA 129.646 3.178 . . . . 0.0 108.302 176.663 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 7.7 p90 -130.02 154.63 47.22 Favored 'General case' 0 C--N 1.363 1.183 0 CA-C-N 120.692 1.587 . . . . 0.0 107.746 169.757 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 7.8 t80 -102.94 127.47 50.14 Favored 'General case' 0 C--N 1.36 1.04 0 N-CA-C 105.652 -1.981 . . . . 0.0 105.652 -179.768 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 16.8 tptp -109.12 111.35 22.92 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 120.875 -1.14 . . . . 0.0 110.153 -178.058 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . 0.414 ' HB2' ' O ' ' A' ' 7' ' ' CYS . 33.7 t-105 -33.98 -58.08 0.45 Allowed 'General case' 0 C--N 1.369 1.453 0 N-CA-C 120.494 3.516 . . . . 0.0 120.494 176.551 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 2.0 p -80.27 -5.92 57.05 Favored 'General case' 0 C--N 1.363 1.173 0 C-N-CA 126.524 1.93 . . . . 0.0 113.868 -179.564 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -94.88 -39.67 10.11 Favored 'General case' 0 C--N 1.363 1.194 0 C-N-CA 124.663 1.185 . . . . 0.0 109.94 173.924 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 11.7 tptm 78.09 17.95 1.19 Allowed 'General case' 0 C--N 1.373 1.619 0 C-N-CA 128.44 2.696 . . . . 0.0 112.241 179.079 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 56.8 mtmt -138.0 167.27 22.12 Favored 'General case' 0 C--N 1.354 0.789 0 C-N-CA 128.469 2.707 . . . . 0.0 110.637 -175.567 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 87.9 m -93.17 119.29 32.2 Favored 'General case' 0 C--N 1.365 1.249 0 C-N-CA 129.528 3.131 . . . . 0.0 111.291 179.434 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 58.3 mt -110.48 139.31 21.42 Favored Pre-proline 0 C--N 1.35 0.591 0 O-C-N 119.949 -1.72 . . . . 0.0 109.788 -179.882 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -87.89 104.62 0.53 Allowed 'Trans proline' 0 N--CA 1.462 -0.346 0 C-N-CA 124.163 3.242 . . . . 0.0 112.12 -178.92 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 1.1 p90 -98.8 -177.95 3.81 Favored 'General case' 0 C--N 1.359 0.982 0 N-CA-C 107.218 -1.401 . . . . 0.0 107.218 173.782 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.444 ' HG ' ' HA ' ' A' ' 21' ' ' SER . 6.8 mp -118.65 145.04 45.77 Favored 'General case' 0 CA--C 1.507 -0.684 0 O-C-N 119.251 -2.156 . . . . 0.0 105.896 176.092 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 25.9 t80 -106.86 138.67 42.59 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 126.408 1.883 . . . . 0.0 110.164 177.851 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 2.7 m -92.85 -5.33 51.21 Favored 'General case' 0 C--N 1.376 1.724 0 N-CA-C 116.475 2.028 . . . . 0.0 116.475 178.073 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 105.82 -58.18 0.46 Allowed Glycine 0 C--N 1.366 2.245 0 CA-C-N 120.415 1.461 . . . . 0.0 115.71 -176.764 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 3.3 m -116.02 134.64 54.74 Favored 'General case' 0 C--N 1.354 0.781 0 N-CA-C 104.323 -2.473 . . . . 0.0 104.323 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 113.35 -10.61 24.2 Favored Glycine 0 C--N 1.362 2.002 0 CA-C-N 120.591 1.541 . . . . 0.0 112.562 -174.599 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -87.43 126.76 8.14 Favored Glycine 0 C--N 1.361 1.932 0 C-N-CA 125.883 1.706 . . . . 0.0 110.206 168.587 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 42.0 p30 -88.48 -78.49 0.33 Allowed 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 127.272 2.229 . . . . 0.0 115.307 -179.52 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -136.84 -27.11 1.02 Allowed 'General case' 0 C--N 1.362 1.151 0 N-CA-C 117.53 2.419 . . . . 0.0 117.53 -176.165 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 55.8 t30 -109.45 78.49 1.14 Allowed 'General case' 0 CA--C 1.55 0.958 0 N-CA-C 117.962 2.578 . . . . 0.0 117.962 -170.635 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.684 HH21 ' NE ' ' A' ' 12' ' ' ARG 0.445 0.2 OUTLIER -146.34 147.96 31.88 Favored 'General case' 0 C--N 1.366 1.312 0 CA-C-N 123.902 3.046 . . . . 0.0 112.67 168.007 . . . . . . . . 4 4 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 7.2 m-85 -108.05 139.08 43.21 Favored 'General case' 0 C--N 1.368 1.409 0 C-N-CA 127.428 2.291 . . . . 0.0 112.416 -168.458 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -81.96 -24.63 35.42 Favored 'General case' 0 C--N 1.374 1.642 0 C-N-CA 126.311 1.844 . . . . 0.0 115.367 -179.61 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 57.3 p -139.54 163.94 31.22 Favored 'General case' 0 C--N 1.36 1.037 0 N-CA-C 105.599 -2.0 . . . . 0.0 105.599 176.519 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 14.1 tt -64.61 -21.52 29.4 Favored 'Isoleucine or valine' 0 C--N 1.367 1.354 0 C-N-CA 126.817 2.047 . . . . 0.0 116.191 179.489 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -84.43 -13.37 73.58 Favored Glycine 0 C--N 1.365 2.148 0 C-N-CA 126.05 1.786 . . . . 0.0 114.618 -179.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -82.76 -12.69 57.33 Favored 'General case' 0 C--N 1.366 1.319 0 O-C-N 120.823 -1.398 . . . . 0.0 111.61 174.577 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 14.9 t -72.71 -48.1 41.54 Favored 'General case' 0 C--N 1.361 1.107 0 C-N-CA 127.628 2.371 . . . . 0.0 112.755 178.045 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 11.0 mtp180 -69.99 -33.16 71.68 Favored 'General case' 0 C--N 1.346 0.424 1 C-N-CA 132.778 4.431 . . . . 0.0 112.994 173.699 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 31.5 ttmt -69.84 -36.94 75.99 Favored 'General case' 0 C--N 1.369 1.421 0 C-N-CA 126.825 2.05 . . . . 0.0 113.213 178.83 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 6.0 mtmm -89.09 -31.64 17.92 Favored 'General case' 0 C--N 1.367 1.366 0 C-N-CA 124.918 1.287 . . . . 0.0 111.91 172.88 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 56.4 m -127.33 8.85 6.59 Favored 'General case' 0 C--N 1.365 1.247 0 N-CA-C 121.558 3.91 . . . . 0.0 121.558 -173.557 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 14.1 mt -136.54 -32.41 0.83 Allowed 'General case' 0 C--N 1.359 1.018 1 CA-C-N 126.984 4.447 . . . . 0.0 115.228 169.392 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 86.46 55.31 2.48 Favored Glycine 0 C--N 1.359 1.827 0 CA-C-N 119.577 1.08 . . . . 0.0 112.279 -169.634 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 1.3 ptpp? . . . . . 0 C--O 1.258 1.527 0 N-CA-C 103.264 -2.865 . . . . 0.0 103.264 -176.594 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 3.4 t90 . . . . . 0 N--CA 1.433 -1.299 0 N-CA-C 105.996 -1.853 . . . . 0.0 105.996 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 30.4 mt-30 -136.38 144.86 49.35 Favored Pre-proline 0 N--CA 1.443 -0.789 0 N-CA-C 100.322 -3.955 . . . . 0.0 100.322 173.585 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.41 ' HA ' ' HD3' ' A' ' 4' ' ' PRO . 47.1 Cg_endo -76.0 125.83 8.92 Favored 'Trans proline' 0 CA--C 1.558 1.701 0 C-N-CA 123.369 2.712 . . . . 0.0 114.5 -168.461 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.498 ' HG2' ' CD2' ' A' ' 6' ' ' TYR . 40.5 Cg_endo -96.59 -114.38 0.0 OUTLIER 'Trans proline' 0 CA--C 1.547 1.168 1 C-N-CA 126.886 5.058 . . . . 0.0 111.345 -176.395 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . 0.506 ' CE3' ' CD1' ' A' ' 6' ' ' TYR 0.29 45.9 p-90 -86.74 -69.71 0.66 Allowed 'General case' 0 C--N 1.382 1.998 0 C-N-CA 127.623 2.369 . . . . 0.0 114.867 178.469 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.506 ' CD1' ' CE3' ' A' ' 5' ' ' TRP . 0.1 OUTLIER -33.14 -45.09 0.13 Allowed 'General case' 0 C--N 1.36 1.046 1 C-N-CA 132.995 4.518 . . . . 0.0 119.137 -173.397 . . . . . . . . 4 4 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.6 m -65.84 -41.79 91.31 Favored 'General case' 0 N--CA 1.448 -0.57 0 C-N-CA 128.235 2.614 . . . . 0.0 112.148 -179.827 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 44.2 mtpt -93.95 -7.97 41.42 Favored 'General case' 0 C--N 1.363 1.154 0 C-N-CA 129.073 2.949 . . . . 0.0 112.368 -179.278 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.437 ' HA ' ' HD3' ' A' ' 10' ' ' PRO . 0.6 OUTLIER -80.89 123.44 82.23 Favored Pre-proline 0 C--N 1.363 1.183 0 CA-C-O 116.326 -1.797 . . . . 0.0 112.738 -172.676 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.437 ' HD3' ' HA ' ' A' ' 9' ' ' GLU . 50.7 Cg_exo -70.86 147.78 56.5 Favored 'Trans proline' 0 CA--C 1.54 0.779 0 C-N-CA 123.525 2.817 . . . . 0.0 115.479 -163.801 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 3.5 p -78.8 131.99 33.21 Favored 'Isoleucine or valine' 0 C--N 1.363 1.177 0 C-N-CA 125.375 1.47 . . . . 0.0 110.659 176.236 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 38.3 mtt-85 -136.23 152.03 50.31 Favored 'General case' 0 C--N 1.359 0.995 0 N-CA-C 106.408 -1.701 . . . . 0.0 106.408 -173.812 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.385 14.5 tt -125.18 -54.03 2.14 Favored 'Isoleucine or valine' 0 C--N 1.375 1.706 0 CA-C-N 120.988 1.722 . . . . 0.0 112.733 179.209 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.434 ' HA2' ' HA3' ' A' ' 41' ' ' GLY . . . 146.31 -163.78 28.4 Favored Glycine 0 C--N 1.357 1.716 0 CA-C-N 119.564 1.074 . . . . 0.0 112.168 173.84 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 75.6 m -150.66 52.65 0.88 Allowed 'General case' 0 C--N 1.355 0.818 0 N-CA-C 105.8 -1.926 . . . . 0.0 105.8 176.806 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 7.6 m -143.35 -172.35 3.68 Favored 'General case' 0 C--N 1.358 0.969 1 C-N-CA 132.253 4.221 . . . . 0.0 103.965 -179.403 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 64.7 mmtt -131.29 80.32 1.93 Allowed 'General case' 0 C--N 1.358 0.953 0 C-N-CA 125.55 1.54 . . . . 0.0 111.851 -177.512 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.491 ' NZ ' ' H ' ' A' ' 19' ' ' GLN . 4.8 tptp -149.91 154.7 38.74 Favored 'General case' 0 C--N 1.347 0.498 0 N-CA-C 104.898 -2.26 . . . . 0.0 104.898 177.957 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.491 ' H ' ' NZ ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -145.82 102.22 3.64 Favored 'General case' 0 C--N 1.358 0.949 0 O-C-N 119.433 -2.042 . . . . 0.0 109.721 174.261 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 58.4 m-85 -93.71 147.21 23.25 Favored 'General case' 0 C--N 1.358 0.962 0 C-N-CA 127.644 2.378 . . . . 0.0 108.168 175.304 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 3.8 t -72.88 114.01 10.55 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 126.324 1.85 . . . . 0.0 115.175 -176.703 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 88.0 p -129.96 161.71 30.3 Favored 'General case' 0 C--N 1.367 1.327 0 N-CA-C 114.679 1.363 . . . . 0.0 114.679 -178.952 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . 0.413 ' HB2' ' HB2' ' A' ' 47' ' ' PHE . 91.8 m-85 -135.97 148.16 48.34 Favored 'General case' 0 CA--C 1.51 -0.594 0 N-CA-C 107.392 -1.336 . . . . 0.0 107.392 176.224 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 2.6 p90 -137.72 153.8 49.72 Favored 'General case' 0 C--N 1.358 0.945 0 C-N-CA 125.751 1.62 . . . . 0.0 108.996 176.183 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 15.7 t80 -96.32 135.81 37.66 Favored 'General case' 0 C--N 1.362 1.137 0 O-C-N 120.727 -1.233 . . . . 0.0 108.353 178.429 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.63 102.97 14.86 Favored 'General case' 0 N--CA 1.441 -0.914 0 O-C-N 121.799 -0.563 . . . . 0.0 110.813 178.882 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 10.6 t-105 -39.68 -47.02 1.95 Allowed 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 130.061 3.345 . . . . 0.0 118.196 169.484 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . 0.278 4.0 p -86.48 -23.23 26.04 Favored 'General case' 0 C--N 1.363 1.169 0 CA-C-O 118.147 -0.93 . . . . 0.0 112.774 176.875 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -82.07 -37.09 26.92 Favored 'General case' 0 C--N 1.376 1.753 0 CA-C-N 121.884 2.129 . . . . 0.0 114.854 173.705 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . 0.292 0.8 OUTLIER 81.96 22.28 0.27 Allowed 'General case' 0 C--N 1.371 1.503 0 C-N-CA 127.876 2.471 . . . . 0.0 111.8 -177.153 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 53.5 mtmt -143.94 169.68 17.34 Favored 'General case' 0 C--N 1.357 0.897 0 C-N-CA 127.174 2.189 . . . . 0.0 108.712 -177.182 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 80.0 m -91.52 145.24 24.78 Favored 'General case' 0 C--N 1.357 0.899 0 C-N-CA 127.108 2.163 . . . . 0.0 112.414 -179.452 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 31.2 mt -123.65 145.01 45.95 Favored Pre-proline 0 C--N 1.36 1.035 0 C-N-CA 125.374 1.47 . . . . 0.0 111.013 176.667 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -86.55 145.12 7.97 Favored 'Trans proline' 0 C--N 1.348 0.513 0 C-N-CA 124.492 3.462 . . . . 0.0 111.842 169.603 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . 0.273 13.5 p90 -141.27 -160.03 1.03 Allowed 'General case' 0 C--N 1.344 0.332 0 N-CA-C 105.787 -1.931 . . . . 0.0 105.787 170.896 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 58.5 mt -141.56 154.5 45.5 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 104.756 -2.313 . . . . 0.0 104.756 175.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 3.3 t80 -115.46 129.11 56.45 Favored 'General case' 0 CA--C 1.567 1.628 0 C-N-CA 125.457 1.503 . . . . 0.0 110.767 177.833 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 49.1 m -98.73 16.06 23.34 Favored 'General case' 0 C--N 1.382 2.01 0 N-CA-C 115.262 1.579 . . . . 0.0 115.262 -178.766 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 76.53 -56.47 3.36 Favored Glycine 0 C--N 1.352 1.469 0 O-C-N 120.133 -1.604 . . . . 0.0 116.257 178.936 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 14.4 m -79.45 34.23 0.26 Allowed 'General case' 0 C--N 1.358 0.954 0 C-N-CA 127.574 2.35 . . . . 0.0 115.666 179.744 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.434 ' HA3' ' HA2' ' A' ' 14' ' ' GLY . . . 173.17 49.67 0.05 OUTLIER Glycine 0 CA--C 1.482 -1.976 0 O-C-N 120.556 -1.34 . . . . 0.0 114.078 174.607 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -104.53 128.06 9.32 Favored Glycine 0 C--N 1.354 1.572 0 N-CA-C 109.432 -1.467 . . . . 0.0 109.432 169.797 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 45.6 p30 -77.33 -57.5 3.8 Favored 'General case' 0 C--N 1.361 1.099 0 N-CA-C 116.331 1.974 . . . . 0.0 116.331 -178.668 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -177.35 -21.95 0.01 OUTLIER 'General case' 0 C--N 1.354 0.778 0 C-N-CA 126.886 2.074 . . . . 0.0 111.926 -178.286 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 39.3 t30 -96.96 89.24 4.77 Favored 'General case' 0 CA--C 1.555 1.146 0 O-C-N 119.283 -2.136 . . . . 0.0 116.416 -174.247 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . 0.355 0.0 OUTLIER -150.42 129.64 12.78 Favored 'General case' 0 C--N 1.355 0.833 0 O-C-N 120.689 -1.257 . . . . 0.0 110.42 168.033 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . 0.413 ' HB2' ' HB2' ' A' ' 23' ' ' PHE . 27.0 m-85 -99.89 150.98 21.83 Favored 'General case' 0 N--CA 1.447 -0.587 0 C-N-CA 126.46 1.904 . . . . 0.0 106.683 175.807 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -78.33 -38.33 42.46 Favored 'General case' 0 C--N 1.363 1.162 0 C-N-CA 125.718 1.607 . . . . 0.0 113.163 -178.299 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 75.5 p -129.95 165.31 22.36 Favored 'General case' 0 C--N 1.357 0.923 0 C-N-CA 125.189 1.395 . . . . 0.0 107.324 175.518 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 13.0 tt -71.98 -10.16 13.66 Favored 'Isoleucine or valine' 0 C--N 1.363 1.185 0 C-N-CA 126.501 1.92 . . . . 0.0 114.673 175.088 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -91.25 -10.62 62.11 Favored Glycine 0 C--N 1.365 2.181 0 O-C-N 120.178 -1.576 . . . . 0.0 114.101 176.664 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 -86.13 -41.16 14.96 Favored 'General case' 0 C--N 1.364 1.228 0 C-N-CA 125.81 1.644 . . . . 0.0 110.887 174.326 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . 0.258 4.1 t -42.51 -47.45 5.1 Favored 'General case' 0 C--N 1.365 1.267 0 C-N-CA 128.952 2.901 . . . . 0.0 116.306 -175.908 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 10.0 ptt180 -69.42 -19.79 63.79 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 129.646 3.178 . . . . 0.0 117.37 174.671 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 8.6 mptt -79.84 -6.12 56.76 Favored 'General case' 0 C--N 1.375 1.694 0 O-C-N 119.493 -2.005 . . . . 0.0 113.495 178.193 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.423 ' HD3' ' CE1' ' A' ' 6' ' ' TYR . 5.6 mtmm -111.16 -21.78 11.76 Favored 'General case' 0 C--N 1.354 0.773 0 O-C-N 120.32 -1.487 . . . . 0.0 110.38 176.816 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 57.4 m -131.3 8.38 4.66 Favored 'General case' 0 C--N 1.364 1.224 0 N-CA-C 116.736 2.125 . . . . 0.0 116.736 -171.0 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 11.6 mt -130.91 -13.51 3.6 Favored 'General case' 0 N--CA 1.476 0.85 0 CA-C-N 123.64 2.927 . . . . 0.0 111.675 172.528 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 73.52 59.68 4.04 Favored Glycine 0 C--N 1.359 1.828 0 C-N-CA 127.999 2.714 . . . . 0.0 112.863 -169.601 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 19.2 mtpt . . . . . 0 C--O 1.262 1.762 0 C-N-CA 124.721 1.208 . . . . 0.0 107.767 -178.83 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' TRP . . . . . 0.458 ' CZ2' ' HB3' ' A' ' 3' ' ' PRO . 4.4 t90 . . . . . 0 N--CA 1.433 -1.298 0 N-CA-C 107.456 -1.313 . . . . 0.0 107.456 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 25.0 mm-40 -147.57 150.66 37.54 Favored Pre-proline 0 C--N 1.351 0.669 1 N-CA-C 98.281 -4.711 . . . . 0.0 98.281 173.674 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.48 ' HB2' ' HD2' ' A' ' 8' ' ' LYS . 66.2 Cg_endo -82.65 123.08 3.65 Favored 'Trans proline' 0 CA--C 1.558 1.717 0 CA-C-N 124.168 2.524 . . . . 0.0 114.906 -165.194 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.451 ' HD3' ' HA ' ' A' ' 3' ' ' PRO . 27.7 Cg_exo -73.79 -110.31 0.01 OUTLIER 'Trans proline' 0 C--N 1.365 1.416 1 C-N-CA 126.96 5.107 . . . . 0.0 112.827 173.088 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . 0.55 ' CE3' ' CD2' ' A' ' 6' ' ' TYR 0.298 17.5 p-90 -88.91 -76.52 0.4 Allowed 'General case' 0 C--N 1.375 1.687 0 N-CA-C 116.419 2.007 . . . . 0.0 116.419 178.968 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.55 ' CD2' ' CE3' ' A' ' 5' ' ' TRP . 0.0 OUTLIER -29.65 -51.88 0.12 Allowed 'General case' 0 C--N 1.36 1.062 1 C-N-CA 135.173 5.389 . . . . 0.0 118.404 -171.391 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.425 ' O ' ' HB2' ' A' ' 27' ' ' TRP . 0.0 OUTLIER -53.12 -41.65 65.25 Favored 'General case' 0 N--CA 1.443 -0.795 1 C-N-CA 131.732 4.013 . . . . 0.0 112.503 178.739 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.48 ' HD2' ' HB2' ' A' ' 3' ' ' PRO . 0.0 OUTLIER -108.82 17.56 21.7 Favored 'General case' 0 C--N 1.367 1.362 0 C-N-CA 127.366 2.266 . . . . 0.0 111.702 -178.451 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.434 ' HA ' ' HD3' ' A' ' 10' ' ' PRO . 4.4 tp10 -93.61 133.11 28.61 Favored Pre-proline 0 C--N 1.361 1.108 0 CA-C-O 116.488 -1.72 . . . . 0.0 112.041 -173.172 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.434 ' HD3' ' HA ' ' A' ' 9' ' ' GLU . 51.9 Cg_exo -70.24 125.95 12.45 Favored 'Trans proline' 0 CA--C 1.54 0.797 0 CA-C-N 125.276 2.92 . . . . 0.0 116.23 -164.73 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 10.1 p -68.9 139.73 20.04 Favored 'Isoleucine or valine' 0 C--N 1.367 1.339 0 C-N-CA 127.453 2.301 . . . . 0.0 114.041 178.582 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 61.8 mtt180 -145.73 120.61 9.97 Favored 'General case' 0 C--N 1.368 1.408 0 C-N-CA 126.297 1.839 . . . . 0.0 111.643 -173.487 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 14.4 tt -88.84 -32.33 5.8 Favored 'Isoleucine or valine' 0 C--N 1.371 1.532 0 CA-C-N 121.245 1.839 . . . . 0.0 113.783 179.691 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 92.89 -69.48 1.64 Allowed Glycine 0 C--N 1.351 1.393 0 C-N-CA 126.139 1.828 . . . . 0.0 115.279 179.902 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.457 ' H ' ' HB3' ' A' ' 38' ' ' SER . 70.8 m 76.12 67.6 0.06 Allowed 'General case' 0 C--N 1.366 1.313 0 C-N-CA 127.714 2.405 . . . . 0.0 110.525 -173.118 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 60.4 m -125.26 -63.05 1.17 Allowed 'General case' 0 N--CA 1.442 -0.838 0 CA-C-O 122.449 1.118 . . . . 0.0 109.92 -178.446 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 34.3 mmtm -90.79 -86.27 0.21 Allowed 'General case' 0 C--N 1.349 0.546 0 C-N-CA 127.342 2.257 . . . . 0.0 116.064 -170.307 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 53.8 tptt -147.87 -169.34 3.31 Favored 'General case' 0 C--N 1.35 0.597 0 N-CA-C 101.682 -3.451 . . . . 0.0 101.682 -177.718 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -118.54 105.52 11.73 Favored 'General case' 0 C--N 1.353 0.734 0 N-CA-C 106.488 -1.671 . . . . 0.0 106.488 173.181 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 22.5 m-85 -96.56 144.35 26.71 Favored 'General case' 0 C--N 1.362 1.116 0 C-N-CA 126.564 1.946 . . . . 0.0 109.77 -177.698 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 7.0 t -69.76 113.31 6.89 Favored 'General case' 0 C--N 1.369 1.441 0 N-CA-C 115.488 1.662 . . . . 0.0 115.488 -178.288 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 78.3 p -120.7 -166.25 1.31 Allowed 'General case' 0 C--N 1.359 0.988 0 C-N-CA 126.321 1.849 . . . . 0.0 113.431 -179.396 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 29.6 m-85 -148.35 149.58 32.05 Favored 'General case' 0 C--N 1.359 0.986 1 C-N-CA 131.877 4.071 . . . . 0.0 109.008 174.487 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 10.5 p90 -144.11 150.8 38.69 Favored 'General case' 0 C--N 1.362 1.113 0 C-N-CA 127.96 2.504 . . . . 0.0 110.986 175.685 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 9.2 t80 -98.24 119.1 36.32 Favored 'General case' 0 C--N 1.381 1.951 0 N-CA-C 106.916 -1.512 . . . . 0.0 106.916 177.071 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 9.4 tptt -103.74 110.44 22.54 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 125.538 1.535 . . . . 0.0 109.124 -179.256 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . 0.425 ' HB2' ' O ' ' A' ' 7' ' ' CYS . 33.2 t-105 -44.99 -49.88 10.98 Favored 'General case' 0 C--N 1.362 1.142 0 C-N-CA 131.14 3.776 . . . . 0.0 117.695 176.502 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 10.8 p -82.46 3.75 26.99 Favored 'General case' 0 C--N 1.36 1.059 0 C-N-CA 125.973 1.709 . . . . 0.0 113.617 -179.565 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -107.25 -46.49 3.87 Favored 'General case' 0 C--N 1.357 0.929 0 C-N-CA 125.604 1.562 . . . . 0.0 108.49 173.114 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . 0.309 0.2 OUTLIER 81.11 24.6 0.27 Allowed 'General case' 0 C--N 1.367 1.346 0 C-N-CA 128.845 2.858 . . . . 0.0 112.352 179.098 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 83.0 tttt -149.82 163.83 36.97 Favored 'General case' 0 N--CA 1.441 -0.902 0 N-CA-C 106.178 -1.786 . . . . 0.0 106.178 179.573 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 89.6 m -79.27 130.07 35.09 Favored 'General case' 0 C--N 1.358 0.957 0 C-N-CA 128.169 2.588 . . . . 0.0 113.927 175.805 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 80.8 mt -120.87 147.9 47.25 Favored Pre-proline 0 C--N 1.355 0.807 0 C-N-CA 124.591 1.157 . . . . 0.0 110.172 179.883 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -85.87 125.14 2.7 Favored 'Trans proline' 0 C--N 1.351 0.666 0 C-N-CA 124.454 3.436 . . . . 0.0 111.587 173.248 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -114.87 -168.86 1.44 Allowed 'General case' 0 C--N 1.354 0.764 0 N-CA-C 103.962 -2.607 . . . . 0.0 103.962 167.34 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 19.6 mt -119.25 155.82 31.05 Favored 'General case' 0 N--CA 1.441 -0.922 0 O-C-N 119.324 -2.11 . . . . 0.0 106.493 175.248 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 22.0 t80 -117.69 137.36 52.72 Favored 'General case' 0 N--CA 1.471 0.611 0 O-C-N 121.055 -1.028 . . . . 0.0 110.187 175.295 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . 0.457 ' HB3' ' H ' ' A' ' 15' ' ' SER . 2.8 t -111.78 37.13 3.03 Favored 'General case' 0 C--N 1.375 1.715 0 N-CA-C 114.758 1.392 . . . . 0.0 114.758 175.721 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 72.29 -45.25 0.96 Allowed Glycine 0 C--N 1.36 1.897 0 N-CA-C 121.329 3.292 . . . . 0.0 121.329 161.986 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -116.43 165.94 12.64 Favored 'General case' 0 C--N 1.347 0.487 0 C-N-CA 126.694 1.998 . . . . 0.0 105.654 173.869 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 90.26 -33.63 4.45 Favored Glycine 0 N--CA 1.484 1.89 0 O-C-N 119.565 -1.959 . . . . 0.0 116.027 177.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -60.59 -174.51 1.11 Allowed Glycine 0 C--N 1.37 2.43 0 N-CA-C 120.696 3.039 . . . . 0.0 120.696 179.76 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . 0.531 ' H ' ' NH1' ' A' ' 46' ' ' ARG 0.272 26.2 p30 -136.39 -103.78 0.21 Allowed 'General case' 0 C--N 1.355 0.813 0 O-C-N 120.779 -1.424 . . . . 0.0 112.818 -179.648 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -155.33 5.03 0.21 Allowed 'General case' 0 C--N 1.35 0.627 0 O-C-N 120.873 -1.142 . . . . 0.0 113.271 -173.672 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 49.3 t30 -95.88 53.55 1.42 Allowed 'General case' 0 C--N 1.365 1.241 0 O-C-N 118.766 -2.459 . . . . 0.0 108.172 175.109 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.531 ' NH1' ' H ' ' A' ' 43' ' ' ASN . 0.0 OUTLIER -139.94 144.25 37.0 Favored 'General case' 0 N--CA 1.443 -0.798 0 N-CA-C 107.862 -1.162 . . . . 0.0 107.862 -177.463 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 52.8 m-85 -131.1 134.01 46.19 Favored 'General case' 0 N--CA 1.449 -0.494 0 C-N-CA 127.705 2.402 . . . . 0.0 107.358 -169.856 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.69 -16.93 61.67 Favored 'General case' 0 C--N 1.373 1.625 0 N-CA-C 116.699 2.111 . . . . 0.0 116.699 -177.35 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 40.9 p -146.29 -176.97 5.38 Favored 'General case' 0 C--N 1.352 0.685 0 N-CA-C 103.752 -2.684 . . . . 0.0 103.752 177.267 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 15.0 tt -76.59 -27.07 16.89 Favored 'Isoleucine or valine' 0 C--N 1.367 1.343 0 O-C-N 120.081 -1.637 . . . . 0.0 114.072 175.794 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -90.4 20.57 36.91 Favored Glycine 0 C--N 1.365 2.185 0 O-C-N 120.598 -1.314 . . . . 0.0 115.486 -171.688 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -112.87 -14.77 13.02 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 126.82 2.048 . . . . 0.0 108.587 171.51 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 15.9 t -87.07 -43.29 12.42 Favored 'General case' 0 C--N 1.361 1.067 0 C-N-CA 126.989 2.116 . . . . 0.0 115.748 -174.775 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . 0.301 0.0 OUTLIER -82.51 -24.75 33.98 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 126.623 1.969 . . . . 0.0 115.07 -175.546 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 28.2 ttmt -71.88 -15.98 62.12 Favored 'General case' 0 C--N 1.357 0.925 0 C-N-CA 127.497 2.319 . . . . 0.0 115.564 176.61 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.444 ' HD2' ' CD2' ' A' ' 6' ' ' TYR . 9.3 mtmm -100.81 -24.9 14.29 Favored 'General case' 0 C--N 1.36 1.058 0 C-N-CA 126.31 1.844 . . . . 0.0 112.357 175.458 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 43.6 m -137.54 26.68 2.82 Favored 'General case' 0 C--N 1.355 0.825 0 N-CA-C 116.935 2.198 . . . . 0.0 116.935 -167.305 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 16.7 mt -146.0 -23.73 0.45 Allowed 'General case' 0 N--CA 1.471 0.625 0 CA-C-N 120.546 1.521 . . . . 0.0 112.396 170.924 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 82.43 63.26 1.79 Allowed Glycine 0 C--N 1.36 1.904 0 C-N-CA 128.561 2.981 . . . . 0.0 112.576 -168.323 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 14.0 ptmt . . . . . 0 C--O 1.258 1.55 0 CA-C-O 116.284 -1.817 . . . . 0.0 106.723 -176.088 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 70.0 t90 . . . . . 0 N--CA 1.433 -1.281 0 N-CA-C 106.541 -1.651 . . . . 0.0 106.541 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 68.1 mt-30 -144.11 152.32 54.34 Favored Pre-proline 0 CA--C 1.512 -0.489 1 N-CA-C 97.996 -4.816 . . . . 0.0 97.996 172.352 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.486 ' HA ' ' HD3' ' A' ' 4' ' ' PRO . 1.5 Cg_endo -79.83 122.16 4.8 Favored 'Trans proline' 0 N--CA 1.452 -0.956 0 CA-C-N 124.207 2.538 . . . . 0.0 112.618 -170.351 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.486 ' HD3' ' HA ' ' A' ' 3' ' ' PRO . 16.2 Cg_exo -85.25 -116.08 0.01 OUTLIER 'Trans proline' 0 C--N 1.359 1.103 0 C-N-CA 124.913 3.742 . . . . 0.0 111.185 179.677 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . 0.501 ' CE2' ' CE2' ' A' ' 6' ' ' TYR . 42.6 p-90 -81.72 -72.53 0.43 Allowed 'General case' 0 C--N 1.375 1.68 0 C-N-CA 124.941 1.296 . . . . 0.0 114.021 -179.746 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.501 ' CE2' ' CE2' ' A' ' 5' ' ' TRP . 0.0 OUTLIER -33.35 -43.89 0.12 Allowed 'General case' 0 C--N 1.361 1.09 1 C-N-CA 134.273 5.029 . . . . 0.0 117.206 -179.853 . . . . . . . . 4 4 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.5 m -83.19 -15.72 49.39 Favored 'General case' 0 N--CA 1.44 -0.956 0 C-N-CA 127.636 2.374 . . . . 0.0 114.173 -173.728 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 67.8 mttm -125.52 32.23 5.37 Favored 'General case' 0 C--N 1.357 0.928 0 C-N-CA 126.892 2.077 . . . . 0.0 105.904 178.537 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 5.9 tm-20 -94.15 141.38 23.54 Favored Pre-proline 0 C--N 1.366 1.3 0 C-N-CA 125.106 1.362 . . . . 0.0 109.862 -176.299 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -89.84 142.37 3.97 Favored 'Trans proline' 0 N--CA 1.448 -1.16 0 C-N-CA 124.858 3.706 . . . . 0.0 108.074 177.609 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . 0.397 3.0 p -77.05 122.32 31.33 Favored 'Isoleucine or valine' 0 C--N 1.362 1.141 0 O-C-N 119.21 -2.182 . . . . 0.0 116.559 -173.659 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.476 ' HB2' HH22 ' A' ' 46' ' ' ARG . 11.0 mtm-85 -102.78 117.73 35.29 Favored 'General case' 0 N--CA 1.443 -0.809 0 C-N-CA 129.855 3.262 . . . . 0.0 109.778 -179.454 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 10.2 tt -90.52 -31.82 5.25 Favored 'Isoleucine or valine' 0 C--N 1.366 1.294 0 CA-C-N 121.103 1.774 . . . . 0.0 111.09 171.535 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 89.09 -64.43 3.33 Favored Glycine 0 C--N 1.358 1.773 0 C-N-CA 123.933 0.778 . . . . 0.0 114.087 -177.621 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . 0.358 86.1 p 78.0 81.73 0.07 Allowed 'General case' 0 C--N 1.359 0.983 0 C-N-CA 127.438 2.295 . . . . 0.0 110.928 -175.479 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 49.2 t -143.77 -80.74 0.19 Allowed 'General case' 0 C--N 1.357 0.898 0 O-C-N 121.263 -0.898 . . . . 0.0 112.863 -171.463 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 38.6 mmtm -86.74 -104.69 0.07 Allowed 'General case' 0 C--N 1.352 0.711 0 C-N-CA 127.104 2.162 . . . . 0.0 115.673 -171.084 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -126.88 151.41 48.44 Favored 'General case' 0 CA--C 1.503 -0.852 0 N-CA-C 100.831 -3.766 . . . . 0.0 100.831 179.245 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 7.1 mm-40 -92.82 113.25 25.47 Favored 'General case' 0 C--N 1.356 0.873 0 N-CA-C 106.699 -1.593 . . . . 0.0 106.699 -178.21 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 67.2 m-85 -106.98 141.85 37.53 Favored 'General case' 0 C--N 1.355 0.845 0 C-N-CA 125.147 1.379 . . . . 0.0 110.674 -174.435 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 24.6 t -70.5 104.62 2.81 Favored 'General case' 0 C--N 1.368 1.389 0 C-N-CA 125.704 1.602 . . . . 0.0 112.686 177.826 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 64.7 p -99.75 -161.17 0.85 Allowed 'General case' 0 C--N 1.349 0.544 0 C-N-CA 125.802 1.641 . . . . 0.0 112.151 177.866 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . 0.453 ' HA ' ' HA ' ' A' ' 34' ' ' PRO . 98.8 m-85 -148.2 132.99 17.96 Favored 'General case' 0 C--N 1.355 0.818 0 C-N-CA 127.237 2.215 . . . . 0.0 105.633 169.69 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 13.2 p90 -125.73 150.36 47.77 Favored 'General case' 0 CA--C 1.516 -0.327 0 C-N-CA 125.676 1.59 . . . . 0.0 109.638 177.414 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 10.8 t80 -91.01 118.97 30.81 Favored 'General case' 0 C--N 1.367 1.369 0 N-CA-C 103.447 -2.797 . . . . 0.0 103.447 176.921 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.94 115.86 27.98 Favored 'General case' 0 N--CA 1.431 -1.413 0 C-N-CA 123.236 0.615 . . . . 0.0 109.727 -176.895 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 48.1 t-105 -51.46 -45.75 62.83 Favored 'General case' 0 C--N 1.366 1.284 0 C-N-CA 128.628 2.771 . . . . 0.0 117.788 -178.324 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 17.3 p -84.75 -3.66 58.69 Favored 'General case' 0 C--N 1.352 0.676 0 C-N-CA 124.64 1.176 . . . . 0.0 113.778 179.922 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -100.79 -45.97 5.3 Favored 'General case' 0 C--N 1.361 1.085 0 C-N-CA 124.641 1.176 . . . . 0.0 113.631 176.675 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . 0.316 67.2 mmtt 85.15 20.55 0.11 Allowed 'General case' 0 C--N 1.368 1.383 0 C-N-CA 128.757 2.823 . . . . 0.0 112.161 -176.312 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.586 ' HZ3' ' H ' ' A' ' 32' ' ' CYS . 2.4 mmmp? -145.64 179.33 7.5 Favored 'General case' 0 C--N 1.355 0.812 0 C-N-CA 128.197 2.599 . . . . 0.0 109.979 -179.771 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.586 ' H ' ' HZ3' ' A' ' 31' ' ' LYS . 73.9 m -105.93 129.51 54.06 Favored 'General case' 0 C--N 1.358 0.977 0 C-N-CA 127.991 2.516 . . . . 0.0 115.085 -171.602 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 59.2 mt -120.37 144.55 38.45 Favored Pre-proline 0 C--N 1.357 0.916 0 O-C-N 119.707 -1.871 . . . . 0.0 110.505 -179.899 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.453 ' HA ' ' HA ' ' A' ' 23' ' ' PHE . 89.3 Cg_endo -81.39 110.19 2.19 Favored 'Trans proline' 0 C--N 1.351 0.677 0 C-N-CA 124.879 3.719 . . . . 0.0 113.797 176.414 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . 0.293 2.8 p90 -102.71 168.59 9.15 Favored 'General case' 0 C--N 1.363 1.175 0 CA-C-O 122.115 0.959 . . . . 0.0 109.751 174.644 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 61.0 mt -94.78 125.3 39.34 Favored 'General case' 0 C--N 1.351 0.634 0 N-CA-C 107.357 -1.349 . . . . 0.0 107.357 174.021 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 5.4 t80 -112.74 137.11 51.54 Favored 'General case' 0 C--N 1.35 0.603 0 C-N-CA 125.333 1.453 . . . . 0.0 109.055 179.31 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -90.77 9.97 27.92 Favored 'General case' 0 C--N 1.371 1.503 0 N-CA-C 116.758 2.132 . . . . 0.0 116.758 -177.318 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 93.4 -44.05 2.47 Favored Glycine 0 C--N 1.361 1.922 0 N-CA-C 119.056 2.383 . . . . 0.0 119.056 168.46 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -124.15 145.7 49.13 Favored 'General case' 0 C--N 1.35 0.603 0 N-CA-C 106.242 -1.762 . . . . 0.0 106.242 175.348 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 117.54 -41.06 2.16 Favored Glycine 0 C--N 1.361 1.932 0 C-N-CA 124.462 1.029 . . . . 0.0 113.744 -179.541 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -67.18 -171.23 4.9 Favored Glycine 0 C--N 1.36 1.878 0 N-CA-C 122.305 3.682 . . . . 0.0 122.305 -176.292 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . 0.475 HD22 ' CZ ' ' A' ' 12' ' ' ARG . 6.8 p30 -124.87 -115.75 0.29 Allowed 'General case' 0 C--N 1.359 1.002 0 C-N-CA 125.201 1.4 . . . . 0.0 111.214 -178.921 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -141.49 19.61 2.21 Favored 'General case' 0 C--N 1.364 1.232 0 O-C-N 119.952 -1.717 . . . . 0.0 112.483 178.271 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . 0.467 ' H ' HH11 ' A' ' 46' ' ' ARG . 49.9 t30 -91.25 36.59 0.93 Allowed 'General case' 0 CA--C 1.564 1.515 0 O-C-N 119.919 -1.738 . . . . 0.0 108.892 172.318 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.476 HH22 ' HB2' ' A' ' 12' ' ' ARG . 0.0 OUTLIER -137.91 97.81 3.5 Favored 'General case' 0 C--N 1.361 1.091 0 C-N-CA 127.839 2.456 . . . . 0.0 105.982 -178.341 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . 0.425 ' HB2' ' HB2' ' A' ' 23' ' ' PHE . 24.7 m-85 -94.24 153.22 18.16 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 111.679 -2.51 . . . . 0.0 111.895 -169.47 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . 0.262 0.0 OUTLIER -68.86 -43.56 75.14 Favored 'General case' 0 C--N 1.376 1.736 0 C-N-CA 125.786 1.635 . . . . 0.0 114.762 -179.806 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 72.2 p -137.88 162.28 34.42 Favored 'General case' 0 C--N 1.351 0.632 0 C-N-CA 127.996 2.518 . . . . 0.0 105.396 177.382 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 15.0 tt -66.45 -11.13 12.64 Favored 'Isoleucine or valine' 0 C--N 1.36 1.054 0 C-N-CA 127.577 2.351 . . . . 0.0 116.324 178.269 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -90.56 -9.09 65.07 Favored Glycine 0 C--N 1.367 2.295 0 C-N-CA 125.532 1.539 . . . . 0.0 114.259 174.385 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 12.8 tt0 -92.72 -14.09 28.45 Favored 'General case' 0 C--N 1.358 0.948 0 C-N-CA 125.304 1.442 . . . . 0.0 112.414 176.875 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 40.6 t -64.97 -41.28 95.58 Favored 'General case' 0 C--N 1.361 1.1 0 C-N-CA 129.137 2.975 . . . . 0.0 114.911 179.791 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 12.0 mtp180 -71.15 -21.41 62.18 Favored 'General case' 0 CA--C 1.532 0.282 1 C-N-CA 134.323 5.049 . . . . 0.0 115.767 178.595 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 49.1 mtmt -82.89 -19.79 36.69 Favored 'General case' 0 C--N 1.36 1.025 0 O-C-N 120.235 -1.541 . . . . 0.0 114.004 -178.796 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 10.6 mtmm -100.4 -30.18 11.98 Favored 'General case' 0 C--N 1.361 1.097 0 C-N-CA 126.711 2.005 . . . . 0.0 109.553 174.241 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . 0.48 ' SG ' ' HB2' ' A' ' 6' ' ' TYR . 96.3 m -124.32 10.08 8.6 Favored 'General case' 0 C--N 1.359 0.989 0 N-CA-C 119.737 3.236 . . . . 0.0 119.737 -172.654 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . 0.259 15.6 mt -131.86 -11.13 3.43 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-N 125.081 3.582 . . . . 0.0 113.065 169.233 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 70.61 52.17 17.2 Favored Glycine 0 C--N 1.365 2.179 0 C-N-CA 128.606 3.003 . . . . 0.0 113.43 -172.869 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 13.6 ptpt . . . . . 0 C--O 1.262 1.725 0 N-CA-C 104.959 -2.238 . . . . 0.0 104.959 -175.064 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 83.4 t90 . . . . . 0 N--CA 1.435 -1.182 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 23.6 mm-40 -147.35 154.58 45.68 Favored Pre-proline 0 C--N 1.352 0.683 1 N-CA-C 98.905 -4.48 . . . . 0.0 98.905 171.45 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.487 ' HA ' ' HD3' ' A' ' 4' ' ' PRO . 3.2 Cg_exo -79.71 118.34 3.81 Favored 'Trans proline' 0 CA--C 1.541 0.844 0 CA-C-N 124.974 2.812 . . . . 0.0 114.335 -167.174 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.487 ' HD3' ' HA ' ' A' ' 3' ' ' PRO . 14.0 Cg_exo -88.63 -109.42 0.0 OUTLIER 'Trans proline' 0 C--N 1.365 1.407 0 C-N-CA 125.045 3.83 . . . . 0.0 110.184 -175.953 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . 0.468 ' CE3' ' CD2' ' A' ' 6' ' ' TYR 0.272 45.1 p-90 -88.25 -72.26 0.54 Allowed 'General case' 0 C--N 1.372 1.558 0 N-CA-C 116.188 1.922 . . . . 0.0 116.188 -179.476 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.499 ' CE2' ' HD3' ' A' ' 56' ' ' LYS . 0.0 OUTLIER -30.85 -49.67 0.13 Allowed 'General case' 0 C--N 1.359 0.981 1 C-N-CA 135.672 5.589 . . . . 0.0 118.182 -175.667 . . . . . . . . 4 4 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.403 ' O ' ' HB2' ' A' ' 27' ' ' TRP . 1.8 m -57.99 -40.96 82.0 Favored 'General case' 0 C--N 1.349 0.572 0 C-N-CA 127.657 2.383 . . . . 0.0 114.116 -176.811 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 24.4 mtpp -105.55 22.26 15.8 Favored 'General case' 0 C--N 1.363 1.163 0 C-N-CA 126.283 1.833 . . . . 0.0 110.255 177.049 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -93.91 123.1 60.49 Favored Pre-proline 0 C--N 1.369 1.439 0 O-C-N 119.685 -1.885 . . . . 0.0 110.295 -174.709 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 80.3 Cg_exo -59.1 124.48 15.74 Favored 'Trans proline' 0 C--N 1.36 1.155 0 C-N-CA 124.758 3.639 . . . . 0.0 116.766 -165.023 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 9.9 p -88.02 126.66 41.45 Favored 'Isoleucine or valine' 0 C--N 1.37 1.479 0 C-N-CA 124.997 1.319 . . . . 0.0 111.328 -179.818 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.62 ' HB2' HH21 ' A' ' 46' ' ' ARG . 32.6 mtt180 -134.76 135.61 42.01 Favored 'General case' 0 N--CA 1.438 -1.047 0 C-N-CA 128.423 2.689 . . . . 0.0 111.158 -175.436 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 11.9 tt -95.41 -39.25 9.62 Favored 'Isoleucine or valine' 0 C--N 1.37 1.487 0 C-N-CA 127.428 2.291 . . . . 0.0 112.58 175.598 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 56.07 -133.85 50.56 Favored Glycine 0 C--N 1.364 2.085 0 C-N-CA 128.022 2.725 . . . . 0.0 116.983 -174.229 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 21.0 m -173.39 134.24 0.52 Allowed 'General case' 0 C--N 1.357 0.919 0 N-CA-C 100.662 -3.829 . . . . 0.0 100.662 179.209 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 31.3 t -167.86 -63.06 0.03 OUTLIER 'General case' 0 C--N 1.352 0.688 0 CA-C-N 120.336 1.425 . . . . 0.0 111.191 -174.867 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt -118.86 -89.18 0.6 Allowed 'General case' 0 C--N 1.347 0.488 0 C-N-CA 125.175 1.39 . . . . 0.0 111.458 -177.082 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 14.5 ptmm? -149.41 170.98 17.32 Favored 'General case' 0 CA--C 1.506 -0.745 0 N-CA-C 103.643 -2.725 . . . . 0.0 103.643 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.6 mm100 -93.27 108.81 20.37 Favored 'General case' 0 C--N 1.358 0.941 0 O-C-N 120.397 -1.439 . . . . 0.0 110.985 -176.577 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 83.1 m-85 -95.34 155.06 16.9 Favored 'General case' 0 C--N 1.354 0.803 0 C-N-CA 126.796 2.038 . . . . 0.0 109.638 -176.2 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 11.3 t -71.08 116.3 11.21 Favored 'General case' 0 C--N 1.369 1.416 0 C-N-CA 127.095 2.158 . . . . 0.0 114.35 -178.589 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 51.5 p -141.58 171.33 14.21 Favored 'General case' 0 C--N 1.353 0.749 0 N-CA-C 114.934 1.457 . . . . 0.0 114.934 -175.038 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 82.2 m-85 -135.88 158.11 45.19 Favored 'General case' 0 C--N 1.354 0.77 0 C-N-CA 128.839 2.856 . . . . 0.0 111.853 177.709 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 23.0 p90 -147.47 156.03 42.47 Favored 'General case' 0 C--N 1.368 1.406 0 C-N-CA 126.412 1.885 . . . . 0.0 110.771 176.029 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . 0.454 ' CD2' ' HB2' ' A' ' 57' ' ' CYS . 5.4 t80 -94.82 128.53 41.63 Favored 'General case' 0 C--N 1.376 1.728 0 N-CA-C 106.334 -1.728 . . . . 0.0 106.334 172.392 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -107.42 113.66 27.16 Favored 'General case' 0 N--CA 1.426 -1.638 0 C-N-CA 126.844 2.058 . . . . 0.0 108.135 -176.709 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . 0.403 ' HB2' ' O ' ' A' ' 7' ' ' CYS . 32.0 t-105 -49.46 -55.74 12.13 Favored 'General case' 0 C--N 1.359 0.998 0 C-N-CA 130.649 3.58 . . . . 0.0 117.942 -178.27 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.9 p -77.41 -14.72 59.64 Favored 'General case' 0 C--N 1.358 0.954 0 C-N-CA 126.327 1.851 . . . . 0.0 113.503 -178.347 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -88.35 -38.59 15.01 Favored 'General case' 0 C--N 1.363 1.17 0 C-N-CA 124.359 1.064 . . . . 0.0 111.732 174.317 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 60.2 mmtt 74.24 21.51 2.44 Favored 'General case' 0 C--N 1.372 1.548 0 C-N-CA 126.964 2.105 . . . . 0.0 112.682 -179.295 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 38.2 ttpt -147.76 166.92 26.06 Favored 'General case' 0 N--CA 1.437 -1.124 0 C-N-CA 126.852 2.061 . . . . 0.0 106.967 -174.433 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 74.9 m -90.94 144.84 25.26 Favored 'General case' 0 C--N 1.361 1.07 0 C-N-CA 126.044 1.738 . . . . 0.0 112.705 178.187 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 89.3 mt -131.87 148.88 71.66 Favored Pre-proline 0 C--N 1.36 1.052 0 C-N-CA 126.855 2.062 . . . . 0.0 109.559 179.238 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -83.98 152.01 12.7 Favored 'Trans proline' 0 C--N 1.352 0.735 0 C-N-CA 124.776 3.65 . . . . 0.0 111.591 166.532 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.424 ' CZ ' ' HD2' ' A' ' 46' ' ' ARG 0.317 0.8 OUTLIER -138.49 -156.22 0.67 Allowed 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 104.085 -2.561 . . . . 0.0 104.085 170.269 . . . . . . . . 4 4 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 48.1 mt -141.08 148.75 40.66 Favored 'General case' 0 CA--C 1.502 -0.901 1 N-CA-C 99.761 -4.163 . . . . 0.0 99.761 176.241 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -124.07 135.65 53.71 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 119.705 1.139 . . . . 0.0 109.759 -178.123 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.9 m -79.68 -10.76 59.84 Favored 'General case' 0 C--N 1.369 1.437 0 N-CA-C 119.433 3.124 . . . . 0.0 119.433 -176.592 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 128.79 -59.14 0.69 Allowed Glycine 0 C--N 1.358 1.795 0 CA-C-N 121.803 2.092 . . . . 0.0 114.464 -178.087 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 30.8 p -144.15 56.82 1.32 Allowed 'General case' 0 C--N 1.35 0.594 0 C-N-CA 125.794 1.638 . . . . 0.0 106.856 -179.364 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -121.16 -48.36 0.29 Allowed Glycine 0 C--N 1.356 1.641 0 C-N-CA 125.637 1.589 . . . . 0.0 110.002 -177.936 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -83.2 153.99 31.22 Favored Glycine 0 C--N 1.361 1.928 0 N-CA-C 116.048 1.179 . . . . 0.0 116.048 177.256 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . 0.477 ' H ' ' NH2' ' A' ' 46' ' ' ARG 0.422 10.2 p30 -95.3 -101.25 0.16 Allowed 'General case' 0 CA--C 1.55 0.947 0 N-CA-C 115.676 1.732 . . . . 0.0 115.676 179.696 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -129.39 9.08 5.55 Favored 'General case' 0 C--N 1.369 1.421 0 N-CA-C 117.476 2.399 . . . . 0.0 117.476 -170.341 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 33.7 t30 -109.65 30.29 6.79 Favored 'General case' 0 C--N 1.364 1.224 0 O-C-N 119.761 -1.837 . . . . 0.0 106.642 176.223 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.62 HH21 ' HB2' ' A' ' 12' ' ' ARG . 43.2 mmt-85 -111.42 123.2 49.74 Favored 'General case' 0 C--N 1.368 1.4 0 CA-C-O 124.821 2.248 . . . . 0.0 109.702 -177.59 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 15.6 m-85 -113.55 148.28 36.41 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-N 112.207 -2.27 . . . . 0.0 112.167 -172.494 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -82.79 -27.64 30.82 Favored 'General case' 0 C--N 1.37 1.484 0 C-N-CA 125.931 1.692 . . . . 0.0 114.621 -179.85 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 61.9 p -137.65 173.54 11.54 Favored 'General case' 0 C--N 1.356 0.872 0 N-CA-C 106.588 -1.634 . . . . 0.0 106.588 177.827 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 14.0 tt -67.51 -27.96 40.37 Favored 'Isoleucine or valine' 0 C--N 1.365 1.26 0 C-N-CA 128.226 2.61 . . . . 0.0 114.764 179.003 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -94.35 5.3 70.91 Favored Glycine 0 C--N 1.361 1.947 0 O-C-N 121.251 -0.905 . . . . 0.0 114.464 -173.339 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -91.71 -21.96 20.46 Favored 'General case' 0 C--N 1.359 0.981 0 CA-C-O 122.227 1.013 . . . . 0.0 110.213 172.745 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 40.0 t -64.41 -51.75 61.65 Favored 'General case' 0 C--N 1.359 1.012 0 C-N-CA 130.101 3.36 . . . . 0.0 116.593 -178.709 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.405 ' HB3' ' HG3' ' A' ' 60' ' ' LYS . 4.4 mtp180 -68.65 -29.7 68.24 Favored 'General case' 0 C--N 1.344 0.334 1 C-N-CA 132.051 4.14 . . . . 0.0 116.915 -175.883 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 56.9 tttm -78.72 -10.15 59.66 Favored 'General case' 0 C--N 1.357 0.934 0 C-N-CA 126.625 1.97 . . . . 0.0 113.937 -179.759 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.499 ' HD3' ' CE2' ' A' ' 6' ' ' TYR . 31.6 mttt -98.4 -36.42 9.97 Favored 'General case' 0 C--N 1.359 1.004 0 C-N-CA 127.217 2.207 . . . . 0.0 111.39 175.946 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . 0.454 ' HB2' ' CD2' ' A' ' 25' ' ' PHE . 27.8 m -126.52 15.43 7.64 Favored 'General case' 0 C--N 1.357 0.902 0 N-CA-C 118.147 2.647 . . . . 0.0 118.147 -168.763 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 18.3 mt -140.47 -20.07 0.85 Allowed 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 122.596 2.453 . . . . 0.0 113.631 174.915 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 82.69 56.58 2.75 Favored Glycine 0 C--N 1.363 2.081 0 C-N-CA 126.794 2.14 . . . . 0.0 112.279 -172.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . 0.405 ' HG3' ' HB3' ' A' ' 54' ' ' ARG . 15.9 ptmt . . . . . 0 C--O 1.261 1.697 0 CA-C-O 116.62 -1.657 . . . . 0.0 107.394 -175.294 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 21.0 t90 . . . . . 0 N--CA 1.436 -1.165 0 CA-C-O 122.721 1.248 . . . . 0.0 110.397 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 80.7 mt-30 -140.23 151.99 65.94 Favored Pre-proline 0 C--N 1.357 0.896 1 N-CA-C 99.264 -4.347 . . . . 0.0 99.264 172.482 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.447 ' HA ' ' HD3' ' A' ' 4' ' ' PRO . 4.8 Cg_exo -81.2 117.69 3.2 Favored 'Trans proline' 0 CA--C 1.551 1.341 0 CA-C-N 126.14 3.228 . . . . 0.0 117.047 -164.275 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.447 ' HD3' ' HA ' ' A' ' 3' ' ' PRO . 17.1 Cg_exo -77.56 -117.01 0.01 OUTLIER 'Trans proline' 0 C--N 1.366 1.454 1 C-N-CA 126.003 4.469 . . . . 0.0 114.199 176.931 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . 0.483 ' CE2' ' CE1' ' A' ' 6' ' ' TYR . 52.0 p-90 -87.22 -68.01 0.78 Allowed 'General case' 0 C--N 1.374 1.657 0 C-N-CA 126.339 1.856 . . . . 0.0 115.011 -179.565 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.483 ' CE1' ' CE2' ' A' ' 5' ' ' TRP . 0.1 OUTLIER -31.73 -60.53 0.24 Allowed 'General case' 0 C--N 1.359 0.985 1 C-N-CA 134.296 5.038 . . . . 0.0 118.58 -173.818 . . . . . . . . 4 4 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.405 ' O ' ' HB2' ' A' ' 27' ' ' TRP . 3.3 m -52.87 -40.24 63.27 Favored 'General case' 0 CA--C 1.497 -1.07 1 C-N-CA 131.987 4.115 . . . . 0.0 116.34 -176.129 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . 0.273 57.0 tttm -113.87 22.11 14.28 Favored 'General case' 0 N--CA 1.428 -1.569 0 C-N-CA 128.385 2.674 . . . . 0.0 108.166 -174.404 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.431 ' HA ' ' HD3' ' A' ' 10' ' ' PRO . 14.6 tp10 -95.36 138.74 21.85 Favored Pre-proline 0 C--N 1.374 1.64 0 O-C-N 120.325 -1.484 . . . . 0.0 112.148 -174.327 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.431 ' HD3' ' HA ' ' A' ' 9' ' ' GLU . 46.5 Cg_exo -70.05 110.18 2.55 Favored 'Trans proline' 0 C--N 1.363 1.333 0 C-N-CA 124.227 3.285 . . . . 0.0 112.555 -174.518 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 8.6 p -72.95 132.13 33.86 Favored 'Isoleucine or valine' 0 C--N 1.36 1.031 0 C-N-CA 128.057 2.543 . . . . 0.0 110.519 178.303 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . 0.252 41.1 mmt-85 -132.28 136.54 47.01 Favored 'General case' 0 CA--C 1.496 -1.123 0 C-N-CA 126.16 1.784 . . . . 0.0 106.645 -169.87 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.302 16.7 tt -97.67 -41.01 10.51 Favored 'Isoleucine or valine' 0 C--N 1.37 1.473 0 CA-C-N 119.924 1.238 . . . . 0.0 111.494 175.279 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 118.51 -151.94 17.61 Favored Glycine 0 C--N 1.362 1.982 0 C-N-CA 124.351 0.977 . . . . 0.0 115.303 172.914 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 70.5 m -153.65 38.85 0.48 Allowed 'General case' 0 C--N 1.362 1.151 0 O-C-N 119.123 -2.398 . . . . 0.0 108.672 178.405 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -98.04 179.1 4.89 Favored 'General case' 0 C--N 1.357 0.913 0 C-N-CA 128.322 2.649 . . . . 0.0 110.398 178.758 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 14.0 mmmm -102.85 36.83 2.09 Favored 'General case' 0 C--N 1.352 0.688 0 O-C-N 120.104 -1.623 . . . . 0.0 112.367 -175.719 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 1.5 tpmt? -148.35 168.28 23.0 Favored 'General case' 0 C--N 1.364 1.197 0 C-N-CA 124.231 1.012 . . . . 0.0 109.809 179.187 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 13.8 mm-40 -147.06 112.43 5.56 Favored 'General case' 0 N--CA 1.441 -0.907 0 C-N-CA 128.767 2.827 . . . . 0.0 105.104 169.357 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 82.9 m-85 -104.63 133.02 50.18 Favored 'General case' 0 C--N 1.354 0.768 0 O-C-N 119.886 -1.759 . . . . 0.0 107.609 174.424 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . 0.455 ' HA ' ' HG ' ' A' ' 36' ' ' LEU . 5.1 t -69.49 125.72 27.58 Favored 'General case' 0 C--N 1.377 1.777 0 CA-C-N 122.179 2.263 . . . . 0.0 115.337 179.831 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 4.5 p -138.49 -169.37 2.58 Favored 'General case' 0 C--N 1.352 0.691 0 C-N-CA 128.043 2.537 . . . . 0.0 111.805 -173.297 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 79.9 m-85 -140.3 153.03 46.32 Favored 'General case' 0 C--N 1.359 0.979 0 C-N-CA 129.569 3.148 . . . . 0.0 112.008 176.042 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . 0.288 4.1 p90 -144.18 163.48 33.48 Favored 'General case' 0 C--N 1.376 1.73 0 C-N-CA 127.038 2.135 . . . . 0.0 109.816 170.683 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 16.0 t80 -99.53 128.32 45.63 Favored 'General case' 0 C--N 1.369 1.418 0 C-N-CA 125.693 1.597 . . . . 0.0 108.918 -179.07 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.503 ' NZ ' ' H ' ' A' ' 28' ' ' THR . 0.0 OUTLIER -91.29 112.17 23.97 Favored 'General case' 0 C--N 1.372 1.569 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 175.25 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . 0.456 ' N ' ' HZ2' ' A' ' 26' ' ' LYS . 16.9 t-105 -61.29 -40.67 95.01 Favored 'General case' 0 C--N 1.349 0.552 0 C-N-CA 128.918 2.887 . . . . 0.0 115.057 177.813 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.503 ' H ' ' NZ ' ' A' ' 26' ' ' LYS 0.318 46.4 p -83.24 -25.54 31.59 Favored 'General case' 0 C--N 1.36 1.03 0 C-N-CA 123.626 0.771 . . . . 0.0 112.504 176.402 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.4 ' HB3' ' HB3' ' A' ' 26' ' ' LYS . . . -82.19 -39.76 22.69 Favored 'General case' 0 C--N 1.379 1.864 0 CA-C-N 120.826 1.648 . . . . 0.0 114.036 172.351 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . 0.274 24.3 tptt 84.09 25.77 0.1 Allowed 'General case' 0 C--N 1.365 1.269 0 C-N-CA 129.007 2.923 . . . . 0.0 113.417 178.841 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 23.6 tptp -147.39 170.39 17.46 Favored 'General case' 0 C--N 1.357 0.895 0 C-N-CA 126.035 1.734 . . . . 0.0 106.786 179.822 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 78.8 m -85.61 142.16 29.29 Favored 'General case' 0 C--N 1.355 0.824 0 C-N-CA 127.786 2.434 . . . . 0.0 113.458 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 13.8 mt -127.14 149.71 70.24 Favored Pre-proline 0 C--N 1.356 0.879 0 C-N-CA 125.566 1.547 . . . . 0.0 109.388 178.382 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 65.3 Cg_endo -82.36 154.28 16.26 Favored 'Trans proline' 0 C--N 1.348 0.55 0 C-N-CA 123.928 3.085 . . . . 0.0 111.066 164.07 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 1.4 p90 -152.35 171.76 17.52 Favored 'General case' 0 N--CA 1.448 -0.559 1 N-CA-C 99.659 -4.2 . . . . 0.0 99.659 170.899 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.455 ' HG ' ' HA ' ' A' ' 21' ' ' SER . 7.8 mp -110.65 156.98 20.23 Favored 'General case' 0 N--CA 1.44 -0.942 0 N-CA-C 105.436 -2.061 . . . . 0.0 105.436 174.001 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 3.1 t80 -119.5 130.32 55.15 Favored 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 126.609 1.964 . . . . 0.0 108.332 179.603 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 43.2 m -83.78 -33.22 25.04 Favored 'General case' 0 C--N 1.361 1.097 0 N-CA-C 115.842 1.794 . . . . 0.0 115.842 178.891 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 121.37 -67.13 0.45 Allowed Glycine 0 C--N 1.355 1.601 0 C-N-CA 125.286 1.422 . . . . 0.0 113.682 -176.57 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 18.3 p -93.78 124.23 37.64 Favored 'General case' 0 C--N 1.355 0.833 0 O-C-N 120.652 -1.499 . . . . 0.0 110.106 179.096 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 105.53 -16.11 44.95 Favored Glycine 0 C--N 1.361 1.935 0 O-C-N 121.564 -0.71 . . . . 0.0 112.616 -175.904 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -81.19 165.85 47.48 Favored Glycine 0 C--N 1.364 2.126 0 CA-C-N 118.671 1.236 . . . . 0.0 114.722 173.079 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -155.22 118.52 4.42 Favored 'General case' 0 C--N 1.36 1.058 0 N-CA-C 116.24 1.941 . . . . 0.0 116.24 -178.963 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . 41.77 -34.63 0.0 OUTLIER 'General case' 0 C--N 1.368 1.373 2 N-CA-C 124.213 4.894 . . . . 0.0 124.213 170.828 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 53.7 t30 -93.25 72.13 4.53 Favored 'General case' 0 C--N 1.36 1.047 0 C-N-CA 125.715 1.606 . . . . 0.0 109.87 -175.598 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 5.4 ptp180 -148.3 131.38 16.32 Favored 'General case' 0 CA--C 1.508 -0.671 0 CA-C-O 123.916 1.817 . . . . 0.0 108.734 176.636 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . 0.422 ' CD2' ' HA ' ' A' ' 53' ' ' CYS . 13.9 m-85 -106.34 142.24 36.33 Favored 'General case' 0 C--N 1.349 0.571 0 C-N-CA 126.696 1.998 . . . . 0.0 109.322 -174.02 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.43 -37.4 60.42 Favored 'General case' 0 C--N 1.372 1.572 0 N-CA-C 114.965 1.468 . . . . 0.0 114.965 -178.332 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 72.8 p -123.29 -179.63 4.38 Favored 'General case' 0 C--N 1.361 1.081 0 C-N-CA 127.079 2.151 . . . . 0.0 107.863 175.561 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 18.6 tt -76.77 -16.28 14.78 Favored 'Isoleucine or valine' 0 C--N 1.364 1.206 0 C-N-CA 127.91 2.484 . . . . 0.0 113.594 174.513 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -96.59 -8.28 57.39 Favored Glycine 0 C--N 1.366 2.241 0 O-C-N 120.454 -1.404 . . . . 0.0 115.252 -178.779 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 14.0 tp10 -85.87 -18.8 31.77 Favored 'General case' 0 C--N 1.362 1.147 0 C-N-CA 125.509 1.524 . . . . 0.0 111.603 175.078 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . 0.422 ' HA ' ' CD2' ' A' ' 47' ' ' PHE . 52.9 t -63.51 -61.47 2.31 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 128.312 2.645 . . . . 0.0 114.779 179.99 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 6.7 ptt180 -68.92 -13.41 62.41 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 129.953 3.301 . . . . 0.0 118.632 -177.844 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 17.6 mmtp -68.34 -52.78 29.46 Favored 'General case' 0 C--N 1.366 1.309 0 C-N-CA 126.452 1.901 . . . . 0.0 112.647 176.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.455 ' HD2' ' CD1' ' A' ' 6' ' ' TYR . 32.3 mtmt -68.7 -24.63 64.51 Favored 'General case' 0 C--N 1.356 0.858 0 C-N-CA 130.419 3.488 . . . . 0.0 113.623 176.971 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 90.7 m -128.37 5.39 5.73 Favored 'General case' 0 C--N 1.359 0.981 0 N-CA-C 119.166 3.024 . . . . 0.0 119.166 -170.04 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 13.5 mt -134.99 -15.58 1.99 Allowed 'General case' 0 N--CA 1.473 0.696 0 CA-C-N 123.15 2.704 . . . . 0.0 111.267 172.441 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 75.9 63.65 2.39 Favored Glycine 0 C--N 1.363 2.03 0 C-N-CA 128.252 2.834 . . . . 0.0 112.47 -168.391 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 14.2 ptmt . . . . . 0 C--O 1.262 1.724 0 CA-C-O 115.655 -2.117 . . . . 0.0 107.134 -176.442 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 5.5 t90 . . . . . 0 N--CA 1.433 -1.292 0 N-CA-C 106.014 -1.847 . . . . 0.0 106.014 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 32.4 mt-30 -139.45 148.55 56.87 Favored Pre-proline 0 C--N 1.355 0.825 1 N-CA-C 100.008 -4.071 . . . . 0.0 100.008 172.093 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -74.23 124.23 8.85 Favored 'Trans proline' 0 CA--C 1.555 1.533 0 C-N-CA 123.491 2.794 . . . . 0.0 115.516 -169.562 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.524 ' HG2' ' CD2' ' A' ' 6' ' ' TYR . 43.2 Cg_endo -93.3 -113.4 0.0 OUTLIER 'Trans proline' 0 CA--C 1.549 1.227 1 C-N-CA 126.569 4.846 . . . . 0.0 111.174 -179.446 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . 0.47 ' CE3' ' CD1' ' A' ' 6' ' ' TYR 0.272 47.7 p-90 -86.49 -70.62 0.59 Allowed 'General case' 0 C--N 1.383 2.023 0 C-N-CA 126.929 2.091 . . . . 0.0 114.483 178.591 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.524 ' CD2' ' HG2' ' A' ' 4' ' ' PRO . 0.1 OUTLIER -31.72 -55.66 0.28 Allowed 'General case' 0 C--N 1.36 1.061 1 C-N-CA 133.277 4.631 . . . . 0.0 118.887 -173.663 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 3.2 m -59.52 -33.21 71.09 Favored 'General case' 0 CA--C 1.498 -1.038 0 C-N-CA 130.215 3.406 . . . . 0.0 117.638 -173.95 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . 0.303 65.3 tttm -117.14 18.31 14.59 Favored 'General case' 0 N--CA 1.436 -1.152 0 C-N-CA 128.978 2.911 . . . . 0.0 107.958 -176.232 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.402 ' HA ' ' HD3' ' A' ' 10' ' ' PRO . 23.3 tp10 -93.64 131.46 32.24 Favored Pre-proline 0 C--N 1.366 1.291 0 O-C-N 120.398 -1.439 . . . . 0.0 112.919 -173.419 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.402 ' HD3' ' HA ' ' A' ' 9' ' ' GLU . 77.9 Cg_exo -63.63 119.27 6.26 Favored 'Trans proline' 0 C--N 1.362 1.239 0 C-N-CA 124.368 3.379 . . . . 0.0 116.452 -167.348 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 11.1 p -69.11 141.14 17.74 Favored 'Isoleucine or valine' 0 C--N 1.359 0.989 0 C-N-CA 125.308 1.443 . . . . 0.0 114.256 178.815 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.515 ' HB2' HH22 ' A' ' 46' ' ' ARG . 9.5 mmm180 -131.07 -160.56 1.05 Allowed 'General case' 0 N--CA 1.438 -1.045 0 C-N-CA 126.06 1.744 . . . . 0.0 110.969 -174.911 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 11.1 tt -159.07 -35.8 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.427 -1.576 0 C-N-CA 128.283 2.633 . . . . 0.0 109.454 171.663 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.459 ' H ' ' NH2' ' A' ' 12' ' ' ARG . . . 106.97 -62.81 0.3 Allowed Glycine 0 C--N 1.356 1.682 0 N-CA-C 108.574 -1.811 . . . . 0.0 108.574 -173.054 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . 0.337 69.0 m 90.89 49.5 0.0 OUTLIER 'General case' 0 C--N 1.354 0.799 0 C-N-CA 129.552 3.141 . . . . 0.0 111.17 178.019 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -92.41 -158.77 0.61 Allowed 'General case' 0 C--N 1.359 0.995 0 CA-C-O 123.981 1.848 . . . . 0.0 110.901 176.198 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 13.2 mmmm -88.06 -12.71 43.48 Favored 'General case' 0 N--CA 1.453 -0.317 0 N-CA-C 117.01 2.226 . . . . 0.0 117.01 -171.595 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 76.0 tttt -148.43 141.56 24.98 Favored 'General case' 0 C--N 1.361 1.099 0 O-C-N 120.149 -1.594 . . . . 0.0 108.159 176.776 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 10.0 mp0 -100.18 122.7 43.42 Favored 'General case' 0 C--N 1.355 0.809 0 C-N-CA 125.923 1.689 . . . . 0.0 108.218 179.376 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 7.1 m-85 -110.27 134.91 51.79 Favored 'General case' 0 C--N 1.359 0.997 0 N-CA-C 104.62 -2.363 . . . . 0.0 104.62 177.909 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 3.8 t -69.36 141.02 54.29 Favored 'General case' 0 C--N 1.365 1.282 0 CA-C-N 121.809 2.095 . . . . 0.0 116.172 -175.207 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 20.1 p -138.19 -171.15 2.96 Favored 'General case' 0 C--N 1.358 0.976 0 C-N-CA 126.849 2.06 . . . . 0.0 111.108 179.385 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 -139.91 147.06 40.03 Favored 'General case' 0 C--N 1.362 1.109 0 C-N-CA 127.37 2.268 . . . . 0.0 110.709 172.577 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 9.7 p90 -137.85 162.9 32.78 Favored 'General case' 0 C--N 1.373 1.607 0 C-N-CA 126.411 1.884 . . . . 0.0 109.558 172.723 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . 0.407 ' CZ ' ' HG ' ' A' ' 58' ' ' LEU . 11.7 t80 -100.19 127.05 46.53 Favored 'General case' 0 C--N 1.362 1.11 0 O-C-N 120.598 -1.314 . . . . 0.0 107.726 179.694 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.648 ' HD2' HD11 ' A' ' 33' ' ' LEU . 36.4 tttm -86.62 104.93 16.51 Favored 'General case' 0 C--N 1.371 1.528 0 O-C-N 121.335 -0.853 . . . . 0.0 111.102 178.126 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 43.3 t-105 -52.01 -46.49 64.96 Favored 'General case' 0 C--N 1.364 1.197 0 C-N-CA 128.863 2.865 . . . . 0.0 116.811 -176.279 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 2.2 p -88.32 1.25 55.0 Favored 'General case' 0 C--N 1.349 0.57 0 C-N-CA 125.53 1.532 . . . . 0.0 113.578 179.567 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -109.87 -40.27 4.83 Favored 'General case' 0 C--N 1.36 1.057 0 O-C-N 120.95 -1.094 . . . . 0.0 111.54 176.402 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . 0.253 26.9 tptt 86.39 27.16 0.05 OUTLIER 'General case' 0 C--N 1.363 1.187 0 C-N-CA 127.953 2.501 . . . . 0.0 113.54 179.523 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 61.4 tttp -146.48 159.55 43.26 Favored 'General case' 0 C--N 1.356 0.886 0 C-N-CA 125.422 1.489 . . . . 0.0 108.102 -178.321 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 76.5 m -79.72 140.77 36.85 Favored 'General case' 0 C--N 1.364 1.214 0 C-N-CA 127.717 2.407 . . . . 0.0 112.449 177.03 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.648 HD11 ' HD2' ' A' ' 26' ' ' LYS . 19.1 mt -128.32 157.38 74.68 Favored Pre-proline 0 C--N 1.355 0.807 0 C-N-CA 126.209 1.804 . . . . 0.0 109.183 177.274 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -88.11 167.77 6.67 Favored 'Trans proline' 0 N--CA 1.455 -0.745 0 C-N-CA 123.815 3.01 . . . . 0.0 111.412 167.976 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 5.4 p90 -163.32 -176.71 4.91 Favored 'General case' 0 N--CA 1.445 -0.683 0 N-CA-C 102.005 -3.331 . . . . 0.0 102.005 172.61 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -125.21 147.01 49.26 Favored 'General case' 0 N--CA 1.423 -1.808 0 N-CA-C 104.929 -2.249 . . . . 0.0 104.929 173.916 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.404 ' CZ ' ' HA2' ' A' ' 39' ' ' GLY . 36.8 t80 -111.1 137.69 48.45 Favored 'General case' 0 CA--C 1.533 0.302 0 N-CA-C 104.607 -2.368 . . . . 0.0 104.607 173.316 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 77.5 p -104.78 -2.3 25.01 Favored 'General case' 0 C--N 1.365 1.266 0 C-N-CA 125.521 1.528 . . . . 0.0 112.386 -178.665 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . 0.404 ' HA2' ' CZ ' ' A' ' 37' ' ' PHE . . . 94.11 -59.6 2.0 Favored Glycine 0 C--N 1.356 1.643 0 O-C-N 120.029 -1.669 . . . . 0.0 115.252 170.419 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.9 m -73.09 62.27 0.63 Allowed 'General case' 0 C--N 1.354 0.802 0 C-N-CA 127.876 2.471 . . . . 0.0 116.036 -176.432 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 127.77 34.79 0.54 Allowed Glycine 0 C--N 1.357 1.737 0 N-CA-C 119.344 2.497 . . . . 0.0 119.344 168.687 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -94.31 170.98 30.49 Favored Glycine 0 C--N 1.368 2.316 0 CA-C-N 121.793 2.796 . . . . 0.0 111.524 175.937 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . 0.312 27.2 p30 -88.9 -99.17 0.09 Allowed 'General case' 0 C--N 1.365 1.262 0 N-CA-C 117.297 2.332 . . . . 0.0 117.297 -178.087 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -144.78 -9.38 0.62 Allowed 'General case' 0 C--N 1.353 0.719 0 O-C-N 120.461 -1.399 . . . . 0.0 114.175 -171.989 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 61.3 t30 -94.93 77.44 3.59 Favored 'General case' 0 C--N 1.357 0.895 0 O-C-N 119.97 -1.706 . . . . 0.0 114.313 -177.781 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.515 HH22 ' HB2' ' A' ' 12' ' ' ARG 0.406 0.0 OUTLIER -145.17 145.03 31.19 Favored 'General case' 0 C--N 1.357 0.898 0 CA-C-O 124.542 2.115 . . . . 0.0 113.745 169.229 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 12.0 m-85 -111.32 133.68 53.47 Favored 'General case' 0 C--N 1.353 0.744 0 C-N-CA 128.025 2.53 . . . . 0.0 108.249 -177.386 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 4.2 mp0 -74.44 -55.04 6.41 Favored 'General case' 0 C--N 1.371 1.523 0 C-N-CA 126.492 1.917 . . . . 0.0 113.132 -178.095 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 9.8 p -111.69 160.79 16.93 Favored 'General case' 0 C--N 1.354 0.804 0 N-CA-C 104.958 -2.238 . . . . 0.0 104.958 174.939 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 16.4 tt -59.49 -30.13 43.81 Favored 'Isoleucine or valine' 0 C--N 1.361 1.095 0 N-CA-C 117.42 2.378 . . . . 0.0 117.42 -175.026 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -96.22 13.59 65.6 Favored Glycine 0 C--N 1.357 1.73 0 O-C-N 119.926 -1.734 . . . . 0.0 115.293 -179.168 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 16.1 tp10 -89.84 -4.58 57.52 Favored 'General case' 0 C--N 1.364 1.22 0 CA-C-O 122.899 1.333 . . . . 0.0 109.845 171.107 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 18.7 t -79.78 -39.03 31.8 Favored 'General case' 0 C--N 1.359 1.0 1 C-N-CA 132.687 4.395 . . . . 0.0 112.843 179.668 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 55.2 mtp180 -69.01 -47.31 65.8 Favored 'General case' 0 C--N 1.34 0.17 1 C-N-CA 133.925 4.89 . . . . 0.0 117.486 -178.532 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 87.3 tttt -66.94 -30.88 71.14 Favored 'General case' 0 C--N 1.362 1.13 0 C-N-CA 127.827 2.451 . . . . 0.0 113.727 -178.878 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.412 ' HD2' ' CD1' ' A' ' 6' ' ' TYR . 20.3 mtmm -87.88 -36.05 17.39 Favored 'General case' 0 C--N 1.359 1.02 0 C-N-CA 127.876 2.47 . . . . 0.0 112.192 174.636 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 97.6 m -127.04 2.82 6.52 Favored 'General case' 0 C--N 1.369 1.427 0 N-CA-C 120.725 3.602 . . . . 0.0 120.725 -171.725 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.407 ' HG ' ' CZ ' ' A' ' 25' ' ' PHE . 14.7 mt -130.4 -26.28 2.32 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 122.215 2.28 . . . . 0.0 110.756 170.365 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 88.9 52.64 2.73 Favored Glycine 0 C--N 1.361 1.963 0 C-N-CA 128.646 3.022 . . . . 0.0 111.327 -172.278 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 19.3 ptmt . . . . . 0 C--O 1.259 1.59 0 CA-C-N 118.377 1.089 . . . . 0.0 111.033 -172.934 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 84.7 t90 . . . . . 0 N--CA 1.434 -1.229 0 CA-C-O 122.149 0.976 . . . . 0.0 108.681 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 24.2 mm-40 -144.32 148.48 41.1 Favored Pre-proline 0 C--N 1.349 0.584 1 N-CA-C 98.296 -4.705 . . . . 0.0 98.296 170.733 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.426 ' HA ' ' HD3' ' A' ' 4' ' ' PRO . 2.9 Cg_endo -74.47 120.33 6.17 Favored 'Trans proline' 0 CA--C 1.555 1.548 0 CA-C-N 124.701 2.715 . . . . 0.0 116.023 -168.511 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.426 ' HD3' ' HA ' ' A' ' 3' ' ' PRO . 24.1 Cg_exo -77.41 -120.22 0.01 OUTLIER 'Trans proline' 0 C--N 1.369 1.657 1 C-N-CA 126.968 5.112 . . . . 0.0 113.587 175.639 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . 0.482 ' CE3' ' CD1' ' A' ' 6' ' ' TYR . 0.4 OUTLIER -86.66 -68.16 0.76 Allowed 'General case' 0 C--N 1.379 1.885 0 C-N-CA 126.955 2.102 . . . . 0.0 113.432 177.557 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.482 ' CD1' ' CE3' ' A' ' 5' ' ' TRP . 0.1 OUTLIER -31.13 -51.46 0.17 Allowed 'General case' 0 C--N 1.363 1.191 1 C-N-CA 133.97 4.908 . . . . 0.0 117.591 -172.844 . . . . . . . . 4 4 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.41 ' O ' ' HB2' ' A' ' 27' ' ' TRP . 2.9 m -57.87 -43.49 86.04 Favored 'General case' 0 CA--C 1.511 -0.519 0 C-N-CA 129.925 3.29 . . . . 0.0 116.007 -175.708 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 26.7 mtpp -103.8 17.38 24.23 Favored 'General case' 0 C--N 1.357 0.904 0 C-N-CA 127.231 2.212 . . . . 0.0 109.908 177.261 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.462 ' HA ' ' HD3' ' A' ' 10' ' ' PRO . 29.7 tp10 -90.22 127.06 54.76 Favored Pre-proline 0 C--N 1.361 1.072 0 O-C-N 120.468 -1.395 . . . . 0.0 112.234 -170.893 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.462 ' HD3' ' HA ' ' A' ' 9' ' ' GLU . 50.0 Cg_exo -67.88 122.51 9.64 Favored 'Trans proline' 0 C--N 1.364 1.371 0 C-N-CA 124.08 3.186 . . . . 0.0 114.43 -165.977 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 7.8 p -69.78 134.06 30.78 Favored 'Isoleucine or valine' 0 C--N 1.357 0.918 0 C-N-CA 126.692 1.997 . . . . 0.0 112.674 -179.767 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 46.8 mtt180 -135.05 125.18 25.99 Favored 'General case' 0 C--N 1.359 0.981 0 CA-C-O 117.134 -1.412 . . . . 0.0 109.109 -175.486 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.267 17.3 tt -96.2 -38.73 8.63 Favored 'Isoleucine or valine' 0 C--N 1.37 1.486 0 CA-C-N 120.16 1.345 . . . . 0.0 112.106 175.398 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 114.4 -144.67 18.39 Favored Glycine 0 C--N 1.357 1.7 0 C-N-CA 125.805 1.669 . . . . 0.0 113.846 177.348 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 71.4 m -158.36 40.73 0.26 Allowed 'General case' 0 C--N 1.36 1.041 0 O-C-N 119.018 -2.46 . . . . 0.0 108.192 179.772 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -104.38 -175.56 2.83 Favored 'General case' 0 C--N 1.356 0.87 0 CA-C-O 124.555 2.122 . . . . 0.0 110.08 179.917 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 14.0 mmmm -111.14 39.35 2.3 Favored 'General case' 0 C--N 1.344 0.329 0 C-N-CA 125.669 1.588 . . . . 0.0 110.824 -177.966 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 16.6 tppt? -146.33 156.53 43.4 Favored 'General case' 0 N--CA 1.439 -1.024 0 N-CA-C 104.192 -2.521 . . . . 0.0 104.192 179.525 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 6.5 mp0 -147.94 118.83 7.61 Favored 'General case' 0 N--CA 1.433 -1.303 0 N-CA-C 105.054 -2.202 . . . . 0.0 105.054 171.843 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 73.5 m-85 -103.4 145.07 30.54 Favored 'General case' 0 C--N 1.353 0.723 0 N-CA-C 105.718 -1.956 . . . . 0.0 105.718 171.04 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 3.7 t -72.75 142.65 48.13 Favored 'General case' 0 C--N 1.371 1.534 0 CA-C-N 122.063 2.211 . . . . 0.0 115.146 -177.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 80.6 p -146.82 -169.38 3.28 Favored 'General case' 0 C--N 1.361 1.089 0 C-N-CA 125.553 1.541 . . . . 0.0 113.606 -175.948 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 62.0 m-85 -145.63 149.28 34.22 Favored 'General case' 0 C--N 1.361 1.095 0 C-N-CA 130.384 3.474 . . . . 0.0 110.777 175.929 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 9.4 p90 -143.49 154.46 43.67 Favored 'General case' 0 C--N 1.365 1.271 0 C-N-CA 127.44 2.296 . . . . 0.0 109.691 174.456 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 11.5 t80 -94.49 121.87 36.48 Favored 'General case' 0 C--N 1.371 1.523 0 N-CA-C 106.269 -1.752 . . . . 0.0 106.269 177.404 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.11 102.56 14.37 Favored 'General case' 0 N--CA 1.431 -1.383 0 CA-C-O 122.032 0.92 . . . . 0.0 110.282 178.709 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . 0.41 ' HB2' ' O ' ' A' ' 7' ' ' CYS . 14.9 t-105 -48.11 -46.36 33.99 Favored 'General case' 0 C--N 1.355 0.824 0 C-N-CA 130.26 3.424 . . . . 0.0 118.266 -174.93 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 3.0 p -79.08 -18.6 53.08 Favored 'General case' 0 C--N 1.358 0.941 0 C-N-CA 125.675 1.59 . . . . 0.0 112.98 179.191 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -87.54 -40.81 13.95 Favored 'General case' 0 C--N 1.366 1.324 0 C-N-CA 124.401 1.08 . . . . 0.0 111.18 172.936 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . 0.297 0.0 OUTLIER 77.45 30.2 0.51 Allowed 'General case' 0 C--N 1.363 1.179 0 C-N-CA 128.94 2.896 . . . . 0.0 113.41 179.349 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 53.2 tptt -148.35 167.39 25.34 Favored 'General case' 0 C--N 1.358 0.971 0 C-N-CA 127.247 2.219 . . . . 0.0 107.204 176.899 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 92.7 m -78.67 138.26 38.21 Favored 'General case' 0 C--N 1.357 0.93 0 C-N-CA 128.481 2.713 . . . . 0.0 114.822 178.971 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 12.0 mt -122.95 148.44 54.06 Favored Pre-proline 0 C--N 1.359 1.013 0 C-N-CA 125.846 1.659 . . . . 0.0 109.328 176.19 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 63.3 Cg_endo -82.8 159.5 16.2 Favored 'Trans proline' 0 CA--C 1.535 0.527 0 C-N-CA 123.115 2.543 . . . . 0.0 111.689 167.311 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . 0.317 2.0 p90 -150.97 -160.27 1.15 Allowed 'General case' 0 C--N 1.347 0.468 0 N-CA-C 104.888 -2.264 . . . . 0.0 104.888 169.796 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 18.8 mt -140.87 153.11 45.58 Favored 'General case' 0 N--CA 1.436 -1.128 0 N-CA-C 101.83 -3.396 . . . . 0.0 101.83 175.472 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -121.95 130.59 53.45 Favored 'General case' 0 N--CA 1.469 0.484 0 N-CA-C 105.071 -2.196 . . . . 0.0 105.071 178.035 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 89.3 p -77.84 -82.54 0.09 Allowed 'General case' 0 C--N 1.37 1.48 0 O-C-N 121.13 -0.981 . . . . 0.0 112.2 179.733 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 176.7 -59.6 0.1 Allowed Glycine 0 CA--C 1.488 -1.597 0 N-CA-C 108.99 -1.644 . . . . 0.0 108.99 173.565 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 20.2 p -83.73 79.42 9.47 Favored 'General case' 0 C--N 1.359 1.018 0 C-N-CA 126.692 1.997 . . . . 0.0 112.963 179.694 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 144.4 19.36 0.19 Allowed Glycine 0 C--N 1.352 1.425 0 N-CA-C 116.933 1.533 . . . . 0.0 116.933 174.557 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -71.14 176.07 38.06 Favored Glycine 0 C--N 1.366 2.204 0 N-CA-C 119.711 2.645 . . . . 0.0 119.711 175.692 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . 0.445 ' H ' ' CZ ' ' A' ' 46' ' ' ARG . 36.0 t-20 -136.76 -156.68 0.72 Allowed 'General case' 0 C--N 1.353 0.726 0 C-N-CA 125.392 1.477 . . . . 0.0 109.114 -174.596 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -99.44 -15.87 18.57 Favored 'General case' 0 C--N 1.354 0.784 0 O-C-N 120.256 -1.527 . . . . 0.0 114.261 -176.869 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 63.0 t30 -94.5 73.83 3.79 Favored 'General case' 0 C--N 1.363 1.165 0 O-C-N 119.653 -1.904 . . . . 0.0 110.396 -178.555 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.445 ' CZ ' ' H ' ' A' ' 43' ' ' ASN 0.303 0.0 OUTLIER -137.21 127.59 26.54 Favored 'General case' 0 C--N 1.352 0.704 0 CA-C-O 124.135 1.921 . . . . 0.0 109.759 172.02 . . . . . . . . 4 4 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 23.4 m-85 -108.06 142.99 37.4 Favored 'General case' 0 C--N 1.353 0.748 0 C-N-CA 127.364 2.266 . . . . 0.0 109.011 -175.248 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 32.5 mt-30 -66.12 -68.63 0.35 Allowed 'General case' 0 C--N 1.365 1.255 0 C-N-CA 128.57 2.748 . . . . 0.0 113.49 -178.544 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 40.9 p -119.12 170.65 8.88 Favored 'General case' 0 C--N 1.354 0.793 0 C-N-CA 124.955 1.302 . . . . 0.0 108.788 176.901 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 16.0 tt -58.72 -26.78 32.72 Favored 'Isoleucine or valine' 0 C--N 1.361 1.105 0 C-N-CA 128.46 2.704 . . . . 0.0 116.297 178.664 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -86.04 -16.9 62.15 Favored Glycine 0 C--N 1.36 1.88 0 O-C-N 120.282 -1.511 . . . . 0.0 116.088 175.35 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 15.2 tp10 -82.9 -25.58 32.33 Favored 'General case' 0 C--N 1.371 1.52 0 CA-C-N 120.358 2.079 . . . . 0.0 111.349 176.313 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 9.6 t -59.84 -44.6 93.99 Favored 'General case' 0 CA--C 1.559 1.293 0 C-N-CA 127.526 2.33 . . . . 0.0 115.955 177.524 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 5.4 ptt180 -82.24 -18.66 41.72 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 126.509 1.923 . . . . 0.0 113.645 178.087 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 36.1 ttmt -75.46 -16.42 60.32 Favored 'General case' 0 C--N 1.361 1.091 0 C-N-CA 126.797 2.039 . . . . 0.0 114.656 178.552 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.426 ' HD2' ' CD1' ' A' ' 6' ' ' TYR . 5.4 ttmt -103.98 -24.33 13.25 Favored 'General case' 0 C--N 1.361 1.098 0 C-N-CA 126.208 1.803 . . . . 0.0 110.82 175.985 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . 0.444 ' SG ' ' HB2' ' A' ' 6' ' ' TYR . 34.4 m -127.21 10.38 6.85 Favored 'General case' 0 C--N 1.364 1.21 0 N-CA-C 118.031 2.604 . . . . 0.0 118.031 -169.14 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 12.1 mt -139.34 -18.67 0.98 Allowed 'General case' 0 C--N 1.35 0.614 0 CA-C-N 121.838 2.108 . . . . 0.0 112.87 172.256 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 82.05 51.53 4.42 Favored Glycine 0 C--N 1.362 1.988 0 C-N-CA 127.589 2.518 . . . . 0.0 111.673 -171.275 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 12.8 mtpt . . . . . 0 C--O 1.262 1.743 0 C-N-CA 124.76 1.224 . . . . 0.0 108.232 -177.024 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' TRP . . . . . 0.5 ' CZ2' ' HB3' ' A' ' 3' ' ' PRO . 83.0 t90 . . . . . 0 N--CA 1.432 -1.338 0 N-CA-C 107.386 -1.339 . . . . 0.0 107.386 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -144.76 148.22 38.6 Favored Pre-proline 0 C--N 1.353 0.728 1 N-CA-C 96.865 -5.235 . . . . 0.0 96.865 172.185 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.5 ' HB3' ' CZ2' ' A' ' 1' ' ' TRP . 90.3 Cg_endo -81.08 123.23 4.47 Favored 'Trans proline' 0 CA--C 1.555 1.553 0 CA-C-N 125.702 3.072 . . . . 0.0 115.259 -165.815 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.46 ' HD3' ' HA ' ' A' ' 3' ' ' PRO . 43.1 Cg_exo -74.52 -115.48 0.01 OUTLIER 'Trans proline' 0 CA--C 1.55 1.301 1 C-N-CA 126.751 4.967 . . . . 0.0 113.828 174.527 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . 0.488 ' CE3' ' CD2' ' A' ' 6' ' ' TYR . 21.7 p-90 -87.75 -72.3 0.53 Allowed 'General case' 0 C--N 1.376 1.729 0 C-N-CA 126.71 2.004 . . . . 0.0 115.01 179.882 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.488 ' CD2' ' CE3' ' A' ' 5' ' ' TRP . 0.0 OUTLIER -31.26 -53.99 0.23 Allowed 'General case' 0 C--N 1.356 0.877 1 C-N-CA 133.868 4.867 . . . . 0.0 118.065 -173.378 . . . . . . . . 4 4 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.405 ' O ' ' HB2' ' A' ' 27' ' ' TRP . 1.9 m -54.96 -33.49 62.4 Favored 'General case' 0 CA--C 1.502 -0.901 0 C-N-CA 131.444 3.897 . . . . 0.0 116.488 -176.501 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 11.7 mtpp -113.96 13.73 18.32 Favored 'General case' 0 N--CA 1.439 -0.987 0 C-N-CA 129.978 3.311 . . . . 0.0 109.891 -177.857 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.45 ' HA ' ' HD3' ' A' ' 10' ' ' PRO . 34.7 tp10 -90.67 142.37 27.81 Favored Pre-proline 0 C--N 1.364 1.209 0 O-C-N 120.74 -1.225 . . . . 0.0 114.289 -170.29 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.45 ' HD3' ' HA ' ' A' ' 9' ' ' GLU . 51.7 Cg_exo -68.0 117.7 5.09 Favored 'Trans proline' 0 C--N 1.367 1.531 0 C-N-CA 124.682 3.588 . . . . 0.0 115.324 -173.891 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 14.5 p -69.72 128.02 32.48 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.938 0 C-N-CA 128.387 2.675 . . . . 0.0 111.885 176.138 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.433 ' HB2' HH22 ' A' ' 46' ' ' ARG . 2.2 mmp_? -142.36 122.58 13.84 Favored 'General case' 0 C--N 1.366 1.313 0 C-N-CA 125.65 1.58 . . . . 0.0 113.546 -170.708 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 12.9 tt -86.78 -42.22 15.35 Favored 'Isoleucine or valine' 0 C--N 1.376 1.757 0 C-N-CA 127.873 2.469 . . . . 0.0 115.931 -179.692 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 82.46 -165.42 44.55 Favored Glycine 0 C--N 1.362 2.003 0 O-C-N 121.279 -0.888 . . . . 0.0 114.161 -173.451 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 72.4 m -162.75 69.28 0.24 Allowed 'General case' 0 CA--C 1.507 -0.686 0 O-C-N 119.458 -2.201 . . . . 0.0 108.028 179.66 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 25.7 m -117.69 -85.33 0.64 Allowed 'General case' 0 N--CA 1.445 -0.688 0 CA-C-O 121.84 0.829 . . . . 0.0 112.815 -174.829 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 2.7 mmmp? -101.74 -64.81 1.02 Allowed 'General case' 0 CA--C 1.51 -0.593 0 N-CA-C 114.636 1.347 . . . . 0.0 114.636 -169.031 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.606 ' HG3' ' H ' ' A' ' 19' ' ' GLN . 14.8 tptp -143.96 -153.39 0.47 Allowed 'General case' 0 CA--C 1.504 -0.811 0 N-CA-C 104.37 -2.456 . . . . 0.0 104.37 -172.206 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.606 ' H ' ' HG3' ' A' ' 18' ' ' LYS . 9.6 mm-40 -131.93 110.02 10.49 Favored 'General case' 0 N--CA 1.432 -1.328 0 N-CA-C 101.183 -3.636 . . . . 0.0 101.183 171.254 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 30.7 m-85 -106.83 138.45 42.98 Favored 'General case' 0 C--N 1.354 0.788 0 C-N-CA 125.794 1.638 . . . . 0.0 108.099 178.234 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . 0.452 ' HA ' ' HG ' ' A' ' 36' ' ' LEU . 3.9 t -65.71 120.96 13.92 Favored 'General case' 0 C--N 1.371 1.513 0 N-CA-C 117.554 2.427 . . . . 0.0 117.554 -175.053 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -116.53 -168.24 1.42 Allowed 'General case' 0 C--N 1.37 1.487 0 C-N-CA 128.541 2.736 . . . . 0.0 111.232 177.171 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 23.6 m-85 -150.34 150.41 31.41 Favored 'General case' 0 C--N 1.355 0.835 0 C-N-CA 129.494 3.118 . . . . 0.0 108.191 174.258 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 8.9 p90 -145.14 166.14 26.28 Favored 'General case' 0 C--N 1.356 0.889 0 C-N-CA 126.325 1.85 . . . . 0.0 109.684 171.998 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . 0.44 ' CD2' ' HB2' ' A' ' 57' ' ' CYS . 19.0 t80 -98.02 125.72 43.11 Favored 'General case' 0 C--N 1.36 1.045 0 O-C-N 120.026 -1.671 . . . . 0.0 108.814 176.655 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 26.7 ttpt -85.05 103.15 13.81 Favored 'General case' 0 C--N 1.379 1.862 0 O-C-N 120.152 -1.593 . . . . 0.0 108.57 173.92 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . 0.405 ' HB2' ' O ' ' A' ' 7' ' ' CYS . 26.1 t-105 -46.07 -43.52 14.67 Favored 'General case' 0 C--N 1.358 0.951 0 C-N-CA 129.904 3.282 . . . . 0.0 117.528 -176.917 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 4.0 p -82.36 -29.83 30.71 Favored 'General case' 0 C--N 1.35 0.59 0 C-N-CA 127.787 2.435 . . . . 0.0 113.885 179.727 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -82.63 -23.69 34.18 Favored 'General case' 0 C--N 1.37 1.494 0 CA-C-N 120.935 1.698 . . . . 0.0 113.853 176.608 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . 0.261 30.5 mmmt 73.23 23.01 2.7 Favored 'General case' 0 C--N 1.367 1.328 0 C-N-CA 126.929 2.092 . . . . 0.0 112.246 -176.842 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.519 ' NZ ' HH12 ' A' ' 54' ' ' ARG . 6.8 mmtm -146.21 164.6 31.77 Favored 'General case' 0 C--N 1.365 1.246 0 C-N-CA 125.655 1.582 . . . . 0.0 112.684 -177.06 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 68.5 m -89.9 141.28 28.8 Favored 'General case' 0 C--N 1.359 1.005 0 C-N-CA 127.501 2.32 . . . . 0.0 116.321 -173.863 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 39.3 mt -127.44 145.59 55.14 Favored Pre-proline 0 C--N 1.363 1.183 0 C-N-CA 125.034 1.334 . . . . 0.0 110.741 -179.083 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 62.2 Cg_endo -84.54 143.17 9.66 Favored 'Trans proline' 0 CA--C 1.536 0.606 0 C-N-CA 123.474 2.783 . . . . 0.0 111.07 167.138 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 1.6 p90 -142.35 159.83 41.45 Favored 'General case' 0 C--N 1.349 0.569 0 N-CA-C 101.098 -3.667 . . . . 0.0 101.098 170.964 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.452 ' HG ' ' HA ' ' A' ' 21' ' ' SER . 6.9 mp -104.82 158.5 16.48 Favored 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 125.655 1.582 . . . . 0.0 107.75 178.39 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 9.0 t80 -125.55 144.2 50.67 Favored 'General case' 0 CA--C 1.557 1.228 0 C-N-CA 127.55 2.34 . . . . 0.0 110.088 179.749 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.9 t -84.86 -19.64 32.06 Favored 'General case' 0 C--N 1.376 1.724 0 N-CA-C 117.834 2.531 . . . . 0.0 117.834 -179.722 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 119.3 -30.71 5.7 Favored Glycine 0 C--N 1.361 1.966 0 C-N-CA 126.265 1.888 . . . . 0.0 116.333 172.871 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -137.23 142.85 42.05 Favored 'General case' 0 C--N 1.345 0.405 0 N-CA-C 104.756 -2.313 . . . . 0.0 104.756 173.418 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 100.8 10.53 43.05 Favored Glycine 0 C--N 1.365 2.178 0 O-C-N 121.085 -1.01 . . . . 0.0 115.429 -174.341 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -105.82 -171.33 23.51 Favored Glycine 0 C--N 1.358 1.77 0 C-N-CA 124.888 1.232 . . . . 0.0 114.446 177.012 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . 0.489 ' H ' ' CZ ' ' A' ' 46' ' ' ARG 0.311 31.8 p30 -124.3 -106.53 0.34 Allowed 'General case' 0 C--N 1.363 1.168 0 N-CA-C 116.265 1.95 . . . . 0.0 116.265 178.782 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -152.92 6.79 0.39 Allowed 'General case' 0 C--N 1.352 0.711 0 O-C-N 121.256 -0.903 . . . . 0.0 112.686 -172.042 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 55.8 t30 -104.17 46.43 0.92 Allowed 'General case' 0 C--N 1.365 1.28 0 O-C-N 120.574 -1.328 . . . . 0.0 109.406 176.264 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.489 ' CZ ' ' H ' ' A' ' 43' ' ' ASN 0.365 0.0 OUTLIER -132.1 106.93 8.3 Favored 'General case' 0 C--N 1.358 0.971 0 CA-C-O 124.468 2.08 . . . . 0.0 107.508 -179.368 . . . . . . . . 4 4 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 13.0 m-30 -93.02 149.62 21.09 Favored 'General case' 0 C--N 1.346 0.427 0 C-N-CA 128.54 2.736 . . . . 0.0 111.762 -165.573 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 35.8 mt-30 -74.73 -41.55 59.93 Favored 'General case' 0 C--N 1.37 1.495 0 N-CA-C 116.746 2.128 . . . . 0.0 116.746 -172.289 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 48.9 p -136.84 179.02 6.63 Favored 'General case' 0 C--N 1.356 0.849 0 C-N-CA 128.584 2.754 . . . . 0.0 105.54 178.55 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 18.1 tt -75.56 -17.65 15.74 Favored 'Isoleucine or valine' 0 C--N 1.37 1.463 0 O-C-N 120.42 -1.425 . . . . 0.0 113.452 175.596 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -77.25 -18.18 78.56 Favored Glycine 0 C--N 1.366 2.225 0 C-N-CA 125.704 1.621 . . . . 0.0 116.166 175.781 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -83.27 -2.17 54.98 Favored 'General case' 0 C--N 1.365 1.28 0 C-N-CA 126.371 1.868 . . . . 0.0 112.109 177.388 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 4.7 t -94.94 -24.34 17.01 Favored 'General case' 0 C--N 1.356 0.88 0 C-N-CA 128.715 2.806 . . . . 0.0 114.449 179.87 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.519 HH12 ' NZ ' ' A' ' 31' ' ' LYS . 0.0 OUTLIER -84.78 -37.91 20.24 Favored 'General case' 0 C--O 1.237 0.419 1 C-N-CA 132.393 4.277 . . . . 0.0 109.398 179.034 . . . . . . . . 4 4 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 28.0 ttmt -71.71 -28.03 63.42 Favored 'General case' 0 C--N 1.351 0.654 0 C-N-CA 129.303 3.041 . . . . 0.0 113.871 -178.285 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 27.2 mtmt -101.08 -39.18 7.82 Favored 'General case' 0 C--N 1.358 0.941 0 C-N-CA 125.094 1.358 . . . . 0.0 112.592 178.098 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . 0.44 ' HB2' ' CD2' ' A' ' 25' ' ' PHE . 99.2 m -126.49 17.22 7.59 Favored 'General case' 0 C--N 1.358 0.951 0 N-CA-C 116.98 2.215 . . . . 0.0 116.98 -170.13 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 22.5 mt -137.15 -23.05 1.15 Allowed 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 122.518 2.417 . . . . 0.0 112.682 168.666 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 86.78 48.74 4.34 Favored Glycine 0 C--N 1.367 2.268 0 C-N-CA 127.134 2.302 . . . . 0.0 111.524 -175.655 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 13.9 ptmt . . . . . 0 C--O 1.261 1.666 0 CA-C-O 118.572 -0.727 . . . . 0.0 110.544 -173.26 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 11.9 t90 . . . . . 0 N--CA 1.434 -1.239 0 CA-C-O 122.748 1.261 . . . . 0.0 109.294 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -135.75 148.91 67.32 Favored Pre-proline 0 C--N 1.351 0.659 1 N-CA-C 100.148 -4.019 . . . . 0.0 100.148 172.737 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.433 ' HA ' ' HD3' ' A' ' 4' ' ' PRO . 1.4 Cg_endo -77.35 125.38 7.7 Favored 'Trans proline' 0 CA--C 1.554 1.495 0 CA-C-N 124.807 2.753 . . . . 0.0 115.222 -169.026 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.521 ' HG2' ' CD2' ' A' ' 6' ' ' TYR . 38.3 Cg_endo -96.29 -116.09 0.0 OUTLIER 'Trans proline' 0 CA--C 1.549 1.239 1 C-N-CA 126.549 4.833 . . . . 0.0 110.855 -176.473 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . 0.471 ' CE3' ' CD1' ' A' ' 6' ' ' TYR 0.274 35.5 p-90 -85.67 -67.59 0.79 Allowed 'General case' 0 C--N 1.38 1.908 0 C-N-CA 126.496 1.918 . . . . 0.0 115.093 178.395 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.521 ' CD2' ' HG2' ' A' ' 4' ' ' PRO . 0.1 OUTLIER -32.71 -53.06 0.33 Allowed 'General case' 0 N--CA 1.48 1.071 1 C-N-CA 132.277 4.231 . . . . 0.0 119.162 -172.353 . . . . . . . . 4 4 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.7 m -60.51 -38.16 83.46 Favored 'General case' 0 N--CA 1.449 -0.514 0 C-N-CA 128.733 2.813 . . . . 0.0 113.277 -179.488 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 39.8 mtpt -104.16 14.01 31.26 Favored 'General case' 0 C--N 1.363 1.17 0 C-N-CA 129.08 2.952 . . . . 0.0 110.579 -177.71 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.425 ' HA ' ' HD3' ' A' ' 10' ' ' PRO . 3.4 tp10 -96.67 127.79 38.28 Favored Pre-proline 0 C--N 1.364 1.217 0 O-C-N 119.853 -1.779 . . . . 0.0 112.015 -172.273 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.425 ' HD3' ' HA ' ' A' ' 9' ' ' GLU . 52.4 Cg_exo -68.16 120.85 7.81 Favored 'Trans proline' 0 C--N 1.358 1.056 0 C-N-CA 124.167 3.245 . . . . 0.0 115.093 -165.881 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 8.1 p -67.85 133.85 31.03 Favored 'Isoleucine or valine' 0 C--N 1.36 1.057 0 C-N-CA 126.568 1.947 . . . . 0.0 113.934 -179.585 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . 0.287 16.5 mmt-85 -134.49 117.9 16.74 Favored 'General case' 0 C--N 1.36 1.04 0 C-N-CA 126.611 1.964 . . . . 0.0 108.494 -171.772 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 21.1 tt -93.18 -40.25 11.74 Favored 'Isoleucine or valine' 0 C--N 1.369 1.443 0 CA-C-N 120.399 1.454 . . . . 0.0 109.453 173.387 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 98.17 -67.47 0.73 Allowed Glycine 0 C--N 1.36 1.895 0 C-N-CA 124.67 1.129 . . . . 0.0 114.533 175.942 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . 0.322 89.9 p 87.91 28.91 0.03 OUTLIER 'General case' 0 C--N 1.362 1.143 0 C-N-CA 129.303 3.041 . . . . 0.0 110.524 -172.083 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 6.6 t -70.16 -89.95 0.02 OUTLIER 'General case' 0 C--N 1.364 1.221 0 N-CA-C 116.345 1.98 . . . . 0.0 116.345 -176.998 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 63.2 mmtt -88.89 -62.02 1.58 Allowed 'General case' 0 C--N 1.355 0.843 0 C-N-CA 125.074 1.349 . . . . 0.0 113.408 -178.02 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . 0.264 0.0 OUTLIER -148.0 -136.5 0.08 Allowed 'General case' 0 C--N 1.349 0.556 0 N-CA-C 104.472 -2.418 . . . . 0.0 104.472 175.391 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -150.11 123.48 9.0 Favored 'General case' 0 C--N 1.351 0.665 0 N-CA-C 103.643 -2.725 . . . . 0.0 103.643 175.314 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 19.6 m-85 -105.84 158.08 17.01 Favored 'General case' 0 C--N 1.36 1.024 0 C-N-CA 126.46 1.904 . . . . 0.0 106.14 177.662 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 2.6 t -82.31 144.59 30.49 Favored 'General case' 0 C--N 1.367 1.331 0 CA-C-N 122.111 2.232 . . . . 0.0 115.964 -176.247 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 61.1 p -146.77 -170.91 3.64 Favored 'General case' 0 C--N 1.364 1.197 0 C-N-CA 127.767 2.427 . . . . 0.0 112.671 -177.471 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 45.1 m-85 -141.05 152.76 45.1 Favored 'General case' 0 C--N 1.358 0.958 0 C-N-CA 129.984 3.313 . . . . 0.0 109.921 171.384 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . 0.303 2.9 p90 -144.68 158.97 43.56 Favored 'General case' 0 C--N 1.365 1.275 0 C-N-CA 126.999 2.12 . . . . 0.0 110.035 172.832 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 12.6 t80 -104.17 130.31 51.93 Favored 'General case' 0 C--N 1.365 1.263 0 N-CA-C 106.931 -1.507 . . . . 0.0 106.931 179.018 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.534 ' NZ ' ' H ' ' A' ' 28' ' ' THR . 0.0 OUTLIER -96.27 112.57 24.27 Favored 'General case' 0 N--CA 1.446 -0.671 0 C-N-CA 125.099 1.36 . . . . 0.0 110.047 179.222 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . 0.418 ' N ' ' HZ2' ' A' ' 26' ' ' LYS . 38.2 t-105 -50.47 -48.57 56.62 Favored 'General case' 0 C--N 1.355 0.819 0 C-N-CA 129.553 3.141 . . . . 0.0 116.494 175.007 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.534 ' H ' ' NZ ' ' A' ' 26' ' ' LYS 0.294 39.7 p -82.3 -25.7 33.73 Favored 'General case' 0 C--N 1.36 1.052 0 C-N-CA 124.471 1.109 . . . . 0.0 112.792 178.362 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -78.1 -38.9 43.01 Favored 'General case' 0 C--N 1.378 1.813 0 CA-C-N 120.779 1.627 . . . . 0.0 114.072 172.799 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . 0.301 52.5 mmtt 78.45 21.36 0.8 Allowed 'General case' 0 C--N 1.369 1.418 0 C-N-CA 128.107 2.563 . . . . 0.0 113.547 179.742 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 63.1 tttt -147.6 168.41 22.07 Favored 'General case' 0 C--N 1.355 0.835 0 C-N-CA 126.578 1.951 . . . . 0.0 106.509 -179.931 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 79.1 m -81.21 146.05 30.67 Favored 'General case' 0 C--N 1.358 0.942 0 C-N-CA 126.961 2.104 . . . . 0.0 115.745 179.894 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 12.8 mt -122.83 142.97 39.15 Favored Pre-proline 0 C--N 1.358 0.941 0 C-N-CA 125.75 1.62 . . . . 0.0 109.828 177.086 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 63.7 Cg_endo -85.6 147.32 9.68 Favored 'Trans proline' 0 C--N 1.35 0.645 0 C-N-CA 124.403 3.402 . . . . 0.0 111.077 169.181 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . 0.386 3.4 p90 -145.42 -157.73 0.82 Allowed 'General case' 0 C--N 1.352 0.695 0 CA-C-N 114.95 -1.023 . . . . 0.0 109.41 174.749 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 40.2 mt -140.31 153.85 46.6 Favored 'General case' 0 N--CA 1.436 -1.134 0 C-N-CA 128.31 2.644 . . . . 0.0 104.153 -178.598 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -137.98 127.17 24.42 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 127.817 2.447 . . . . 0.0 108.465 -178.169 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 96.7 p -83.71 4.51 28.42 Favored 'General case' 0 C--N 1.368 1.371 0 N-CA-C 119.714 3.227 . . . . 0.0 119.714 -176.247 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 88.2 -31.25 4.83 Favored Glycine 0 C--N 1.355 1.615 0 C-N-CA 129.252 3.31 . . . . 0.0 120.103 172.58 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -136.22 31.78 2.9 Favored 'General case' 0 CA--C 1.509 -0.597 0 O-C-N 121.441 -1.035 . . . . 0.0 109.931 -175.681 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -150.36 36.91 0.93 Allowed Glycine 0 C--N 1.355 1.599 0 N-CA-C 110.457 -1.057 . . . . 0.0 110.457 176.186 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -101.3 -177.42 28.84 Favored Glycine 0 C--N 1.357 1.739 0 C-N-CA 125.455 1.502 . . . . 0.0 113.99 174.72 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . 0.5 ' H ' ' NH1' ' A' ' 46' ' ' ARG 0.381 42.0 p30 -125.01 -96.0 0.45 Allowed 'General case' 0 C--N 1.356 0.891 0 O-C-N 120.945 -1.327 . . . . 0.0 111.225 174.322 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -145.3 -16.56 0.49 Allowed 'General case' 0 C--N 1.348 0.541 0 C-N-CA 125.205 1.402 . . . . 0.0 112.274 -174.984 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 50.6 t30 -94.11 74.1 4.05 Favored 'General case' 0 C--N 1.363 1.168 0 O-C-N 120.165 -1.584 . . . . 0.0 111.738 -177.939 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.5 ' NH1' ' H ' ' A' ' 43' ' ' ASN 0.295 0.0 OUTLIER -137.27 130.55 31.03 Favored 'General case' 0 C--N 1.352 0.674 0 CA-C-O 124.271 1.986 . . . . 0.0 108.868 173.638 . . . . . . . . 4 4 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . 0.441 ' CD2' ' HA ' ' A' ' 53' ' ' CYS . 21.7 m-85 -111.31 141.94 44.18 Favored 'General case' 0 CA--C 1.507 -0.685 0 C-N-CA 127.914 2.486 . . . . 0.0 108.598 -174.763 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 31.0 mt-30 -67.35 -64.63 0.82 Allowed 'General case' 0 C--N 1.363 1.167 0 C-N-CA 127.097 2.159 . . . . 0.0 114.609 -175.572 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 31.4 p -121.47 171.9 8.46 Favored 'General case' 0 C--N 1.353 0.743 0 C-N-CA 126.492 1.917 . . . . 0.0 107.499 177.791 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 17.7 tt -59.36 -25.71 31.73 Favored 'Isoleucine or valine' 0 C--N 1.363 1.174 0 C-N-CA 127.802 2.441 . . . . 0.0 117.227 178.78 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -88.48 -17.32 57.25 Favored Glycine 0 C--N 1.353 1.503 0 N-CA-C 116.669 1.427 . . . . 0.0 116.669 174.301 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 15.8 tp10 -70.05 -34.62 73.45 Favored 'General case' 0 C--N 1.378 1.835 0 CA-C-N 120.015 1.908 . . . . 0.0 112.016 174.547 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . 0.441 ' HA ' ' CD2' ' A' ' 47' ' ' PHE . 48.7 t -47.92 -44.17 29.67 Favored 'General case' 0 C--N 1.361 1.108 0 C-N-CA 128.575 2.75 . . . . 0.0 116.024 175.444 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 8.4 mtp85 -74.34 -26.67 60.29 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 130.964 3.705 . . . . 0.0 117.385 -179.174 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 12.5 mttp -80.34 -11.72 59.67 Favored 'General case' 0 C--N 1.364 1.225 0 C-N-CA 125.572 1.549 . . . . 0.0 114.815 -179.634 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 9.9 mtmm -103.52 -28.69 11.6 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 126.664 1.986 . . . . 0.0 109.38 175.001 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 53.6 m -125.86 6.68 7.36 Favored 'General case' 0 C--N 1.365 1.265 0 N-CA-C 119.551 3.167 . . . . 0.0 119.551 -170.502 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 16.3 mt -134.54 -15.39 2.14 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 123.435 2.834 . . . . 0.0 113.334 174.826 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 77.49 57.47 3.59 Favored Glycine 0 C--N 1.361 1.931 0 C-N-CA 128.238 2.828 . . . . 0.0 113.02 -171.443 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 16.0 ptpt . . . . . 0 C--O 1.259 1.604 0 N-CA-C 107.889 -1.152 . . . . 0.0 107.889 -176.197 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' TRP . . . . . 0.515 ' CZ2' ' HB3' ' A' ' 3' ' ' PRO . 81.0 t90 . . . . . 0 N--CA 1.434 -1.263 0 N-CA-C 107.099 -1.445 . . . . 0.0 107.099 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 81.2 mt-30 -149.38 149.0 28.02 Favored Pre-proline 0 C--N 1.355 0.829 1 N-CA-C 97.549 -4.982 . . . . 0.0 97.549 174.22 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.515 ' HB3' ' CZ2' ' A' ' 1' ' ' TRP . 60.5 Cg_endo -86.95 118.84 1.48 Allowed 'Trans proline' 0 CA--C 1.557 1.635 0 CA-C-N 125.045 2.838 . . . . 0.0 115.845 -162.997 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.445 ' HD3' ' HA ' ' A' ' 3' ' ' PRO . 30.0 Cg_exo -76.09 -110.53 0.01 OUTLIER 'Trans proline' 0 C--N 1.362 1.287 1 C-N-CA 126.552 4.834 . . . . 0.0 114.658 178.942 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . 0.487 ' CE3' ' CD2' ' A' ' 6' ' ' TYR 0.316 36.5 p-90 -88.46 -70.47 0.64 Allowed 'General case' 0 C--N 1.379 1.854 0 C-N-CA 126.671 1.988 . . . . 0.0 116.334 -178.695 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.487 ' CD2' ' CE3' ' A' ' 5' ' ' TRP . 0.0 OUTLIER -32.06 -55.76 0.31 Allowed 'General case' 0 C--N 1.36 1.042 1 C-N-CA 135.74 5.616 . . . . 0.0 118.07 -173.338 . . . . . . . . 4 4 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.434 ' O ' ' HB2' ' A' ' 27' ' ' TRP . 0.1 OUTLIER -55.13 -39.78 69.8 Favored 'General case' 0 N--CA 1.444 -0.769 0 C-N-CA 130.287 3.435 . . . . 0.0 114.553 -179.8 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 10.1 mtpp -105.12 13.5 30.65 Favored 'General case' 0 C--N 1.356 0.867 0 C-N-CA 127.559 2.344 . . . . 0.0 110.56 -178.074 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.436 ' HB3' ' HB2' ' A' ' 45' ' ' ASN . 3.7 tp10 -93.46 132.84 29.35 Favored Pre-proline 0 C--N 1.368 1.385 0 O-C-N 120.012 -1.68 . . . . 0.0 112.458 -171.884 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.4 ' HD3' ' HA ' ' A' ' 9' ' ' GLU . 53.4 Cg_exo -66.46 122.71 10.2 Favored 'Trans proline' 0 C--N 1.359 1.091 0 C-N-CA 124.054 3.17 . . . . 0.0 116.88 -165.957 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 8.4 p -72.52 132.53 33.27 Favored 'Isoleucine or valine' 0 C--N 1.36 1.026 0 C-N-CA 125.882 1.673 . . . . 0.0 111.743 175.924 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . 0.251 1.6 mmp_? -146.41 124.43 12.07 Favored 'General case' 0 C--N 1.353 0.751 0 CA-C-O 115.063 -2.399 . . . . 0.0 112.956 -168.822 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.278 6.5 tt -88.44 -35.16 7.63 Favored 'Isoleucine or valine' 0 C--N 1.384 2.097 0 CA-C-N 124.922 3.51 . . . . 0.0 115.179 177.64 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 96.47 -68.4 0.93 Allowed Glycine 0 C--N 1.358 1.764 0 N-CA-C 117.388 1.715 . . . . 0.0 117.388 175.081 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 21.6 m 77.22 70.7 0.06 Allowed 'General case' 0 C--N 1.366 1.313 0 C-N-CA 125.822 1.649 . . . . 0.0 110.649 -171.986 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 3.0 t -128.72 -72.61 0.6 Allowed 'General case' 0 CA--C 1.506 -0.717 0 CA-C-O 121.687 0.756 . . . . 0.0 111.143 -176.438 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 12.5 mmmm -97.49 -76.29 0.52 Allowed 'General case' 0 C--N 1.349 0.586 0 C-N-CA 125.869 1.668 . . . . 0.0 113.827 -172.464 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.548 ' HG3' ' H ' ' A' ' 19' ' ' GLN . 20.5 tptp -146.71 -152.56 0.44 Allowed 'General case' 0 CA--C 1.509 -0.596 0 N-CA-C 102.025 -3.324 . . . . 0.0 102.025 -176.657 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.548 ' H ' ' HG3' ' A' ' 18' ' ' LYS . 23.4 mp0 -133.75 113.23 12.08 Favored 'General case' 0 N--CA 1.438 -1.068 0 N-CA-C 101.983 -3.34 . . . . 0.0 101.983 170.979 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 33.1 m-85 -107.18 141.66 38.11 Favored 'General case' 0 C--N 1.355 0.845 0 O-C-N 120.484 -1.385 . . . . 0.0 107.921 179.65 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.7 t -66.39 122.65 18.01 Favored 'General case' 0 C--N 1.372 1.573 0 N-CA-C 117.695 2.48 . . . . 0.0 117.695 -176.619 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 1.2 t -120.73 -175.68 3.08 Favored 'General case' 0 C--N 1.363 1.159 0 C-N-CA 129.157 2.983 . . . . 0.0 109.175 -178.881 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 37.0 m-85 -146.12 141.62 27.71 Favored 'General case' 0 C--N 1.349 0.56 0 C-N-CA 129.854 3.262 . . . . 0.0 104.312 170.716 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 16.0 p90 -124.57 148.87 47.56 Favored 'General case' 0 C--N 1.358 0.967 0 N-CA-C 107.499 -1.297 . . . . 0.0 107.499 172.102 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 10.4 t80 -94.76 126.11 39.86 Favored 'General case' 0 C--N 1.363 1.189 0 N-CA-C 104.129 -2.545 . . . . 0.0 104.129 175.639 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -100.0 113.32 25.82 Favored 'General case' 0 N--CA 1.425 -1.682 0 C-N-CA 125.569 1.548 . . . . 0.0 108.85 -175.232 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . 0.434 ' HB2' ' O ' ' A' ' 7' ' ' CYS . 45.8 t-105 -53.54 -46.96 70.38 Favored 'General case' 0 C--N 1.361 1.097 0 C-N-CA 129.544 3.138 . . . . 0.0 117.457 -177.922 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 11.0 p -83.49 -5.54 59.19 Favored 'General case' 0 C--N 1.353 0.749 0 C-N-CA 124.542 1.137 . . . . 0.0 113.604 179.456 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -97.06 -47.93 5.59 Favored 'General case' 0 C--N 1.363 1.188 0 C-N-CA 124.819 1.247 . . . . 0.0 111.868 174.993 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . 0.294 0.7 OUTLIER 83.45 26.38 0.11 Allowed 'General case' 0 C--N 1.366 1.287 0 C-N-CA 127.672 2.389 . . . . 0.0 112.489 -178.333 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 7.8 tmtm? -147.78 164.22 34.3 Favored 'General case' 0 C--N 1.356 0.868 0 C-N-CA 128.008 2.523 . . . . 0.0 107.344 179.197 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 64.6 m -81.98 118.81 23.27 Favored 'General case' 0 C--N 1.363 1.195 0 C-N-CA 129.739 3.216 . . . . 0.0 114.606 178.831 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 29.6 mt -105.26 145.73 31.35 Favored Pre-proline 0 C--N 1.354 0.8 0 O-C-N 119.83 -1.794 . . . . 0.0 111.203 177.924 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 69.2 Cg_endo -86.92 144.28 7.24 Favored 'Trans proline' 0 N--CA 1.46 -0.452 0 C-N-CA 123.129 2.552 . . . . 0.0 112.245 173.481 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -149.03 171.16 16.83 Favored 'General case' 0 N--CA 1.444 -0.755 0 N-CA-C 101.338 -3.579 . . . . 0.0 101.338 170.255 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 8.4 mp -111.72 156.23 22.23 Favored 'General case' 0 N--CA 1.449 -0.519 0 C-N-CA 125.967 1.707 . . . . 0.0 106.882 178.398 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 8.3 t80 -116.95 139.69 50.35 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 127.137 2.175 . . . . 0.0 112.157 -179.104 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.3 t -92.76 -4.97 52.18 Favored 'General case' 0 C--N 1.377 1.786 0 N-CA-C 117.401 2.371 . . . . 0.0 117.401 178.291 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 106.21 -44.04 1.56 Allowed Glycine 0 C--N 1.366 2.197 0 CA-C-N 120.908 1.686 . . . . 0.0 116.541 170.856 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -133.69 139.37 46.38 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 103.634 -2.728 . . . . 0.0 103.634 177.322 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 103.09 -12.2 55.69 Favored Glycine 0 C--N 1.358 1.775 0 O-C-N 121.329 -0.857 . . . . 0.0 113.606 -173.75 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -102.93 177.24 25.27 Favored Glycine 0 C--N 1.361 1.922 0 C-N-CA 127.707 2.575 . . . . 0.0 112.622 177.052 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 15.1 p30 -119.72 -100.13 0.44 Allowed 'General case' 0 C--N 1.365 1.269 0 N-CA-C 115.446 1.647 . . . . 0.0 115.446 179.241 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -158.75 17.87 0.2 Allowed 'General case' 0 C--N 1.363 1.19 0 N-CA-C 114.981 1.475 . . . . 0.0 114.981 -172.155 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . 0.436 ' HB2' ' HB3' ' A' ' 9' ' ' GLU . 36.6 t30 -106.69 55.64 0.66 Allowed 'General case' 0 C--N 1.366 1.315 0 N-CA-C 104.401 -2.444 . . . . 0.0 104.401 172.47 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 7.0 ptp180 -144.07 105.31 4.24 Favored 'General case' 0 CA--C 1.5 -0.95 0 CA-C-O 124.721 2.201 . . . . 0.0 106.442 -172.08 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 18.4 m-85 -107.14 133.53 51.61 Favored 'General case' 0 N--CA 1.434 -1.241 0 CA-C-N 111.87 -2.423 . . . . 0.0 109.04 -169.849 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 30.9 mt-30 -55.23 -40.0 70.37 Favored 'General case' 0 C--N 1.355 0.845 0 C-N-CA 130.221 3.409 . . . . 0.0 116.605 -177.223 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 81.9 p -136.3 174.08 11.01 Favored 'General case' 0 C--N 1.356 0.862 0 C-N-CA 127.551 2.341 . . . . 0.0 107.656 178.163 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 18.6 tt -68.32 -13.04 16.52 Favored 'Isoleucine or valine' 0 C--N 1.36 1.049 0 C-N-CA 129.36 3.064 . . . . 0.0 116.883 177.58 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -99.61 -25.27 9.36 Favored Glycine 0 C--N 1.353 1.501 0 N-CA-C 116.72 1.448 . . . . 0.0 116.72 176.646 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -68.79 -21.77 64.31 Favored 'General case' 0 N--CA 1.491 1.611 0 CA-C-N 120.254 2.027 . . . . 0.0 113.188 176.509 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 22.7 t -70.84 -23.7 62.38 Favored 'General case' 0 CA--C 1.557 1.222 0 C-N-CA 129.105 2.962 . . . . 0.0 113.593 173.659 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 47.3 mtm180 -86.07 -30.79 22.32 Favored 'General case' 0 C--N 1.354 0.8 0 N-CA-C 116.719 2.118 . . . . 0.0 116.719 -175.102 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 84.1 tttt -77.29 -10.12 59.24 Favored 'General case' 0 C--N 1.369 1.439 0 C-N-CA 126.397 1.879 . . . . 0.0 113.6 -177.509 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 31.6 mtmt -102.06 -30.38 11.21 Favored 'General case' 0 N--CA 1.442 -0.856 0 C-N-CA 126.648 1.979 . . . . 0.0 114.132 -178.878 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . 0.43 ' SG ' ' HB2' ' A' ' 6' ' ' TYR . 47.3 m -139.4 25.46 2.43 Favored 'General case' 0 C--N 1.36 1.031 0 O-C-N 120.652 -1.28 . . . . 0.0 114.275 -166.644 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 18.3 mt -145.98 -27.62 0.43 Allowed 'General case' 0 C--N 1.345 0.405 0 O-C-N 120.625 -1.297 . . . . 0.0 111.735 174.436 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 86.61 57.58 2.06 Favored Glycine 0 C--N 1.364 2.094 0 C-N-CA 126.739 2.114 . . . . 0.0 112.706 -173.169 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 15.6 ptmt . . . . . 0 C--O 1.262 1.754 0 N-CA-C 106.433 -1.691 . . . . 0.0 106.433 -176.274 . . . . . . . . 0 0 . 1 stop_ save_