data_2mxw_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 2mxw _Structure_validation_residue.Date_analyzed 2016-10-08 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 17.7 m-85 . . . . . 0 CA--C 1.54 0.59 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 96.2 Cg_endo -65.36 -176.06 0.48 Allowed 'Trans proline' 0 CA--C 1.537 0.644 0 C-N-CA 123.623 2.882 . . . . 0.0 111.594 169.404 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 48.8 t -113.95 85.82 10.4 Favored Pre-proline 0 CA--C 1.541 0.609 0 N-CA-C 106.987 -1.486 . . . . 0.0 106.987 178.09 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -67.0 175.53 5.47 Favored 'Trans proline' 0 C--N 1.35 0.614 0 C-N-CA 123.39 2.726 . . . . 0.0 112.121 -176.881 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 63.3 t0 -142.46 125.23 15.99 Favored 'General case' 0 C--O 1.237 0.445 0 N-CA-C 105.154 -2.165 . . . . 0.0 105.154 166.429 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 5.3 p -55.33 -23.05 13.0 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.433 0 C-N-CA 123.816 0.846 . . . . 0.0 111.499 175.531 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 31.6 t -67.65 2.29 1.96 Allowed 'General case' 0 CA--C 1.54 0.573 0 O-C-N 120.895 -1.128 . . . . 0.0 112.248 175.565 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 47.3 p -114.65 3.22 14.72 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 125.272 1.429 . . . . 0.0 110.878 174.608 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 14.7 m-30 -85.57 175.79 8.58 Favored 'General case' 0 C--O 1.236 0.391 0 O-C-N 121.03 -1.044 . . . . 0.0 109.579 -179.362 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 15.7 mt-30 -120.14 114.27 21.7 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 124.271 1.029 . . . . 0.0 110.119 -178.348 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 69.0 t80 -72.79 135.74 45.31 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 123.344 0.658 . . . . 0.0 110.407 175.116 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -118.98 75.81 1.06 Allowed 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 125.421 1.488 . . . . 0.0 108.649 -173.543 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -56.52 -19.49 15.82 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 125.343 1.457 . . . . 0.0 114.662 -167.528 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 1.3 t -54.67 -30.76 56.32 Favored 'General case' 0 CA--C 1.554 1.111 0 C-N-CA 124.705 1.202 . . . . 0.0 110.234 170.427 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 47.1 m -132.12 -16.94 2.77 Favored 'General case' 0 C--N 1.346 0.439 0 N-CA-C 115.61 1.707 . . . . 0.0 115.61 -178.854 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 99.78 2.39 56.25 Favored Glycine 0 CA--C 1.535 1.326 0 CA-C-N 120.865 1.666 . . . . 0.0 114.297 172.223 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 80.4 m-85 -95.32 169.3 10.17 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 125.106 1.363 . . . . 0.0 110.657 178.083 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 71.3 m-85 -102.09 151.91 21.6 Favored 'General case' 0 N--CA 1.453 -0.319 0 N-CA-C 106.335 -1.728 . . . . 0.0 106.335 160.411 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 40.6 t80 -115.68 140.4 49.23 Favored 'General case' 0 C--O 1.241 0.625 0 C-N-CA 125.926 1.69 . . . . 0.0 107.457 175.525 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -121.96 76.34 39.65 Favored Pre-proline 0 N--CA 1.444 -0.763 0 N-CA-C 106.636 -1.616 . . . . 0.0 106.636 -158.561 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 27.2 Cg_endo -60.9 -19.49 62.53 Favored 'Trans proline' 0 CA--C 1.537 0.665 0 C-N-CA 122.415 2.077 . . . . 0.0 114.353 -168.536 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 14.8 tt0 -68.09 -22.79 64.9 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.539 1.135 . . . . 0.0 111.33 178.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -116.13 -58.21 2.12 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 127.725 2.41 . . . . 0.0 107.091 -178.309 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 113.88 -7.59 23.71 Favored Glycine 0 CA--C 1.53 1.005 0 C-N-CA 127.443 2.449 . . . . 0.0 110.861 -169.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -59.5 168.71 1.49 Allowed 'General case' 0 N--CA 1.434 -1.237 0 C-N-CA 129.118 2.967 . . . . 0.0 111.086 170.95 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 63.4 m-85 -116.1 140.46 49.26 Favored 'General case' 0 C--O 1.238 0.478 0 CA-C-N 114.45 -1.25 . . . . 0.0 108.658 158.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 58.6 t80 -105.41 153.9 21.04 Favored 'General case' 0 C--N 1.325 -0.493 0 C-N-CA 125.387 1.475 . . . . 0.0 108.093 171.345 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 6.9 t0 -119.76 142.77 33.64 Favored Pre-proline 0 C--N 1.329 -0.31 0 N-CA-C 105.898 -1.89 . . . . 0.0 105.898 171.255 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -73.48 -28.68 11.84 Favored 'Trans proline' 0 N--CA 1.455 -0.779 0 C-N-CA 121.369 1.38 . . . . 0.0 113.01 -174.35 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 52.3 m-80 -95.24 -25.41 16.37 Favored 'General case' 0 N--CA 1.448 -0.528 0 C-N-CA 125.986 1.714 . . . . 0.0 110.467 -177.603 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 4.1 m -121.03 95.65 4.78 Favored 'General case' 0 C--O 1.223 -0.317 0 C-N-CA 124.536 1.135 . . . . 0.0 108.733 -178.654 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 20.7 mp0 -64.06 1.15 0.74 Allowed 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 125.665 1.586 . . . . 0.0 114.121 179.417 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 26.4 m-85 -77.29 109.04 10.86 Favored 'General case' 0 C--O 1.234 0.26 0 C-N-CA 126.024 1.73 . . . . 0.0 108.97 169.657 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 18.8 m-85 -67.23 157.38 33.97 Favored 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 125.472 1.509 . . . . 0.0 109.442 179.872 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . 0.427 ' CZ ' ' HA ' ' A' ' 46' ' ' ALA . 7.8 t80 -118.86 105.17 11.24 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 125.443 1.497 . . . . 0.0 107.885 178.875 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 30.1 t30 -79.25 92.18 5.09 Favored 'General case' 0 N--CA 1.445 -0.7 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 168.152 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . 0.427 ' HA ' ' CZ ' ' A' ' 44' ' ' TYR . . . -56.54 -35.18 67.81 Favored 'General case' 0 N--CA 1.456 -0.144 0 C-N-CA 124.046 0.938 . . . . 0.0 112.482 179.743 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -45.76 -55.78 6.11 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 126.157 1.783 . . . . 0.0 111.606 -176.941 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.9 m -109.99 -1.84 17.42 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 123.736 0.814 . . . . 0.0 111.36 -172.827 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 40.9 mt-30 50.46 60.59 3.74 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 126.302 1.841 . . . . 0.0 109.442 -163.741 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -106.85 149.29 27.57 Favored 'General case' 0 C--O 1.233 0.198 0 N-CA-C 107.992 -1.114 . . . . 0.0 107.992 167.237 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 3.8 m-85 -104.79 131.03 52.75 Favored 'General case' 0 CA--C 1.515 -0.397 0 N-CA-C 105.475 -2.046 . . . . 0.0 105.475 168.498 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 49.9 mt -127.08 177.89 6.36 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 125.521 1.528 . . . . 0.0 108.164 -171.709 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 26.1 p90 -142.94 156.3 44.86 Favored 'General case' 0 N--CA 1.447 -0.618 0 N-CA-C 108.845 -0.798 . . . . 0.0 108.845 160.89 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 26.6 t-105 -82.52 118.95 23.63 Favored 'General case' 0 N--CA 1.448 -0.562 0 N-CA-C 106.937 -1.505 . . . . 0.0 106.937 171.288 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 20.9 t0 -109.39 93.58 4.58 Favored 'General case' 0 CA--C 1.516 -0.365 0 N-CA-C 107.918 -1.141 . . . . 0.0 107.918 171.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -62.89 -12.4 42.29 Favored Glycine 0 CA--C 1.53 1.029 0 CA-C-O 117.947 -1.474 . . . . 0.0 113.641 179.846 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 11.7 mt-10 -75.77 -32.95 60.14 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 121.228 2.514 . . . . 0.0 109.363 173.911 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 51.0 mtt85 -104.43 -5.06 22.02 Favored 'General case' 0 CA--C 1.529 0.137 0 C-N-CA 125.201 1.4 . . . . 0.0 111.727 -177.807 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 38.9 mtp180 44.28 43.75 6.16 Favored 'General case' 0 CA--C 1.514 -0.436 0 C-N-CA 128.604 2.762 . . . . 0.0 110.836 178.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 4.9 t -145.43 172.18 13.57 Favored 'General case' 0 N--CA 1.444 -0.737 0 N-CA-C 106.573 -1.639 . . . . 0.0 106.573 177.874 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 71.0 m-85 -94.58 140.42 29.88 Favored 'General case' 0 C--O 1.242 0.71 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 170.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -125.79 154.45 73.35 Favored Pre-proline 0 C--N 1.321 -0.661 0 C-N-CA 126.161 1.784 . . . . 0.0 107.182 173.124 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_endo -68.33 145.52 65.96 Favored 'Trans proline' 0 N--CA 1.45 -1.081 0 C-N-CA 122.132 1.888 . . . . 0.0 109.62 172.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 0.322 0 C-N-CA 124.207 1.003 . . . . 0.0 111.411 173.872 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 28.5 m-85 . . . . . 0 C--O 1.239 0.544 0 CA-C-O 119.346 -0.359 . . . . 0.0 111.49 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 68.5 Cg_endo -74.51 -178.98 4.38 Favored 'Trans proline' 0 C--N 1.349 0.586 0 C-N-CA 122.957 2.438 . . . . 0.0 110.207 171.896 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 25.0 t -104.73 86.46 1.46 Allowed Pre-proline 0 CA--C 1.538 0.506 0 N-CA-C 106.05 -1.833 . . . . 0.0 106.05 176.422 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -68.67 170.62 14.81 Favored 'Trans proline' 0 N--CA 1.457 -0.639 0 C-N-CA 123.125 2.55 . . . . 0.0 109.134 -176.616 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 12.0 t0 -144.53 138.28 27.43 Favored 'General case' 0 CA--C 1.511 -0.532 0 N-CA-C 107.342 -1.355 . . . . 0.0 107.342 176.011 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.516 ' HA ' ' CD2' ' A' ' 18' ' ' TYR . 1.5 t -69.1 -19.27 23.6 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 N-CA-C 107.902 -1.147 . . . . 0.0 107.902 178.399 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 86.7 p -61.66 -15.66 41.87 Favored 'General case' 0 N--CA 1.43 -1.446 0 N-CA-C 113.606 0.965 . . . . 0.0 113.606 -179.384 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 14.0 t -124.08 9.92 8.73 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 126.308 1.843 . . . . 0.0 112.807 177.836 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . 0.516 ' CD2' ' HA ' ' A' ' 15' ' ' VAL . 18.3 m-30 -68.86 170.59 9.35 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-N 120.393 1.451 . . . . 0.0 108.488 166.577 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 14.3 mt-30 -118.1 106.25 12.67 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 124.521 1.128 . . . . 0.0 110.028 177.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 84.8 t80 -56.03 141.76 38.78 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 124.599 1.16 . . . . 0.0 111.456 170.879 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -126.04 95.09 4.28 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 124.158 0.983 . . . . 0.0 109.312 179.727 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -57.35 -23.21 47.51 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 125.176 1.39 . . . . 0.0 113.285 -177.637 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 5.2 t -48.59 -35.58 13.82 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 127.128 2.171 . . . . 0.0 109.659 172.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -120.68 -55.76 1.99 Allowed 'General case' 0 N--CA 1.445 -0.719 0 C-N-CA 124.167 0.987 . . . . 0.0 108.538 -177.768 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 117.0 28.71 2.36 Favored Glycine 0 CA--C 1.527 0.833 0 C-N-CA 123.965 0.793 . . . . 0.0 114.424 -174.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 39.4 m-85 -130.82 165.33 23.24 Favored 'General case' 0 C--O 1.239 0.504 0 C-N-CA 126.244 1.817 . . . . 0.0 106.804 -176.261 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 79.6 m-85 -90.41 140.17 29.97 Favored 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 124.554 1.141 . . . . 0.0 108.037 173.265 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 31.3 t80 -102.34 134.86 44.95 Favored 'General case' 0 C--O 1.237 0.433 0 N-CA-C 107.459 -1.311 . . . . 0.0 107.459 170.039 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -112.69 77.0 2.28 Favored Pre-proline 0 N--CA 1.447 -0.587 0 C-N-CA 125.89 1.676 . . . . 0.0 109.429 -166.347 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -67.22 -6.27 15.81 Favored 'Trans proline' 0 N--CA 1.46 -0.465 0 C-N-CA 122.929 2.42 . . . . 0.0 114.145 -170.82 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 3.9 tt0 -63.29 -26.11 68.62 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 118.516 0.598 . . . . 0.0 110.408 174.314 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 7.3 p -139.98 -21.15 0.88 Allowed 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 124.78 1.232 . . . . 0.0 113.474 179.453 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 97.45 14.81 39.95 Favored Glycine 0 CA--C 1.529 0.963 0 CA-C-N 119.054 0.843 . . . . 0.0 112.764 -178.463 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 24.3 mt -86.51 -178.33 6.39 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 118.634 1.217 . . . . 0.0 109.18 175.664 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 39.0 m-85 -126.63 146.42 50.18 Favored 'General case' 0 C--O 1.238 0.461 0 C-N-CA 124.507 1.123 . . . . 0.0 109.825 166.374 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 85.9 t80 -117.83 154.79 31.21 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.932 1.693 . . . . 0.0 109.348 177.878 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -124.95 143.81 45.11 Favored Pre-proline 0 CA--C 1.535 0.383 0 C-N-CA 126.248 1.819 . . . . 0.0 109.151 171.927 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 70.7 Cg_endo -79.33 -31.92 1.93 Allowed 'Trans proline' 0 N--CA 1.459 -0.516 0 C-N-CA 123.691 2.927 . . . . 0.0 113.853 -176.238 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 8.2 m-80 -81.98 -22.04 36.82 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 124.049 0.939 . . . . 0.0 109.592 176.656 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 38.4 m -137.6 98.1 3.61 Favored 'General case' 0 CA--C 1.513 -0.477 0 C-N-CA 125.501 1.521 . . . . 0.0 108.94 -170.554 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 19.7 mp0 -67.35 24.33 0.02 OUTLIER 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 127.733 2.413 . . . . 0.0 113.203 -179.278 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 33.2 m-85 -99.25 101.44 12.76 Favored 'General case' 0 CA--C 1.536 0.42 0 O-C-N 120.202 -1.561 . . . . 0.0 108.261 177.501 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 29.6 m-85 -65.69 111.83 3.38 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 128.554 2.741 . . . . 0.0 110.604 -179.747 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 63.8 t80 -75.33 127.29 32.81 Favored 'General case' 0 C--N 1.326 -0.452 0 C-N-CA 125.618 1.567 . . . . 0.0 110.448 -176.495 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 45.0 t30 -99.3 81.33 2.53 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 126.886 2.074 . . . . 0.0 109.54 175.364 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -46.08 -36.79 6.08 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 124.749 1.22 . . . . 0.0 111.992 176.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.7 tt0 -49.78 -31.07 10.75 Favored 'General case' 0 N--CA 1.447 -0.611 0 C-N-CA 127.573 2.349 . . . . 0.0 114.121 -178.425 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 40.2 m -134.04 17.13 3.81 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 123.52 0.728 . . . . 0.0 111.223 172.146 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 40.8 mt-30 44.99 32.31 0.83 Allowed 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 125.519 1.528 . . . . 0.0 112.006 -163.376 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -93.6 168.33 11.1 Favored 'General case' 0 N--CA 1.452 -0.345 0 O-C-N 120.9 -1.125 . . . . 0.0 109.848 -176.167 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 5.7 m-85 -116.57 128.07 55.08 Favored 'General case' 0 N--CA 1.446 -0.633 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 -174.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 22.6 mt -124.02 178.24 5.39 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 127.326 2.25 . . . . 0.0 109.885 179.686 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 5.1 p90 -145.69 152.44 39.62 Favored 'General case' 0 C--O 1.235 0.318 0 C-N-CA 127.788 2.435 . . . . 0.0 106.943 168.441 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 69.2 t-105 -77.1 142.98 39.53 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 107.316 -1.364 . . . . 0.0 107.316 164.569 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 63.9 t0 -131.85 104.53 6.93 Favored 'General case' 0 C--O 1.234 0.272 0 N-CA-C 108.876 -0.786 . . . . 0.0 108.876 169.708 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -75.81 -7.63 83.82 Favored Glycine 0 CA--C 1.533 1.163 0 C-N-CA 124.362 0.982 . . . . 0.0 113.345 -178.935 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 73.7 mt-10 -75.04 -31.57 61.34 Favored 'General case' 0 CA--C 1.531 0.222 0 O-C-N 121.066 -1.255 . . . . 0.0 109.933 170.342 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 63.9 mtt180 -110.04 -7.31 14.95 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 125.502 1.521 . . . . 0.0 112.668 -177.115 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 61.3 mtt85 44.98 55.66 5.97 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 128.294 2.638 . . . . 0.0 110.752 -174.02 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 11.3 t -150.72 169.46 21.56 Favored 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 123.268 0.627 . . . . 0.0 109.833 174.051 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 93.4 m-85 -92.43 134.88 34.52 Favored 'General case' 0 C--O 1.238 0.458 0 N-CA-C 107.23 -1.396 . . . . 0.0 107.23 164.071 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -126.95 157.7 71.02 Favored Pre-proline 0 C--N 1.322 -0.608 0 C-N-CA 127.026 2.13 . . . . 0.0 111.113 178.362 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_endo -75.23 123.41 7.74 Favored 'Trans proline' 0 CA--C 1.533 0.471 0 C-N-CA 123.925 3.083 . . . . 0.0 112.568 -177.939 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.298 0 N-CA-C 115.831 1.789 . . . . 0.0 115.831 -169.091 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 61.4 m-85 . . . . . 0 C--O 1.242 0.708 0 N-CA-C 112.013 0.375 . . . . 0.0 112.013 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 92.3 Cg_endo -68.62 179.28 3.2 Favored 'Trans proline' 0 N--CA 1.456 -0.713 0 C-N-CA 123.541 2.827 . . . . 0.0 109.976 167.639 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 10.7 t -105.1 88.39 2.41 Favored Pre-proline 0 N--CA 1.45 -0.445 0 N-CA-C 106.748 -1.575 . . . . 0.0 106.748 176.403 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_endo -58.67 170.89 2.26 Favored 'Trans proline' 0 CA--C 1.545 1.048 0 CA-C-N 120.248 1.124 . . . . 0.0 110.397 171.703 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 15.3 t0 -132.84 129.25 38.22 Favored 'General case' 0 N--CA 1.447 -0.621 0 N-CA-C 106.139 -1.8 . . . . 0.0 106.139 164.524 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 1.7 t -59.0 -26.6 33.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 114.515 -1.221 . . . . 0.0 108.149 173.545 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 36.4 p -60.34 -38.22 83.1 Favored 'General case' 0 N--CA 1.437 -1.114 0 C-N-CA 118.033 -1.467 . . . . 0.0 109.047 -172.42 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 16.4 p -87.68 18.33 4.09 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 126.436 1.894 . . . . 0.0 111.778 179.374 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 13.3 m-30 -79.96 160.6 25.88 Favored 'General case' 0 C--O 1.234 0.258 0 O-C-N 119.903 -1.748 . . . . 0.0 110.049 170.518 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 25.6 mt-30 -100.56 109.6 21.71 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 107.975 -1.12 . . . . 0.0 107.975 -178.429 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 66.9 t80 -63.45 152.68 37.68 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 124.081 0.953 . . . . 0.0 110.421 176.042 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -128.73 105.3 8.16 Favored 'General case' 0 CA--C 1.512 -0.505 0 C-N-CA 125.139 1.376 . . . . 0.0 108.498 168.135 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -61.09 -27.47 68.39 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 119.172 -0.442 . . . . 0.0 112.109 169.917 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 15.1 t -66.08 -4.98 8.36 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.347 1.059 . . . . 0.0 113.184 -178.132 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 12.5 t -140.75 -47.8 0.42 Allowed 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 123.301 0.641 . . . . 0.0 109.555 172.619 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 112.0 43.66 0.92 Allowed Glycine 0 CA--C 1.526 0.743 0 C-N-CA 124.921 1.248 . . . . 0.0 111.929 -177.75 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 68.8 m-85 -136.13 170.28 16.27 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 119.401 1.601 . . . . 0.0 111.161 -177.785 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 79.4 m-85 -110.91 125.96 54.22 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 124.76 1.224 . . . . 0.0 107.707 173.685 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 34.8 t80 -88.56 139.48 30.43 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 124.368 1.067 . . . . 0.0 108.396 177.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 27.7 t0 -97.4 86.54 0.42 Allowed Pre-proline 0 CA--C 1.529 0.145 0 C-N-CA 126.946 2.098 . . . . 0.0 109.247 177.796 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -70.37 -5.08 15.77 Favored 'Trans proline' 0 N--CA 1.456 -0.702 0 C-N-CA 122.592 2.195 . . . . 0.0 113.685 175.798 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 2.4 mm-40 -73.77 -28.26 61.57 Favored 'General case' 0 CA--C 1.533 0.309 0 O-C-N 121.328 -0.858 . . . . 0.0 109.368 175.284 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 23.7 p -140.31 -24.11 0.81 Allowed 'General case' 0 C--O 1.238 0.453 0 N-CA-C 115.079 1.511 . . . . 0.0 115.079 -169.404 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 104.13 9.95 35.49 Favored Glycine 0 CA--C 1.53 1.021 0 C-N-CA 124.135 0.874 . . . . 0.0 112.986 177.426 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 19.8 mt -89.84 179.99 5.86 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 125.544 1.538 . . . . 0.0 109.07 178.253 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 57.4 m-85 -124.3 171.37 9.94 Favored 'General case' 0 C--O 1.234 0.282 0 C-N-CA 124.474 1.11 . . . . 0.0 108.843 162.368 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 68.1 t80 -143.21 159.36 42.46 Favored 'General case' 0 C--O 1.238 0.467 0 C-N-CA 128.224 2.609 . . . . 0.0 108.337 179.24 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -127.66 144.35 50.82 Favored Pre-proline 0 C--O 1.235 0.321 0 C-N-CA 124.576 1.15 . . . . 0.0 108.373 174.229 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 61.9 Cg_endo -75.07 -35.07 3.3 Favored 'Trans proline' 0 N--CA 1.45 -1.057 0 C-N-CA 121.944 1.763 . . . . 0.0 113.324 -173.036 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 3.6 m-80 -83.08 -21.72 33.64 Favored 'General case' 0 CA--C 1.524 -0.056 0 CA-C-N 119.152 0.887 . . . . 0.0 110.91 175.807 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 42.7 t -130.89 89.36 2.74 Favored 'General case' 0 N--CA 1.45 -0.472 0 N-CA-C 107.449 -1.315 . . . . 0.0 107.449 -166.85 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -55.92 -9.25 0.55 Allowed 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.873 1.269 . . . . 0.0 113.255 -177.792 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 11.5 m-85 -62.95 107.04 0.91 Allowed 'General case' 0 N--CA 1.449 -0.486 0 C-N-CA 124.951 1.3 . . . . 0.0 108.807 170.566 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 28.2 m-85 -59.89 156.75 13.76 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 124.756 1.222 . . . . 0.0 109.28 170.915 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 83.0 t80 -117.35 124.45 48.96 Favored 'General case' 0 N--CA 1.447 -0.602 0 C-N-CA 124.508 1.123 . . . . 0.0 108.116 177.74 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 27.1 t30 -98.15 84.65 3.3 Favored 'General case' 0 N--CA 1.446 -0.654 0 C-N-CA 126.754 2.022 . . . . 0.0 107.824 176.084 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -53.85 -26.52 24.89 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 124.324 1.049 . . . . 0.0 112.181 175.639 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -52.49 -41.64 63.58 Favored 'General case' 0 N--CA 1.446 -0.637 0 C-N-CA 124.496 1.118 . . . . 0.0 112.113 176.861 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 14.6 m -128.43 15.91 6.57 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 125.15 1.38 . . . . 0.0 111.726 -179.766 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 40.2 mt-30 50.62 19.01 0.53 Allowed 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 127.091 2.156 . . . . 0.0 114.35 -171.803 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -91.31 159.14 16.17 Favored 'General case' 0 N--CA 1.454 -0.239 0 C-N-CA 124.02 0.928 . . . . 0.0 109.798 -171.071 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -98.49 146.75 25.45 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 108.548 -0.908 . . . . 0.0 108.548 174.849 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 82.7 mt -140.01 -178.03 5.26 Favored 'General case' 0 C--N 1.326 -0.413 0 C-N-CA 125.564 1.546 . . . . 0.0 107.915 -179.386 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 26.5 p90 -143.32 149.69 38.13 Favored 'General case' 0 C--N 1.327 -0.378 0 C-N-CA 125.188 1.395 . . . . 0.0 108.191 168.073 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 42.0 t-105 -85.71 139.38 31.4 Favored 'General case' 0 C--O 1.235 0.337 0 N-CA-C 106.57 -1.641 . . . . 0.0 106.57 168.399 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 7.6 t0 -134.85 113.8 11.95 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 122.899 0.48 . . . . 0.0 110.057 -175.833 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -74.37 -12.01 82.18 Favored Glycine 0 CA--C 1.533 1.183 0 CA-C-O 119.117 -0.824 . . . . 0.0 113.498 176.179 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -67.15 -35.23 79.26 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 119.67 1.735 . . . . 0.0 108.937 176.388 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 43.0 mtt85 -120.21 -4.29 10.0 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 124.556 1.142 . . . . 0.0 112.75 -177.558 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 9.7 mtp85 49.19 51.53 16.08 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 126.695 1.998 . . . . 0.0 110.475 -173.247 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 1.4 t -146.36 173.86 11.89 Favored 'General case' 0 CA--C 1.536 0.424 0 O-C-N 121.345 -0.847 . . . . 0.0 108.793 -179.888 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 99.1 m-85 -111.03 119.66 39.78 Favored 'General case' 0 C--O 1.234 0.276 0 C-N-CA 125.044 1.337 . . . . 0.0 108.547 -179.445 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -126.4 156.84 72.12 Favored Pre-proline 0 N--CA 1.469 0.503 0 C-N-CA 125.946 1.698 . . . . 0.0 111.871 -169.805 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -74.43 118.46 5.36 Favored 'Trans proline' 0 N--CA 1.459 -0.553 0 C-N-CA 122.439 2.092 . . . . 0.0 111.947 -175.505 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.347 0 O-C-N 121.479 -0.763 . . . . 0.0 112.069 178.159 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 12.9 m-85 . . . . . 0 CA--C 1.539 0.553 0 CA-C-O 118.784 -0.627 . . . . 0.0 110.055 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -59.23 -164.88 0.03 OUTLIER 'Trans proline' 0 CA--C 1.542 0.916 1 C-N-CA 125.769 4.312 . . . . 0.0 113.881 162.268 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 47.0 t -126.2 88.06 55.01 Favored Pre-proline 0 CA--C 1.541 0.613 0 C-N-CA 127.083 2.153 . . . . 0.0 108.804 -176.473 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_endo -65.24 160.0 44.33 Favored 'Trans proline' 0 CA--C 1.539 0.745 0 C-N-CA 123.657 2.905 . . . . 0.0 112.451 -173.468 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 42.5 t0 -148.73 127.64 12.67 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 106.709 -1.589 . . . . 0.0 106.709 175.797 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 11.3 p -60.4 -21.44 22.9 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.534 0 C-N-CA 123.956 0.902 . . . . 0.0 112.123 177.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 42.6 t -62.77 -7.49 5.06 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 125.489 1.516 . . . . 0.0 113.381 -178.882 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 14.5 t -124.29 12.35 8.82 Favored 'General case' 0 CA--C 1.533 0.296 0 O-C-N 120.549 -1.344 . . . . 0.0 111.34 177.142 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 10.9 m-30 -73.88 169.28 17.74 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-O 122.101 0.953 . . . . 0.0 110.8 175.423 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 27.2 mt-30 -113.55 101.72 9.61 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 125.936 1.694 . . . . 0.0 107.49 177.763 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 74.9 t80 -67.17 147.02 53.62 Favored 'General case' 0 C--N 1.328 -0.348 0 O-C-N 121.82 -0.55 . . . . 0.0 110.215 169.828 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -129.17 87.99 2.64 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 123.351 0.661 . . . . 0.0 110.793 179.789 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -58.72 -21.94 56.27 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 114.075 1.139 . . . . 0.0 114.075 -168.967 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 3.2 t -58.61 -19.12 35.85 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.577 1.151 . . . . 0.0 112.41 174.405 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 48.8 m -137.54 -23.51 1.08 Allowed 'General case' 0 CA--C 1.539 0.519 0 N-CA-C 114.563 1.32 . . . . 0.0 114.563 177.43 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 98.6 19.98 20.98 Favored Glycine 0 CA--C 1.536 1.364 0 CA-C-N 120.361 1.437 . . . . 0.0 115.535 170.413 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 7.7 m-85 -122.62 169.55 10.92 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 119.595 1.698 . . . . 0.0 110.395 175.72 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 88.3 m-85 -102.49 153.43 20.06 Favored 'General case' 0 N--CA 1.448 -0.531 0 C-N-CA 125.186 1.395 . . . . 0.0 109.617 173.656 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 55.2 t80 -118.86 143.75 46.78 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 126.107 1.763 . . . . 0.0 108.699 172.147 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 65.7 t0 -106.15 87.29 2.43 Favored Pre-proline 0 C--N 1.33 -0.272 0 C-N-CA 126.749 2.02 . . . . 0.0 111.941 -175.738 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -61.16 -6.74 6.92 Favored 'Trans proline' 0 CA--C 1.535 0.551 0 C-N-CA 123.038 2.492 . . . . 0.0 114.747 176.145 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 54.5 mt-30 -74.98 -19.97 59.87 Favored 'General case' 0 CA--C 1.535 0.366 0 O-C-N 120.731 -1.23 . . . . 0.0 111.057 173.772 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 27.5 p -143.19 -40.75 0.31 Allowed 'General case' 0 C--O 1.235 0.339 0 C-N-CA 123.687 0.795 . . . . 0.0 112.791 -166.364 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 96.03 40.25 4.09 Favored Glycine 0 CA--C 1.525 0.663 0 C-N-CA 124.606 1.098 . . . . 0.0 111.744 -176.046 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 10.8 mt -115.56 167.01 11.27 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 124.961 1.305 . . . . 0.0 108.997 172.853 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 37.2 m-85 -106.88 160.57 15.41 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 118.801 0.728 . . . . 0.0 110.359 166.37 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 38.3 t80 -141.95 152.02 43.12 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 126.593 1.957 . . . . 0.0 109.23 -174.78 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -124.63 143.71 44.23 Favored Pre-proline 0 CA--C 1.535 0.402 0 C-N-CA 125.762 1.625 . . . . 0.0 108.797 174.863 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 95.5 Cg_endo -77.46 -21.27 11.74 Favored 'Trans proline' 0 CA--C 1.535 0.535 0 C-N-CA 123.089 2.526 . . . . 0.0 115.159 -172.553 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 81.9 m-20 -92.31 -33.94 14.41 Favored 'General case' 0 N--CA 1.447 -0.622 0 C-N-CA 125.513 1.525 . . . . 0.0 110.018 174.731 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 41.5 p -125.19 84.1 2.24 Favored 'General case' 0 N--CA 1.451 -0.375 0 C-N-CA 123.861 0.864 . . . . 0.0 108.806 -165.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 21.0 mp0 -57.87 -1.09 0.09 Allowed 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 127.149 2.18 . . . . 0.0 114.726 -175.666 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 45.3 m-85 -65.4 107.48 1.67 Allowed 'General case' 0 C--O 1.236 0.35 0 C-N-CA 125.529 1.532 . . . . 0.0 107.807 169.764 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 68.9 m-85 -65.72 140.83 58.48 Favored 'General case' 0 C--O 1.235 0.312 0 C-N-CA 123.87 0.868 . . . . 0.0 108.846 -178.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 64.8 t80 -95.29 109.72 21.82 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-O 122.752 1.263 . . . . 0.0 108.2 175.246 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 35.9 t30 -83.29 80.32 9.11 Favored 'General case' 0 N--CA 1.44 -0.946 0 CA-C-N 114.171 -1.377 . . . . 0.0 108.509 173.966 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -46.25 -35.3 5.11 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 125.095 1.358 . . . . 0.0 112.225 178.444 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -44.41 -50.62 9.18 Favored 'General case' 0 N--CA 1.444 -0.756 0 C-N-CA 127.942 2.497 . . . . 0.0 111.908 177.624 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 13.9 m -126.09 19.4 7.67 Favored 'General case' 0 C--N 1.332 -0.169 0 C-N-CA 124.845 1.258 . . . . 0.0 111.065 -178.345 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 11.1 mp0 50.88 18.67 0.54 Allowed 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 127.75 2.42 . . . . 0.0 113.275 -174.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -84.82 164.07 18.68 Favored 'General case' 0 N--CA 1.447 -0.578 0 C-N-CA 125.145 1.378 . . . . 0.0 111.303 -170.463 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 4.9 m-85 -118.57 121.57 40.54 Favored 'General case' 0 N--CA 1.449 -0.516 0 N-CA-C 105.62 -1.993 . . . . 0.0 105.62 -177.119 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 63.7 mt -124.4 176.56 6.4 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 125.076 1.35 . . . . 0.0 108.223 -170.895 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 13.5 p90 -135.4 148.21 49.28 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 108.121 -1.066 . . . . 0.0 108.121 168.604 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 57.8 t-105 -74.89 135.44 41.5 Favored 'General case' 0 C--O 1.236 0.359 0 N-CA-C 106.395 -1.706 . . . . 0.0 106.395 165.898 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 35.3 t0 -129.05 95.05 3.97 Favored 'General case' 0 N--CA 1.448 -0.564 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 177.567 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -66.09 -17.98 66.35 Favored Glycine 0 CA--C 1.526 0.744 0 CA-C-O 119.232 -0.76 . . . . 0.0 112.381 176.647 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 -68.33 -30.29 69.23 Favored 'General case' 0 C--N 1.34 0.166 0 CA-C-N 119.206 1.503 . . . . 0.0 109.366 174.559 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 47.6 mtt180 -102.86 -9.9 19.52 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.67 1.188 . . . . 0.0 112.106 178.327 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 11.8 mtm-85 44.68 54.94 6.23 Favored 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 127.539 2.335 . . . . 0.0 111.111 -167.297 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 7.5 t -154.94 178.15 10.5 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 124.092 0.957 . . . . 0.0 109.104 177.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 97.3 m-85 -109.36 128.28 54.99 Favored 'General case' 0 C--O 1.233 0.221 0 N-CA-C 107.571 -1.27 . . . . 0.0 107.571 168.349 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -126.73 158.34 68.4 Favored Pre-proline 0 C--N 1.324 -0.525 0 C-N-CA 126.494 1.918 . . . . 0.0 110.64 -173.692 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -72.61 136.93 26.74 Favored 'Trans proline' 0 N--CA 1.455 -0.778 0 C-N-CA 122.421 2.081 . . . . 0.0 110.135 -178.057 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 0.367 0 C-N-CA 123.521 0.728 . . . . 0.0 111.959 -176.824 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 37.8 m-85 . . . . . 0 C--O 1.241 0.614 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 29.5 Cg_endo -65.29 -178.25 0.81 Allowed 'Trans proline' 0 CA--C 1.54 0.824 0 C-N-CA 122.965 2.443 . . . . 0.0 111.422 160.202 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 59.1 t -111.34 87.99 8.31 Favored Pre-proline 0 CA--C 1.537 0.465 0 C-N-CA 127.653 2.381 . . . . 0.0 107.584 -173.242 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -68.82 164.92 31.57 Favored 'Trans proline' 0 CA--C 1.539 0.74 0 C-N-CA 123.467 2.778 . . . . 0.0 111.751 -179.109 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.9 t0 -143.25 130.58 20.96 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 108.003 -1.11 . . . . 0.0 108.003 167.653 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 14.0 p -58.68 -17.3 10.26 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.769 0 C-N-CA 124.25 1.02 . . . . 0.0 112.047 176.456 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 32.2 t -53.55 -26.2 20.28 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 125.708 1.603 . . . . 0.0 113.061 173.535 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 5.9 t -119.77 17.68 12.68 Favored 'General case' 0 CA--C 1.545 0.774 0 CA-C-N 119.33 0.968 . . . . 0.0 111.738 -175.18 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 8.1 m-30 -73.64 -168.98 0.63 Allowed 'General case' 0 C--O 1.237 0.398 0 C-N-CA 125.305 1.442 . . . . 0.0 110.456 171.741 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 6.8 mt-30 -122.43 150.86 41.9 Favored 'General case' 0 N--CA 1.446 -0.637 0 N-CA-C 107.018 -1.475 . . . . 0.0 107.018 163.81 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 78.2 t80 -93.95 152.42 18.86 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 108.122 -1.066 . . . . 0.0 108.122 163.909 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -136.05 86.52 2.24 Favored 'General case' 0 CA--C 1.511 -0.539 0 N-CA-C 107.477 -1.305 . . . . 0.0 107.477 175.114 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -47.03 -30.89 2.91 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 126.773 2.029 . . . . 0.0 112.773 179.773 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 1.3 t -65.9 -26.78 67.77 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 123.844 0.858 . . . . 0.0 110.682 -176.78 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 30.2 m -109.15 -24.15 11.28 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.599 1.159 . . . . 0.0 111.641 167.544 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 79.93 27.62 52.77 Favored Glycine 0 CA--C 1.526 0.757 0 C-N-CA 124.558 1.075 . . . . 0.0 112.162 -178.384 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 31.4 m-85 -118.09 169.1 9.95 Favored 'General case' 0 CA--C 1.521 -0.169 0 C-N-CA 124.965 1.306 . . . . 0.0 108.426 179.51 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 73.6 m-85 -94.17 154.46 17.56 Favored 'General case' 0 N--CA 1.449 -0.499 0 N-CA-C 108.25 -1.018 . . . . 0.0 108.25 159.848 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 20.1 t80 -117.93 137.1 53.06 Favored 'General case' 0 N--CA 1.447 -0.624 0 C-N-CA 127.845 2.458 . . . . 0.0 106.472 174.636 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 47.9 t0 -100.62 86.72 0.69 Allowed Pre-proline 0 C--N 1.327 -0.384 0 C-N-CA 128.088 2.555 . . . . 0.0 108.359 -179.648 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_endo -66.0 -11.9 33.03 Favored 'Trans proline' 0 N--CA 1.458 -0.593 0 C-N-CA 122.162 1.908 . . . . 0.0 114.244 177.646 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 56.7 mm-40 -63.51 -52.99 58.86 Favored 'General case' 0 C--O 1.233 0.196 0 N-CA-C 107.164 -1.421 . . . . 0.0 107.164 173.276 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 45.4 p -110.35 -32.53 6.92 Favored 'General case' 0 CA--C 1.532 0.274 0 N-CA-C 114.112 1.153 . . . . 0.0 114.112 -169.564 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 106.74 12.16 25.06 Favored Glycine 0 CA--C 1.529 0.968 0 C-N-CA 124.994 1.283 . . . . 0.0 113.378 -175.816 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 50.7 mt -87.58 169.52 12.1 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 118.57 1.185 . . . . 0.0 109.701 178.453 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 42.7 m-85 -112.02 161.53 16.36 Favored 'General case' 0 C--O 1.234 0.284 0 O-C-N 121.454 -0.779 . . . . 0.0 109.062 163.076 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 93.3 t80 -142.63 152.67 42.72 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 126.077 1.751 . . . . 0.0 108.685 -176.384 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -124.15 144.18 44.68 Favored Pre-proline 0 N--CA 1.467 0.38 0 CA-C-N 118.777 0.717 . . . . 0.0 109.892 177.11 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -72.99 -34.25 6.65 Favored 'Trans proline' 0 N--CA 1.456 -0.727 0 C-N-CA 122.263 1.975 . . . . 0.0 114.271 -177.366 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -77.65 -27.59 51.04 Favored 'General case' 0 CA--C 1.517 -0.323 0 CA-C-N 120.043 1.292 . . . . 0.0 112.617 172.791 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -134.08 83.66 2.06 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 106.833 -1.543 . . . . 0.0 106.833 -153.522 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -60.23 -6.77 1.59 Allowed 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 126.167 1.787 . . . . 0.0 114.18 -165.754 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 39.1 m-85 -65.04 123.57 19.82 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 123.956 0.902 . . . . 0.0 110.048 171.766 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 38.8 m-85 -75.44 152.86 37.9 Favored 'General case' 0 N--CA 1.45 -0.451 0 N-CA-C 108.688 -0.856 . . . . 0.0 108.688 174.046 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 9.0 t80 -114.42 109.12 17.83 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 126.099 1.76 . . . . 0.0 106.641 -177.885 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 44.7 t30 -83.62 77.15 9.9 Favored 'General case' 0 N--CA 1.445 -0.688 0 C-N-CA 125.272 1.429 . . . . 0.0 107.357 171.129 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -52.18 -33.14 39.37 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 123.017 0.527 . . . . 0.0 110.32 178.667 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -47.78 -32.04 5.55 Favored 'General case' 0 N--CA 1.448 -0.548 0 C-N-CA 127.663 2.385 . . . . 0.0 114.74 178.069 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 19.9 m -138.36 25.96 2.64 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 123.851 0.86 . . . . 0.0 110.039 170.12 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 24.5 mt-30 52.35 18.44 0.92 Allowed 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 127.503 2.321 . . . . 0.0 114.893 -176.859 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -95.52 159.58 14.92 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 123.638 0.775 . . . . 0.0 110.535 -166.942 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 9.5 m-85 -114.12 127.15 55.78 Favored 'General case' 0 CA--C 1.516 -0.358 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 -169.947 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 53.2 mt -126.53 174.63 8.51 Favored 'General case' 0 C--N 1.324 -0.54 0 C-N-CA 124.415 1.086 . . . . 0.0 108.691 -170.066 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 13.5 p90 -134.59 153.49 51.94 Favored 'General case' 0 N--CA 1.447 -0.608 0 N-CA-C 106.881 -1.526 . . . . 0.0 106.881 162.072 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 46.9 t-105 -78.28 127.69 32.61 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 105.713 -1.958 . . . . 0.0 105.713 164.703 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 19.9 t0 -110.24 108.78 19.02 Favored 'General case' 0 CA--C 1.515 -0.378 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 166.475 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -72.57 -15.39 77.57 Favored Glycine 0 N--CA 1.441 -1.003 0 CA-C-O 116.84 -2.089 . . . . 0.0 112.831 176.266 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -69.87 -56.18 7.76 Favored 'General case' 0 C--N 1.346 0.442 0 CA-C-N 121.021 2.411 . . . . 0.0 107.596 176.667 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 62.3 mtt85 -80.96 -3.97 53.41 Favored 'General case' 0 N--CA 1.456 -0.136 0 C-N-CA 124.047 0.939 . . . . 0.0 113.148 178.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 42.0 mtt180 43.36 58.18 3.52 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 126.982 2.113 . . . . 0.0 109.7 -175.276 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 6.2 t -153.88 157.45 39.29 Favored 'General case' 0 N--CA 1.448 -0.563 0 N-CA-C 107.143 -1.428 . . . . 0.0 107.143 176.759 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 71.7 m-85 -86.88 132.07 33.92 Favored 'General case' 0 C--O 1.237 0.398 0 N-CA-C 106.202 -1.777 . . . . 0.0 106.202 169.662 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -125.8 154.48 73.38 Favored Pre-proline 0 C--N 1.322 -0.627 0 C-N-CA 125.124 1.37 . . . . 0.0 110.391 -176.682 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -72.22 130.3 16.21 Favored 'Trans proline' 0 N--CA 1.454 -0.834 0 C-N-CA 122.523 2.149 . . . . 0.0 110.253 -178.112 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.235 0.297 0 N-CA-C 112.992 0.738 . . . . 0.0 112.992 -178.539 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 36.6 m-85 . . . . . 0 CA--C 1.539 0.52 0 CA-C-O 119.119 -0.467 . . . . 0.0 110.0 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -66.09 169.55 13.37 Favored 'Trans proline' 0 C--N 1.349 0.57 0 C-N-CA 123.78 2.987 . . . . 0.0 109.828 172.803 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 38.8 t -111.94 85.4 6.42 Favored Pre-proline 0 CA--C 1.539 0.547 0 N-CA-C 107.659 -1.237 . . . . 0.0 107.659 177.668 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -72.92 178.38 6.52 Favored 'Trans proline' 0 N--CA 1.457 -0.643 0 C-N-CA 123.669 2.913 . . . . 0.0 111.035 177.285 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -159.3 32.21 0.2 Allowed 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 113.367 0.877 . . . . 0.0 113.367 -177.285 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . 0.373 11.9 p 42.88 23.25 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.553 1.08 0 C-N-CA 128.072 2.549 . . . . 0.0 113.085 -173.805 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 7.5 t -113.51 -12.73 12.88 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 127.795 2.438 . . . . 0.0 109.287 -174.746 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 2.8 p -112.7 1.57 15.73 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 124.516 1.127 . . . . 0.0 111.08 -179.945 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 11.5 m-30 -85.0 173.27 10.65 Favored 'General case' 0 C--N 1.341 0.235 0 C-N-CA 124.597 1.159 . . . . 0.0 111.344 -167.294 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 68.5 mt-30 -119.89 99.1 6.43 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 126.023 1.729 . . . . 0.0 108.541 -174.297 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 87.1 t80 -58.18 143.82 42.83 Favored 'General case' 0 C--N 1.326 -0.422 0 O-C-N 122.302 -0.249 . . . . 0.0 111.012 171.246 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 4.1 t0 -122.64 112.68 18.26 Favored 'General case' 0 CA--C 1.515 -0.379 0 C-N-CA 123.902 0.881 . . . . 0.0 109.802 172.716 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -63.46 -19.36 64.66 Favored 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 124.794 1.238 . . . . 0.0 112.974 176.875 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 3.2 t -59.48 -32.81 70.61 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 123.445 0.698 . . . . 0.0 111.643 176.62 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 66.6 m -132.6 -20.54 2.3 Favored 'General case' 0 N--CA 1.462 0.162 0 C-N-CA 123.953 0.901 . . . . 0.0 112.209 -173.781 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 86.83 10.9 71.6 Favored Glycine 0 CA--C 1.526 0.737 0 C-N-CA 124.084 0.849 . . . . 0.0 111.942 -179.684 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 5.0 m-85 -96.87 168.74 10.3 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-N 118.429 1.115 . . . . 0.0 108.438 -177.313 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 93.8 m-85 -100.94 141.18 34.2 Favored 'General case' 0 N--CA 1.45 -0.44 0 N-CA-C 107.404 -1.332 . . . . 0.0 107.404 171.205 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 39.0 t80 -107.6 139.79 41.59 Favored 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 125.532 1.533 . . . . 0.0 107.634 175.03 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 62.3 t0 -104.1 87.27 1.53 Allowed Pre-proline 0 C--N 1.328 -0.347 0 C-N-CA 126.108 1.763 . . . . 0.0 111.672 -178.734 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -61.5 -12.48 24.61 Favored 'Trans proline' 0 N--CA 1.457 -0.659 0 C-N-CA 122.505 2.137 . . . . 0.0 114.289 176.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 22.4 mm-40 -72.7 -30.12 63.95 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-N 119.205 0.911 . . . . 0.0 110.599 178.65 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 22.0 p -120.54 -50.28 2.21 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 124.657 1.183 . . . . 0.0 109.276 -166.947 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 101.12 46.11 1.77 Allowed Glycine 0 CA--C 1.525 0.709 0 N-CA-C 108.995 -1.642 . . . . 0.0 108.995 -168.68 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 20.9 mt -126.57 171.19 11.31 Favored 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 125.384 1.474 . . . . 0.0 109.295 176.682 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 51.0 m-85 -114.69 164.79 13.56 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 124.69 1.196 . . . . 0.0 108.672 166.18 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 50.3 t80 -145.64 152.11 39.13 Favored 'General case' 0 C--O 1.239 0.518 0 C-N-CA 126.873 2.069 . . . . 0.0 107.576 179.025 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -121.9 143.83 39.54 Favored Pre-proline 0 CA--C 1.535 0.39 0 C-N-CA 123.421 0.689 . . . . 0.0 109.636 175.219 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo -76.33 -25.68 9.62 Favored 'Trans proline' 0 N--CA 1.458 -0.593 0 C-N-CA 121.953 1.768 . . . . 0.0 113.236 -176.093 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 26.8 m-20 -90.9 -21.21 21.51 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 119.538 1.063 . . . . 0.0 112.676 175.262 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 86.4 p -129.26 91.12 3.13 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 123.861 0.864 . . . . 0.0 109.597 179.406 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -56.02 -5.96 0.21 Allowed 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 128.71 2.804 . . . . 0.0 115.63 -171.71 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 54.5 m-85 -68.95 158.47 34.6 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 123.861 0.864 . . . . 0.0 108.851 172.755 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 31.6 m-85 -105.26 133.16 50.48 Favored 'General case' 0 N--CA 1.449 -0.518 0 N-CA-C 108.286 -1.005 . . . . 0.0 108.286 179.788 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 74.6 t80 -90.28 118.18 29.59 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 107.982 -1.118 . . . . 0.0 107.982 175.517 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 20.9 t30 -96.49 86.2 4.09 Favored 'General case' 0 N--CA 1.442 -0.831 0 C-N-CA 126.328 1.851 . . . . 0.0 107.941 179.08 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -50.3 -36.27 31.03 Favored 'General case' 0 N--CA 1.463 0.223 0 C-N-CA 123.957 0.903 . . . . 0.0 111.544 179.584 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 3.8 tt0 -47.19 -37.97 11.15 Favored 'General case' 0 N--CA 1.446 -0.633 0 C-N-CA 127.284 2.234 . . . . 0.0 113.126 -176.764 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 13.6 m -135.79 24.3 3.36 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 124.588 1.155 . . . . 0.0 109.76 176.422 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . 0.364 4.6 pt20 44.65 23.72 0.08 Allowed 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 129.052 2.941 . . . . 0.0 114.403 -175.36 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -92.43 172.18 8.56 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 126.507 1.923 . . . . 0.0 111.361 -171.186 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 4.9 m-85 -118.28 131.55 56.34 Favored 'General case' 0 N--CA 1.45 -0.428 0 N-CA-C 106.965 -1.495 . . . . 0.0 106.965 -177.77 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 48.9 mt -125.92 176.69 6.8 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 126.156 1.782 . . . . 0.0 107.859 -177.063 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 13.9 p90 -139.83 149.35 43.36 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 107.706 -1.22 . . . . 0.0 107.706 168.274 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 39.7 t-105 -78.13 127.19 31.92 Favored 'General case' 0 C--O 1.239 0.506 0 N-CA-C 107.46 -1.311 . . . . 0.0 107.46 172.277 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -120.81 86.88 2.65 Favored 'General case' 0 CA--C 1.512 -0.496 0 CA-C-O 121.631 0.729 . . . . 0.0 109.516 -179.634 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -58.71 -19.33 42.33 Favored Glycine 0 CA--C 1.526 0.778 0 CA-C-O 118.648 -1.085 . . . . 0.0 111.996 175.891 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -59.6 -34.75 73.14 Favored 'General case' 0 C--N 1.342 0.28 0 CA-C-N 118.989 1.395 . . . . 0.0 109.368 176.553 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 21.6 mtt180 -121.77 -1.55 9.44 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 127.232 2.213 . . . . 0.0 111.509 -171.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 60.1 mtt180 44.26 54.39 6.16 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 127.715 2.406 . . . . 0.0 111.489 -171.17 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 10.2 t -148.68 175.56 11.1 Favored 'General case' 0 C--N 1.328 -0.357 0 O-C-N 122.047 -0.408 . . . . 0.0 109.947 175.473 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 87.9 m-85 -98.96 134.78 41.32 Favored 'General case' 0 C--O 1.237 0.405 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 168.149 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -126.44 154.81 75.05 Favored Pre-proline 0 C--N 1.322 -0.627 0 C-N-CA 125.667 1.587 . . . . 0.0 109.359 176.841 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_endo -76.65 122.46 6.43 Favored 'Trans proline' 0 N--CA 1.46 -0.499 0 C-N-CA 123.099 2.533 . . . . 0.0 112.26 -174.276 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 0.335 0 C-N-CA 124.691 1.196 . . . . 0.0 112.999 -178.219 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 32.6 m-85 . . . . . 0 CA--C 1.532 0.282 0 N-CA-C 109.979 -0.378 . . . . 0.0 109.979 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 95.5 Cg_endo -67.91 177.7 4.06 Favored 'Trans proline' 0 N--CA 1.454 -0.834 0 C-N-CA 121.782 1.654 . . . . 0.0 109.023 161.282 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 45.7 t -104.71 86.27 1.4 Allowed Pre-proline 0 CA--C 1.537 0.46 0 C-N-CA 124.27 1.028 . . . . 0.0 109.162 -173.093 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_endo -69.62 153.69 69.25 Favored 'Trans proline' 0 N--CA 1.456 -0.694 0 C-N-CA 122.015 1.81 . . . . 0.0 110.386 -178.302 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -136.3 133.17 36.63 Favored 'General case' 0 C--O 1.235 0.305 0 C-N-CA 123.193 0.597 . . . . 0.0 111.808 -176.231 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.409 ' HA ' ' CD2' ' A' ' 18' ' ' TYR . 10.8 p -56.62 -25.95 22.33 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.407 0 C-N-CA 125.382 1.473 . . . . 0.0 113.544 -178.968 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 2.0 t -61.8 -12.3 16.52 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.999 0.919 . . . . 0.0 112.039 174.576 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 37.0 p -113.41 1.06 14.96 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.633 1.173 . . . . 0.0 111.723 -179.648 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . 0.409 ' CD2' ' HA ' ' A' ' 15' ' ' VAL . 15.3 m-30 -79.77 166.56 21.62 Favored 'General case' 0 C--O 1.238 0.499 0 O-C-N 120.858 -1.151 . . . . 0.0 110.159 179.984 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 28.0 mt-30 -105.31 112.55 25.7 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 124.728 1.211 . . . . 0.0 108.573 175.356 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 61.5 t80 -61.34 137.66 58.24 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 108.558 -0.904 . . . . 0.0 108.558 169.86 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 22.2 t0 -117.74 70.44 0.79 Allowed 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 125.932 1.693 . . . . 0.0 109.436 -172.389 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.55 -3.79 1.63 Allowed 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 115.527 1.677 . . . . 0.0 115.527 -169.224 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 1.3 t -65.94 -27.17 67.97 Favored 'General case' 0 C--N 1.315 -0.897 0 C-N-CA 126.659 1.984 . . . . 0.0 111.795 164.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 25.0 p -127.78 -25.83 3.04 Favored 'General case' 0 C--O 1.237 0.419 0 CA-C-N 120.169 1.35 . . . . 0.0 112.464 174.914 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 96.64 9.5 56.39 Favored Glycine 0 CA--C 1.533 1.201 0 CA-C-N 118.737 0.698 . . . . 0.0 112.39 177.206 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 8.3 m-85 -100.58 177.29 5.05 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.774 1.63 . . . . 0.0 109.1 178.119 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 77.9 m-85 -101.59 139.55 37.1 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 106.997 -1.483 . . . . 0.0 106.997 166.698 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 17.4 t80 -101.97 135.62 43.21 Favored 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 125.827 1.651 . . . . 0.0 107.099 172.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -110.55 85.08 4.42 Favored Pre-proline 0 N--CA 1.442 -0.863 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 -171.004 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_endo -61.36 -13.5 29.25 Favored 'Trans proline' 0 C--N 1.348 0.511 0 C-N-CA 122.388 2.059 . . . . 0.0 113.362 -179.919 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 98.6 mm-40 -60.64 -28.96 68.95 Favored 'General case' 0 N--CA 1.448 -0.567 0 C-N-CA 124.877 1.271 . . . . 0.0 111.423 178.697 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 12.6 p -145.96 -18.17 0.45 Allowed 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 113.664 0.987 . . . . 0.0 113.664 -176.745 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 99.53 7.57 53.71 Favored Glycine 0 CA--C 1.531 1.059 0 CA-C-N 119.446 1.021 . . . . 0.0 114.065 179.23 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 40.0 mt -85.69 179.51 7.07 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 124.847 1.259 . . . . 0.0 109.612 175.249 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 25.0 m-85 -118.91 159.79 23.14 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 124.329 1.052 . . . . 0.0 109.35 162.815 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 71.1 t80 -127.19 165.68 19.15 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 128.402 2.681 . . . . 0.0 109.128 173.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 6.1 t0 -137.77 144.1 42.97 Favored Pre-proline 0 N--CA 1.465 0.283 0 O-C-N 120.735 -1.228 . . . . 0.0 108.294 177.829 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 68.9 Cg_endo -71.62 -30.49 14.69 Favored 'Trans proline' 0 N--CA 1.454 -0.808 0 C-N-CA 121.354 1.37 . . . . 0.0 113.422 -175.281 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 77.2 m-20 -87.77 -28.53 21.65 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 125.139 1.375 . . . . 0.0 110.483 175.411 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' SER . . . . . 0.455 ' C ' ' H ' ' A' ' 42' ' ' TYR . 1.6 m -117.76 95.47 4.94 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 123.775 0.83 . . . . 0.0 109.572 -176.084 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 20.4 mp0 -62.18 -2.79 1.05 Allowed 'General case' 0 CA--C 1.547 0.843 0 O-C-N 121.387 -0.821 . . . . 0.0 111.758 166.676 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . 0.455 ' H ' ' C ' ' A' ' 40' ' ' SER . 17.8 m-85 -70.57 98.87 1.55 Allowed 'General case' 0 N--CA 1.444 -0.736 0 C-N-CA 125.39 1.476 . . . . 0.0 107.538 162.736 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 34.3 m-85 -59.27 153.85 17.73 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 125.204 1.402 . . . . 0.0 110.072 175.418 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 76.8 t80 -110.19 113.45 26.14 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 125.011 1.324 . . . . 0.0 108.514 177.826 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 38.7 t30 -87.45 81.58 7.77 Favored 'General case' 0 N--CA 1.445 -0.695 0 C-N-CA 125.22 1.408 . . . . 0.0 108.888 177.553 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -44.9 -38.46 4.66 Favored 'General case' 0 C--N 1.341 0.202 0 C-N-CA 124.273 1.029 . . . . 0.0 111.723 176.07 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 4.4 tt0 -44.41 -38.85 4.29 Favored 'General case' 0 N--CA 1.446 -0.626 0 C-N-CA 127.843 2.457 . . . . 0.0 113.054 -177.376 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 70.8 m -136.61 16.17 3.13 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 124.305 1.042 . . . . 0.0 111.726 176.852 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 25.7 mt-30 58.77 14.89 3.44 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 126.855 2.062 . . . . 0.0 113.494 -173.297 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 41.2 mm-40 -77.31 167.06 22.34 Favored 'General case' 0 C--N 1.334 -0.07 0 O-C-N 121.139 -0.976 . . . . 0.0 111.459 -177.209 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 37.0 m-85 -114.27 132.8 56.02 Favored 'General case' 0 C--O 1.236 0.347 0 C-N-CA 124.145 0.978 . . . . 0.0 109.97 172.141 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 66.6 mt -129.81 179.91 5.57 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 126.55 1.94 . . . . 0.0 108.801 -173.609 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 23.6 p90 -144.64 157.98 43.97 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 124.012 0.925 . . . . 0.0 109.685 165.425 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 54.5 t-105 -89.18 125.49 35.08 Favored 'General case' 0 C--O 1.237 0.434 0 N-CA-C 107.121 -1.437 . . . . 0.0 107.121 170.276 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -120.99 108.69 14.18 Favored 'General case' 0 CA--C 1.516 -0.328 0 CA-C-O 121.304 0.573 . . . . 0.0 110.578 177.557 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -72.6 -1.75 53.84 Favored Glycine 0 CA--C 1.526 0.723 0 CA-C-O 117.99 -1.45 . . . . 0.0 114.294 -172.792 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 2.9 pt-20 -76.23 -54.49 6.72 Favored 'General case' 0 C--N 1.339 0.138 0 CA-C-N 120.072 1.936 . . . . 0.0 110.255 171.511 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 13.0 mtt180 -88.42 -8.11 55.51 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 124.17 0.988 . . . . 0.0 110.567 -177.856 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 3.3 mpt_? 44.88 59.46 3.41 Favored 'General case' 0 C--N 1.342 0.263 0 C-N-CA 125.988 1.715 . . . . 0.0 109.321 -174.326 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 8.4 t -148.88 179.49 7.81 Favored 'General case' 0 C--O 1.238 0.457 0 N-CA-C 108.766 -0.828 . . . . 0.0 108.766 175.917 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 72.0 m-85 -104.32 132.29 50.74 Favored 'General case' 0 C--O 1.241 0.641 0 C-N-CA 123.878 0.871 . . . . 0.0 109.656 172.853 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -127.57 154.96 77.62 Favored Pre-proline 0 C--N 1.326 -0.421 0 C-N-CA 126.638 1.975 . . . . 0.0 110.631 -178.671 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_endo -70.12 131.18 20.2 Favored 'Trans proline' 0 CA--C 1.534 0.5 0 C-N-CA 123.321 2.681 . . . . 0.0 111.732 174.483 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 0.281 0 C-N-CA 124.729 1.211 . . . . 0.0 108.981 178.693 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 18.4 m-85 . . . . . 0 CA--C 1.543 0.68 0 CA-C-O 119.124 -0.465 . . . . 0.0 110.161 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 79.0 Cg_endo -73.53 -174.31 1.61 Allowed 'Trans proline' 0 CA--C 1.539 0.726 0 C-N-CA 123.989 3.126 . . . . 0.0 111.619 176.396 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 21.2 t -106.93 86.54 2.43 Favored Pre-proline 0 CA--C 1.532 0.276 0 C-N-CA 125.56 1.544 . . . . 0.0 108.452 176.589 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 91.7 Cg_endo -66.66 159.06 52.81 Favored 'Trans proline' 0 N--CA 1.457 -0.67 0 C-N-CA 122.161 1.907 . . . . 0.0 109.335 173.754 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.2 t0 -131.02 134.3 46.56 Favored 'General case' 0 C--O 1.234 0.249 0 N-CA-C 108.333 -0.988 . . . . 0.0 108.333 171.133 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.475 ' HA ' ' CD2' ' A' ' 18' ' ' TYR . 2.9 p -57.02 -25.18 22.0 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.472 0 C-N-CA 123.999 0.92 . . . . 0.0 111.864 178.002 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 56.6 m -59.08 -20.04 49.74 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 119.305 0.957 . . . . 0.0 113.51 173.222 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 12.2 p -119.07 16.33 13.28 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 119.805 1.184 . . . . 0.0 111.914 -176.761 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . 0.475 ' CD2' ' HA ' ' A' ' 15' ' ' VAL . 20.2 m-30 -71.89 159.57 34.05 Favored 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 160.614 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 26.4 mt-30 -111.12 114.6 27.98 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 125.787 1.635 . . . . 0.0 111.788 177.479 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 49.5 t80 -67.08 156.76 35.27 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 120.618 1.554 . . . . 0.0 113.341 -177.654 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -129.47 102.98 6.63 Favored 'General case' 0 C--N 1.342 0.273 0 N-CA-C 107.561 -1.274 . . . . 0.0 107.561 166.075 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -52.75 -29.89 29.72 Favored 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 124.795 1.238 . . . . 0.0 112.063 171.368 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 1.4 t -67.1 -20.73 65.83 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-O 117.899 -1.048 . . . . 0.0 111.987 -174.461 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 72.9 m -136.0 -9.79 2.04 Favored 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 113.795 1.035 . . . . 0.0 113.795 177.505 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 81.54 6.3 89.27 Favored Glycine 0 CA--C 1.526 0.721 0 C-N-CA 124.469 1.033 . . . . 0.0 114.007 169.243 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 5.3 m-85 -97.97 169.26 9.76 Favored 'General case' 0 C--O 1.238 0.485 0 CA-C-N 118.328 1.064 . . . . 0.0 108.746 174.819 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 56.5 m-85 -104.04 140.26 38.0 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 125.799 1.639 . . . . 0.0 108.33 175.379 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 41.6 t80 -107.58 142.42 37.53 Favored 'General case' 0 CA--C 1.512 -0.497 0 N-CA-C 107.386 -1.339 . . . . 0.0 107.386 179.666 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 11.8 m-20 -117.4 78.02 10.64 Favored Pre-proline 0 N--CA 1.441 -0.913 0 N-CA-C 107.71 -1.219 . . . . 0.0 107.71 -160.753 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 22.3 Cg_endo -64.57 -4.69 8.74 Favored 'Trans proline' 0 C--N 1.348 0.513 0 C-N-CA 124.044 3.163 . . . . 0.0 113.989 -173.706 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 99.6 mm-40 -71.89 -24.37 61.64 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-O 118.823 -0.608 . . . . 0.0 111.008 172.421 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 1.1 p -143.57 -15.9 0.64 Allowed 'General case' 0 CA--C 1.532 0.274 0 N-CA-C 114.747 1.388 . . . . 0.0 114.747 -176.061 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 89.69 12.25 62.76 Favored Glycine 0 CA--C 1.531 1.043 0 CA-C-N 119.848 1.204 . . . . 0.0 113.563 -176.198 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 55.0 mt -88.83 178.83 6.34 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.574 1.149 . . . . 0.0 109.256 178.253 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 39.3 m-85 -124.19 149.74 46.0 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 123.577 0.751 . . . . 0.0 109.164 163.583 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 41.0 t80 -118.39 150.26 39.85 Favored 'General case' 0 C--O 1.24 0.56 0 C-N-CA 126.822 2.049 . . . . 0.0 109.628 178.0 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -116.85 143.54 31.69 Favored Pre-proline 0 CA--C 1.537 0.477 0 C-N-CA 123.444 0.698 . . . . 0.0 109.516 171.784 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_endo -81.51 -22.43 5.61 Favored 'Trans proline' 0 N--CA 1.458 -0.617 0 C-N-CA 122.509 2.139 . . . . 0.0 114.922 -174.098 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 56.5 m-80 -77.38 -40.66 42.99 Favored 'General case' 0 N--CA 1.445 -0.681 0 O-C-N 120.915 -1.116 . . . . 0.0 108.675 164.406 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' SER . . . . . 0.423 ' C ' ' H ' ' A' ' 42' ' ' TYR . 38.5 m -124.54 95.61 4.59 Favored 'General case' 0 N--CA 1.452 -0.375 0 CA-C-O 122.028 0.918 . . . . 0.0 110.536 -156.965 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 20.2 mp0 -62.55 3.62 0.2 Allowed 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 125.758 1.623 . . . . 0.0 113.871 -174.388 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . 0.423 ' H ' ' C ' ' A' ' 40' ' ' SER . 19.0 m-85 -79.41 98.63 6.84 Favored 'General case' 0 N--CA 1.438 -1.034 0 C-N-CA 125.333 1.453 . . . . 0.0 108.17 -179.604 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 48.6 m-85 -59.17 120.25 8.84 Favored 'General case' 0 N--CA 1.445 -0.7 0 C-N-CA 125.706 1.603 . . . . 0.0 109.014 177.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 79.5 t80 -78.65 138.52 38.35 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 124.242 1.017 . . . . 0.0 108.385 176.77 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 24.4 t30 -116.65 85.79 2.38 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 127.033 2.133 . . . . 0.0 107.256 175.025 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -45.41 -40.26 7.93 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 127.65 2.38 . . . . 0.0 111.736 178.004 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -44.63 -41.74 6.88 Favored 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 127.397 2.279 . . . . 0.0 112.704 179.823 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 4.0 m -129.87 14.21 5.82 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 125.495 1.518 . . . . 0.0 109.774 -176.723 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . 0.411 4.5 pt20 44.38 30.64 0.49 Allowed 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 128.732 2.813 . . . . 0.0 113.989 -172.745 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -90.77 162.83 14.69 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 127.402 2.281 . . . . 0.0 110.633 -169.435 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 3.4 m-85 -110.44 131.8 54.74 Favored 'General case' 0 C--O 1.233 0.234 0 C-N-CA 124.558 1.143 . . . . 0.0 108.991 174.019 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 60.7 mt -128.67 178.08 6.58 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 126.91 2.084 . . . . 0.0 108.218 -178.129 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 9.6 p90 -138.03 148.38 45.05 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 106.807 -1.553 . . . . 0.0 106.807 166.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 43.8 t-105 -71.96 136.92 46.97 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 105.42 -2.067 . . . . 0.0 105.42 162.412 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -131.07 95.85 3.9 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 178.403 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -71.25 -5.5 59.26 Favored Glycine 0 CA--C 1.528 0.851 0 CA-C-O 118.722 -1.043 . . . . 0.0 112.538 -178.373 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -71.9 -58.77 3.17 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 119.496 1.648 . . . . 0.0 107.096 173.182 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 75.6 mtt-85 -80.36 -18.54 48.74 Favored 'General case' 0 C--O 1.232 0.173 0 C-N-CA 125.381 1.472 . . . . 0.0 112.636 -179.804 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 97.6 mtt180 55.93 58.84 4.12 Favored 'General case' 0 C--O 1.234 0.239 0 C-N-CA 127.094 2.157 . . . . 0.0 109.457 -173.912 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 6.2 t -155.22 -177.69 6.72 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 125.195 1.398 . . . . 0.0 108.55 175.045 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 76.0 m-85 -112.61 129.9 56.22 Favored 'General case' 0 C--O 1.238 0.477 0 C-N-CA 124.321 1.048 . . . . 0.0 108.791 172.462 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -126.29 154.74 74.66 Favored Pre-proline 0 C--N 1.326 -0.441 0 C-N-CA 126.4 1.88 . . . . 0.0 110.499 -171.53 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_endo -75.28 124.84 8.74 Favored 'Trans proline' 0 C--N 1.348 0.506 0 C-N-CA 122.927 2.418 . . . . 0.0 111.204 -178.299 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.411 0 N-CA-C 115.896 1.813 . . . . 0.0 115.896 -167.18 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 33.7 m-85 . . . . . 0 CA--C 1.538 0.509 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_endo -65.68 -171.4 0.21 Allowed 'Trans proline' 0 CA--C 1.537 0.646 0 C-N-CA 122.695 2.263 . . . . 0.0 110.339 164.031 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 61.7 t -104.92 87.29 1.79 Allowed Pre-proline 0 C--N 1.329 -0.304 0 N-CA-C 106.646 -1.612 . . . . 0.0 106.646 171.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 96.8 Cg_endo -64.15 156.23 60.41 Favored 'Trans proline' 0 N--CA 1.451 -1.005 0 C-N-CA 122.226 1.951 . . . . 0.0 110.05 -177.547 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -135.12 129.29 33.67 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 123.898 0.879 . . . . 0.0 109.064 177.926 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 9.1 p -63.94 -26.44 40.56 Favored 'Isoleucine or valine' 0 C--O 1.234 0.266 0 C-N-CA 124.586 1.154 . . . . 0.0 111.531 178.758 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 41.5 m -69.6 1.77 3.82 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 119.908 1.231 . . . . 0.0 112.726 -178.103 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 7.0 t -125.9 11.0 7.7 Favored 'General case' 0 CA--C 1.545 0.777 0 O-C-N 120.899 -1.125 . . . . 0.0 111.773 169.757 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 15.0 m-30 -70.02 159.48 33.73 Favored 'General case' 0 C--O 1.24 0.581 0 O-C-N 120.525 -1.359 . . . . 0.0 111.694 172.346 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 54.6 mt-30 -82.59 135.07 35.16 Favored 'General case' 0 C--O 1.225 -0.234 0 N-CA-C 107.1 -1.444 . . . . 0.0 107.1 167.292 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 45.7 t80 -75.81 164.57 26.1 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 118.796 0.726 . . . . 0.0 109.145 160.246 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -143.04 108.82 5.13 Favored 'General case' 0 CA--C 1.51 -0.596 0 N-CA-C 108.868 -0.79 . . . . 0.0 108.868 159.696 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -59.72 -19.81 52.4 Favored 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 113.154 0.798 . . . . 0.0 113.154 174.628 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 1.4 t -55.29 -35.61 65.25 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 123.59 0.756 . . . . 0.0 110.694 -179.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 15.8 m -114.21 -28.06 7.42 Favored 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 125.147 1.379 . . . . 0.0 110.663 173.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 87.19 25.09 34.89 Favored Glycine 0 CA--C 1.528 0.898 0 N-CA-C 110.318 -1.113 . . . . 0.0 110.318 -173.432 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 6.7 m-85 -117.97 175.25 5.76 Favored 'General case' 0 C--O 1.232 0.176 0 C-N-CA 126.103 1.761 . . . . 0.0 107.776 -170.807 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -110.4 151.19 27.78 Favored 'General case' 0 CA--C 1.521 -0.157 0 N-CA-C 109.084 -0.71 . . . . 0.0 109.084 172.77 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 44.7 t80 -118.81 137.84 53.11 Favored 'General case' 0 N--CA 1.446 -0.633 0 C-N-CA 127.612 2.365 . . . . 0.0 107.79 179.761 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 37.3 t0 -106.95 86.22 2.29 Favored Pre-proline 0 C--N 1.33 -0.268 0 C-N-CA 126.129 1.772 . . . . 0.0 111.28 -175.612 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 22.9 Cg_endo -60.81 -14.25 31.13 Favored 'Trans proline' 0 CA--C 1.537 0.664 0 C-N-CA 121.903 1.735 . . . . 0.0 113.798 177.918 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 4.7 tt0 -67.81 -16.33 64.06 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 119.399 0.999 . . . . 0.0 111.276 176.731 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 40.1 p -131.48 -63.12 0.85 Allowed 'General case' 0 N--CA 1.447 -0.612 0 C-N-CA 125.271 1.428 . . . . 0.0 107.896 177.351 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 124.5 12.61 4.12 Favored Glycine 0 CA--C 1.531 1.05 0 C-N-CA 127.041 2.258 . . . . 0.0 112.025 -167.65 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 32.0 mt -87.22 175.59 7.97 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 126.119 1.768 . . . . 0.0 109.85 176.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 42.7 m-85 -117.42 167.41 11.29 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 125.097 1.359 . . . . 0.0 109.617 166.775 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 31.3 t80 -144.66 156.27 44.02 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 128.158 2.583 . . . . 0.0 108.345 -179.565 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 42.6 t0 -126.17 142.33 42.34 Favored Pre-proline 0 N--CA 1.473 0.722 0 N-CA-C 107.716 -1.216 . . . . 0.0 107.716 175.287 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 41.5 Cg_endo -73.15 -38.9 2.45 Favored 'Trans proline' 0 C--N 1.345 0.391 0 CA-C-N 120.952 1.376 . . . . 0.0 112.826 -176.15 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 30.5 m-20 -75.69 -25.66 56.91 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-O 118.533 -0.746 . . . . 0.0 111.383 -178.416 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 67.2 m -131.73 94.38 3.5 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 125.809 1.643 . . . . 0.0 109.434 -174.715 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 12.1 mp0 -59.43 -3.12 0.39 Allowed 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.974 1.31 . . . . 0.0 114.163 -178.119 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 68.4 m-85 -61.25 111.07 1.59 Allowed 'General case' 0 N--CA 1.446 -0.632 0 CA-C-N 119.189 0.904 . . . . 0.0 108.887 171.934 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 30.4 m-85 -62.1 153.63 29.38 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 123.519 0.727 . . . . 0.0 109.45 174.744 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 68.8 t80 -119.69 117.55 28.56 Favored 'General case' 0 N--CA 1.443 -0.811 0 CA-C-O 122.476 1.131 . . . . 0.0 108.802 -179.325 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 21.2 t30 -95.95 89.7 5.32 Favored 'General case' 0 N--CA 1.442 -0.863 0 C-N-CA 125.715 1.606 . . . . 0.0 107.354 175.252 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -48.1 -42.24 28.4 Favored 'General case' 0 CA--C 1.529 0.157 0 C-N-CA 124.838 1.255 . . . . 0.0 112.169 174.819 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -44.49 -48.64 10.11 Favored 'General case' 0 N--CA 1.448 -0.572 0 C-N-CA 126.213 1.805 . . . . 0.0 112.232 -175.621 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -118.43 12.78 13.39 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 125.207 1.403 . . . . 0.0 110.507 -177.052 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 31.2 mt-30 44.24 45.72 7.23 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 128.646 2.778 . . . . 0.0 112.755 -175.925 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -117.24 143.65 45.66 Favored 'General case' 0 N--CA 1.448 -0.557 0 C-N-CA 125.483 1.513 . . . . 0.0 110.233 -171.504 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 58.3 m-85 -101.73 132.29 47.53 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 123.441 0.696 . . . . 0.0 111.704 176.432 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.1 mt -135.87 -177.89 4.89 Favored 'General case' 0 C--N 1.323 -0.555 0 C-N-CA 126.779 2.031 . . . . 0.0 108.739 -165.414 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 25.7 p90 -135.02 164.76 26.91 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 124.179 0.992 . . . . 0.0 109.219 173.182 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 21.4 t-105 -109.23 137.82 46.53 Favored 'General case' 0 CA--C 1.504 -0.794 0 C-N-CA 125.955 1.702 . . . . 0.0 108.501 172.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 22.7 p-10 -133.56 77.29 1.71 Allowed 'General case' 0 N--CA 1.42 -1.958 0 C-N-CA 126.822 2.049 . . . . 0.0 107.208 -171.163 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -61.03 1.09 0.91 Allowed Glycine 0 CA--C 1.53 1.018 0 C-N-CA 125.025 1.298 . . . . 0.0 114.538 179.288 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 14.9 mt-10 -69.72 -63.32 1.1 Allowed 'General case' 0 N--CA 1.444 -0.754 0 N-CA-C 106.552 -1.647 . . . . 0.0 106.552 171.789 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 82.4 mtt180 -72.91 -23.15 60.67 Favored 'General case' 0 C--O 1.226 -0.146 0 C-N-CA 127.157 2.183 . . . . 0.0 111.323 173.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 52.9 mtt85 56.24 69.83 0.7 Allowed 'General case' 0 C--O 1.232 0.151 0 C-N-CA 126.295 1.838 . . . . 0.0 109.456 -162.861 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 6.8 t -144.24 -175.11 4.49 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 118.385 0.539 . . . . 0.0 110.194 170.165 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 91.3 m-85 -120.54 129.1 53.66 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 107.101 -1.444 . . . . 0.0 107.101 164.351 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -126.22 154.92 74.49 Favored Pre-proline 0 C--N 1.325 -0.458 0 C-N-CA 125.95 1.7 . . . . 0.0 113.068 -175.763 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -80.42 132.15 8.91 Favored 'Trans proline' 0 N--CA 1.443 -1.467 0 C-N-CA 121.355 1.37 . . . . 0.0 112.36 -171.907 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.571 0 C-N-CA 123.832 0.853 . . . . 0.0 113.118 -172.704 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 61.2 m-85 . . . . . 0 C--O 1.241 0.637 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 68.2 Cg_endo -67.67 -175.33 0.71 Allowed 'Trans proline' 0 CA--C 1.538 0.687 0 C-N-CA 123.661 2.908 . . . . 0.0 109.874 161.134 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 18.6 t -116.55 86.09 17.8 Favored Pre-proline 0 CA--C 1.541 0.607 0 C-N-CA 125.222 1.409 . . . . 0.0 107.813 -173.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo -73.17 174.87 11.34 Favored 'Trans proline' 0 C--N 1.347 0.456 0 C-N-CA 124.72 3.613 . . . . 0.0 111.667 -177.723 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -142.79 131.95 23.22 Favored 'General case' 0 N--CA 1.445 -0.692 0 C-N-CA 125.935 1.694 . . . . 0.0 110.881 -175.194 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 7.1 p -63.81 -26.39 40.5 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.423 0 O-C-N 121.061 -1.025 . . . . 0.0 112.558 179.549 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 93.1 p -71.64 0.67 8.14 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 120.06 1.3 . . . . 0.0 113.568 178.846 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 32.1 p -111.32 1.79 17.29 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.475 1.11 . . . . 0.0 112.02 172.076 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 11.0 m-30 -69.46 172.46 7.19 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.647 1.179 . . . . 0.0 111.88 -178.808 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 2.8 mm100 -116.11 101.88 9.12 Favored 'General case' 0 N--CA 1.478 0.926 0 N-CA-C 114.663 1.357 . . . . 0.0 114.663 179.03 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 55.1 t80 -63.68 147.84 50.57 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 118.426 0.557 . . . . 0.0 111.621 -175.637 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 8.4 t0 -124.82 84.42 2.28 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 123.289 0.636 . . . . 0.0 109.769 176.809 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.75 -19.48 50.49 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 115.152 1.538 . . . . 0.0 115.152 -172.351 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 5.9 t -49.16 -46.93 46.0 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-O 118.346 -0.835 . . . . 0.0 110.313 166.264 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 64.8 m -130.07 -8.16 4.36 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 114.203 1.186 . . . . 0.0 114.203 -171.625 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 96.87 14.57 42.56 Favored Glycine 0 CA--C 1.526 0.771 0 CA-C-N 119.081 0.855 . . . . 0.0 114.221 155.707 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 16.9 m-85 -110.49 171.69 7.31 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 118.287 1.044 . . . . 0.0 109.027 -176.967 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 35.0 m-85 -113.03 121.81 45.72 Favored 'General case' 0 CA--C 1.529 0.142 0 C-N-CA 124.644 1.177 . . . . 0.0 108.624 -175.353 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 71.9 t80 -91.26 138.45 31.58 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 124.475 1.11 . . . . 0.0 110.694 -177.467 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 32.3 t0 -98.78 86.81 0.53 Allowed Pre-proline 0 N--CA 1.472 0.645 0 C-N-CA 126.233 1.813 . . . . 0.0 111.992 179.497 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_endo -60.9 -11.84 19.74 Favored 'Trans proline' 0 N--CA 1.459 -0.541 0 C-N-CA 122.415 2.077 . . . . 0.0 114.196 178.218 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -63.86 -29.52 70.7 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 119.743 1.156 . . . . 0.0 110.0 173.928 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 38.4 p -133.98 -42.42 0.82 Allowed 'General case' 0 C--O 1.235 0.301 0 CA-C-N 118.867 0.758 . . . . 0.0 112.833 -174.102 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 113.78 19.35 6.52 Favored Glycine 0 CA--C 1.534 1.228 0 C-N-CA 125.605 1.574 . . . . 0.0 112.322 -179.533 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 22.5 mt -93.11 176.21 6.5 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 126.466 1.906 . . . . 0.0 109.306 178.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 55.6 m-85 -121.96 165.36 16.09 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 124.678 1.191 . . . . 0.0 110.603 172.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 77.0 t80 -147.93 160.06 43.2 Favored 'General case' 0 C--O 1.239 0.534 0 C-N-CA 129.112 2.965 . . . . 0.0 108.475 -175.897 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 8.8 t0 -129.35 143.74 50.07 Favored Pre-proline 0 CA--C 1.537 0.469 0 N-CA-C 107.358 -1.349 . . . . 0.0 107.358 178.712 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_endo -63.72 -42.68 19.35 Favored 'Trans proline' 0 CA--C 1.537 0.633 0 C-N-CA 122.457 2.105 . . . . 0.0 113.262 -179.842 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 88.4 m-20 -75.07 -43.06 55.35 Favored 'General case' 0 N--CA 1.446 -0.647 0 C-N-CA 124.565 1.146 . . . . 0.0 109.596 176.041 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 14.9 m -103.92 97.89 7.81 Favored 'General case' 0 N--CA 1.456 -0.132 0 C-N-CA 123.727 0.811 . . . . 0.0 109.11 -171.177 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 7.4 mp0 -58.83 -15.61 13.3 Favored 'General case' 0 CA--C 1.541 0.621 0 O-C-N 121.78 -0.575 . . . . 0.0 111.135 173.526 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 32.1 m-85 -61.5 105.44 0.52 Allowed 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 125.94 1.696 . . . . 0.0 109.7 170.163 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 27.1 m-85 -67.99 168.36 12.01 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 124.692 1.197 . . . . 0.0 110.52 175.078 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 75.7 t80 -123.48 121.22 35.13 Favored 'General case' 0 N--CA 1.446 -0.649 0 C-N-CA 125.422 1.489 . . . . 0.0 109.559 176.183 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 28.1 t30 -86.18 88.38 7.59 Favored 'General case' 0 N--CA 1.443 -0.784 0 C-N-CA 127.875 2.47 . . . . 0.0 108.744 173.147 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -52.09 -36.39 50.7 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.498 0.719 . . . . 0.0 111.825 175.524 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -48.01 -57.09 6.22 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 126.393 1.877 . . . . 0.0 112.172 -178.257 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -111.23 18.48 19.27 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 125.037 1.335 . . . . 0.0 111.603 179.317 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 3.0 mt-30 48.4 34.0 4.37 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 125.579 1.551 . . . . 0.0 112.606 -176.516 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -105.76 174.56 5.83 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 126.714 2.006 . . . . 0.0 110.975 -174.02 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 5.6 m-85 -114.44 146.47 40.59 Favored 'General case' 0 C--N 1.332 -0.153 0 N-CA-C 108.387 -0.968 . . . . 0.0 108.387 179.601 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 85.2 mt -137.82 174.76 10.24 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.966 1.306 . . . . 0.0 108.874 -175.503 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 8.7 p90 -139.46 142.96 37.35 Favored 'General case' 0 C--O 1.239 0.543 0 C-N-CA 125.687 1.595 . . . . 0.0 107.917 165.948 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 41.8 t-105 -85.12 100.86 12.0 Favored 'General case' 0 N--CA 1.449 -0.524 0 N-CA-C 105.543 -2.021 . . . . 0.0 105.543 176.907 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 51.4 t0 -88.53 87.08 7.15 Favored 'General case' 0 N--CA 1.447 -0.615 0 N-CA-C 107.61 -1.255 . . . . 0.0 107.61 -178.47 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -58.55 -17.3 32.89 Favored Glycine 0 CA--C 1.53 1.02 0 CA-C-O 118.299 -1.278 . . . . 0.0 112.345 177.599 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 17.6 mt-10 -69.7 -22.27 63.43 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 120.021 1.911 . . . . 0.0 111.282 174.47 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 8.8 mtt180 -120.16 -2.71 10.13 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 125.173 1.389 . . . . 0.0 111.359 -179.516 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 2.1 mpt_? 44.55 56.15 5.29 Favored 'General case' 0 C--O 1.234 0.252 0 C-N-CA 126.664 1.986 . . . . 0.0 110.278 -173.54 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 5.0 t -148.89 153.46 38.06 Favored 'General case' 0 N--CA 1.448 -0.53 0 N-CA-C 108.851 -0.796 . . . . 0.0 108.851 176.513 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 80.3 m-85 -93.08 115.74 28.39 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 106.186 -1.783 . . . . 0.0 106.186 175.641 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -125.26 154.92 71.99 Favored Pre-proline 0 C--N 1.326 -0.425 0 C-N-CA 125.667 1.587 . . . . 0.0 110.274 -171.462 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -68.32 130.32 20.96 Favored 'Trans proline' 0 N--CA 1.455 -0.782 0 C-N-CA 122.36 2.04 . . . . 0.0 110.464 -179.032 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.231 0 CA-C-O 121.993 0.901 . . . . 0.0 112.764 177.916 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 58.5 m-85 . . . . . 0 C--O 1.235 0.329 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -61.04 169.69 5.73 Favored 'Trans proline' 0 N--CA 1.453 -0.873 0 C-N-CA 121.823 1.682 . . . . 0.0 109.846 161.94 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 59.7 t -104.67 86.69 1.51 Allowed Pre-proline 0 C--O 1.241 0.615 0 N-CA-C 107.073 -1.454 . . . . 0.0 107.073 -173.028 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 69.0 Cg_endo -66.79 169.18 15.13 Favored 'Trans proline' 0 CA--C 1.534 0.48 0 C-N-CA 123.856 3.037 . . . . 0.0 111.525 -168.929 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.434 ' CG ' ' HG ' ' A' ' 16' ' ' SER . 7.4 t0 -146.43 123.15 11.21 Favored 'General case' 0 C--O 1.232 0.164 0 O-C-N 121.535 -0.728 . . . . 0.0 111.057 -175.948 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 13.3 p -58.61 -20.84 17.24 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.671 0 C-N-CA 124.679 1.192 . . . . 0.0 112.695 -178.052 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' SER . . . . . 0.434 ' HG ' ' CG ' ' A' ' 14' ' ' ASP . 38.7 p -64.66 -13.7 55.13 Favored 'General case' 0 N--CA 1.434 -1.229 0 O-C-N 119.856 -1.777 . . . . 0.0 113.705 179.24 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 12.7 t -119.87 8.42 11.1 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 125.185 1.394 . . . . 0.0 110.75 176.669 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 12.9 m-30 -74.68 155.78 37.38 Favored 'General case' 0 C--O 1.238 0.467 0 O-C-N 120.977 -1.077 . . . . 0.0 110.524 170.68 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 25.5 mt-30 -93.47 150.79 20.17 Favored 'General case' 0 C--O 1.224 -0.26 0 CA-C-N 114.915 -1.039 . . . . 0.0 109.79 171.457 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 70.2 t80 -96.46 152.81 18.26 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 124.567 1.147 . . . . 0.0 109.975 167.469 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -132.66 97.28 4.02 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 124.134 0.974 . . . . 0.0 109.415 173.872 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 1.3 pt-20 -62.22 -20.2 63.95 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 125.307 1.443 . . . . 0.0 113.861 -172.403 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 15.1 t -56.74 -24.8 52.39 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 123.495 0.718 . . . . 0.0 111.617 171.38 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 66.2 m -133.14 -19.92 2.19 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.834 1.254 . . . . 0.0 112.775 179.522 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 62.77 25.37 67.49 Favored Glycine 0 CA--C 1.531 1.073 0 O-C-N 121.016 -1.052 . . . . 0.0 112.682 -175.516 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 17.8 m-85 -87.98 170.57 11.01 Favored 'General case' 0 C--O 1.238 0.482 0 N-CA-C 107.419 -1.326 . . . . 0.0 107.419 160.966 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 76.9 m-85 -107.04 152.45 23.99 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 124.316 1.046 . . . . 0.0 108.741 166.782 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 46.6 t80 -111.21 137.63 48.67 Favored 'General case' 0 N--CA 1.447 -0.623 0 C-N-CA 126.933 2.093 . . . . 0.0 108.315 179.162 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 6.2 t0 -96.02 86.7 0.37 Allowed Pre-proline 0 CA--C 1.532 0.267 0 C-N-CA 128.609 2.763 . . . . 0.0 107.048 177.335 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -66.91 -10.27 27.8 Favored 'Trans proline' 0 C--N 1.347 0.485 0 C-N-CA 122.424 2.083 . . . . 0.0 111.983 175.982 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 10.0 tt0 -70.1 -18.54 63.25 Favored 'General case' 0 N--CA 1.447 -0.599 0 C-N-CA 124.578 1.151 . . . . 0.0 110.523 -179.151 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 37.0 p -145.57 -53.29 0.27 Allowed 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 126.165 1.786 . . . . 0.0 111.106 178.438 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 135.1 12.23 1.3 Allowed Glycine 0 CA--C 1.531 1.08 0 C-N-CA 126.329 1.919 . . . . 0.0 113.851 178.727 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 10.7 mt -81.1 177.19 9.2 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 118.92 1.36 . . . . 0.0 110.339 178.332 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 59.5 m-85 -121.95 167.52 12.97 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.275 1.03 . . . . 0.0 110.196 168.915 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 33.9 t80 -149.65 139.73 22.08 Favored 'General case' 0 C--O 1.235 0.317 0 C-N-CA 127.518 2.327 . . . . 0.0 107.835 -172.63 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -99.29 143.25 26.06 Favored Pre-proline 0 CA--C 1.538 0.506 0 N-CA-C 106.951 -1.5 . . . . 0.0 106.951 -178.389 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -66.48 -38.43 19.6 Favored 'Trans proline' 0 C--O 1.236 0.417 0 C-N-CA 121.423 1.415 . . . . 0.0 113.735 -178.841 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 11.2 m-80 -99.78 -14.26 18.91 Favored 'General case' 0 CA--C 1.518 -0.264 0 N-CA-C 113.31 0.855 . . . . 0.0 113.31 -172.414 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 24.2 m -127.93 103.33 7.19 Favored 'General case' 0 C--N 1.32 -0.689 0 C-N-CA 125.954 1.702 . . . . 0.0 107.659 178.161 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -65.62 -1.51 2.75 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 123.56 0.744 . . . . 0.0 112.344 -176.832 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 42.1 m-85 -60.98 120.75 10.82 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 119.414 1.007 . . . . 0.0 108.435 164.769 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 32.5 m-85 -74.1 164.36 26.71 Favored 'General case' 0 N--CA 1.442 -0.838 0 C-N-CA 124.482 1.113 . . . . 0.0 109.355 173.611 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 94.4 t80 -119.44 139.52 51.91 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 125.474 1.509 . . . . 0.0 108.674 173.027 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 18.7 t30 -121.17 79.97 1.59 Allowed 'General case' 0 N--CA 1.444 -0.745 0 C-N-CA 128.169 2.588 . . . . 0.0 106.179 -171.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -52.15 -33.07 38.63 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 123.629 0.772 . . . . 0.0 111.621 179.97 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -46.19 -38.04 7.83 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 127.369 2.268 . . . . 0.0 113.012 177.097 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.3 m -129.05 13.12 6.22 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 125.141 1.376 . . . . 0.0 110.488 179.127 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 52.4 mt-30 44.02 35.25 1.11 Allowed 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 128.859 2.864 . . . . 0.0 113.7 -169.003 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -108.08 -179.83 4.01 Favored 'General case' 0 N--CA 1.448 -0.54 0 C-N-CA 124.839 1.256 . . . . 0.0 112.145 -176.227 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 55.4 m-85 -123.28 139.7 53.78 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 124.723 1.209 . . . . 0.0 109.221 -178.08 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 64.9 mt -130.97 167.25 19.34 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.865 1.266 . . . . 0.0 107.838 -174.28 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 13.6 p90 -126.05 149.85 48.56 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 107.437 -1.319 . . . . 0.0 107.437 165.835 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 62.9 t-105 -88.03 152.92 21.68 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 106.212 -1.774 . . . . 0.0 106.212 166.805 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 49.0 t0 -145.58 155.25 42.93 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 107.595 -1.261 . . . . 0.0 107.595 166.553 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -100.84 -7.93 49.51 Favored Glycine 0 CA--C 1.526 0.758 0 CA-C-O 118.883 -0.954 . . . . 0.0 112.322 177.95 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 75.6 mt-10 -74.11 -44.29 54.42 Favored 'General case' 0 C--N 1.341 0.201 0 CA-C-N 119.664 1.732 . . . . 0.0 107.824 177.251 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 81.3 mtt180 -102.05 -5.21 24.82 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-O 117.703 -1.142 . . . . 0.0 112.499 -178.499 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 60.6 mtt85 43.95 57.89 3.91 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 126.997 2.119 . . . . 0.0 111.941 177.684 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 10.0 t -151.05 156.44 41.11 Favored 'General case' 0 N--CA 1.442 -0.835 0 N-CA-C 107.848 -1.167 . . . . 0.0 107.848 177.174 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 31.3 m-85 -75.27 128.25 35.0 Favored 'General case' 0 C--O 1.238 0.479 0 N-CA-C 106.616 -1.624 . . . . 0.0 106.616 154.499 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -126.04 154.46 73.99 Favored Pre-proline 0 C--N 1.325 -0.481 0 C-N-CA 126.81 2.044 . . . . 0.0 111.429 -178.697 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -71.78 122.68 8.74 Favored 'Trans proline' 0 N--CA 1.456 -0.686 0 C-N-CA 122.87 2.38 . . . . 0.0 111.782 -176.17 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.311 0 N-CA-C 115.144 1.535 . . . . 0.0 115.144 -174.691 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 44.0 m-85 . . . . . 0 C--O 1.241 0.656 0 N-CA-C 109.922 -0.399 . . . . 0.0 109.922 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 62.8 Cg_endo -71.82 -169.0 0.4 Allowed 'Trans proline' 0 N--CA 1.46 -0.468 0 C-N-CA 123.598 2.865 . . . . 0.0 110.516 170.497 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 85.9 t -109.38 88.13 5.78 Favored Pre-proline 0 CA--C 1.539 0.544 0 C-N-CA 126.232 1.813 . . . . 0.0 108.341 178.226 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 64.9 Cg_endo -66.4 175.23 5.23 Favored 'Trans proline' 0 CA--C 1.543 0.935 0 C-N-CA 122.957 2.438 . . . . 0.0 112.744 -177.356 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -154.1 147.76 25.26 Favored 'General case' 0 N--CA 1.465 0.295 0 C-N-CA 123.171 0.588 . . . . 0.0 111.144 168.234 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.482 ' HA ' ' CD2' ' A' ' 18' ' ' TYR . 13.0 p -58.01 -22.9 20.01 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.151 0 C-N-CA 125.22 1.408 . . . . 0.0 114.048 178.711 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 8.0 t -64.92 -3.5 3.51 Favored 'General case' 0 CA--C 1.541 0.633 0 O-C-N 121.022 -1.049 . . . . 0.0 112.52 174.476 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 40.9 p -105.48 -7.98 18.36 Favored 'General case' 0 CA--C 1.543 0.707 0 CA-C-N 119.558 1.072 . . . . 0.0 112.369 178.257 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . 0.482 ' CD2' ' HA ' ' A' ' 15' ' ' VAL . 17.8 m-30 -88.99 168.28 12.49 Favored 'General case' 0 C--N 1.342 0.282 0 C-N-CA 124.61 1.164 . . . . 0.0 111.637 -170.226 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 14.5 mt-30 -118.09 116.04 26.05 Favored 'General case' 0 C--O 1.226 -0.181 0 C-N-CA 124.835 1.254 . . . . 0.0 110.099 178.805 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 69.6 t80 -71.27 143.02 50.5 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 118.473 0.578 . . . . 0.0 110.509 172.962 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -131.0 96.75 4.13 Favored 'General case' 0 CA--C 1.515 -0.376 0 C-N-CA 124.425 1.09 . . . . 0.0 110.141 178.529 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.7 pt-20 -53.54 -19.12 3.39 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.86 1.264 . . . . 0.0 113.289 -179.972 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 1.3 t -64.21 -17.92 64.01 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.229 1.412 . . . . 0.0 111.974 178.581 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -143.83 -19.96 0.58 Allowed 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 119.341 0.973 . . . . 0.0 112.467 177.712 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 89.88 10.57 64.63 Favored Glycine 0 CA--C 1.529 0.923 0 CA-C-O 118.331 -1.261 . . . . 0.0 113.433 176.105 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 -110.63 151.08 28.09 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-N 119.257 1.529 . . . . 0.0 108.468 177.602 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 66.0 m-85 -80.29 147.79 31.0 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 106.774 -1.565 . . . . 0.0 106.774 172.764 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 35.9 t80 -105.67 135.32 47.29 Favored 'General case' 0 C--O 1.239 0.515 0 C-N-CA 125.039 1.336 . . . . 0.0 110.223 175.892 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -99.65 85.8 0.51 Allowed Pre-proline 0 N--CA 1.451 -0.403 0 C-N-CA 126.824 2.049 . . . . 0.0 110.771 -178.591 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -65.73 -5.68 12.33 Favored 'Trans proline' 0 N--CA 1.458 -0.58 0 C-N-CA 121.649 1.566 . . . . 0.0 113.994 -179.49 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 36.7 tt0 -77.31 -33.03 55.69 Favored 'General case' 0 N--CA 1.447 -0.594 0 O-C-N 121.263 -0.898 . . . . 0.0 110.46 177.948 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' THR . . . . . 0.495 ' HB ' ' CD2' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -135.37 -19.57 1.67 Allowed 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 126.268 1.827 . . . . 0.0 112.988 -162.913 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 94.84 -4.78 68.8 Favored Glycine 0 N--CA 1.445 -0.725 0 CA-C-O 117.678 -1.623 . . . . 0.0 113.623 175.584 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.495 ' CD2' ' HB ' ' A' ' 32' ' ' THR . 0.0 OUTLIER -76.84 -179.45 5.43 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 119.847 1.824 . . . . 0.0 109.906 178.644 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 41.0 m-85 -116.54 135.34 53.9 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-N 114.672 -1.149 . . . . 0.0 109.688 161.126 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 63.7 t80 -92.18 153.38 19.35 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 126.213 1.805 . . . . 0.0 109.683 168.235 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -128.93 144.28 51.93 Favored Pre-proline 0 CA--C 1.538 0.499 0 O-C-N 121.523 -0.736 . . . . 0.0 110.383 172.461 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 61.9 Cg_endo -72.75 -23.78 18.91 Favored 'Trans proline' 0 N--CA 1.457 -0.654 0 C-N-CA 122.445 2.096 . . . . 0.0 114.573 -176.539 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -84.79 -31.11 24.09 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-N 120.558 1.526 . . . . 0.0 109.935 166.029 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 49.4 m -127.32 92.77 3.57 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-O 122.403 1.096 . . . . 0.0 110.724 -162.924 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 5.5 mp0 -62.7 -5.92 3.14 Favored 'General case' 0 CA--C 1.546 0.825 0 CA-C-N 115.215 -0.902 . . . . 0.0 111.216 168.98 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 24.7 m-85 -62.92 98.0 0.12 Allowed 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 125.829 1.652 . . . . 0.0 107.398 160.395 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 67.9 m-85 -61.69 157.16 18.34 Favored 'General case' 0 C--O 1.232 0.153 0 C-N-CA 126.335 1.854 . . . . 0.0 111.511 177.692 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 10.8 t80 -115.89 108.45 16.3 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 125.029 1.332 . . . . 0.0 108.769 174.812 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 29.7 t30 -90.32 75.74 6.85 Favored 'General case' 0 C--O 1.235 0.299 0 C-N-CA 126.761 2.024 . . . . 0.0 106.111 177.359 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -48.63 -31.07 6.12 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 124.845 1.258 . . . . 0.0 111.413 178.703 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -44.75 -39.25 5.04 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 127.643 2.377 . . . . 0.0 112.594 178.901 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 35.2 m -134.22 20.14 3.72 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.956 1.302 . . . . 0.0 110.101 176.054 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 37.3 mt-30 46.66 17.82 0.06 Allowed 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 128.741 2.817 . . . . 0.0 114.844 -165.995 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 33.7 mm-40 -76.28 166.49 23.37 Favored 'General case' 0 CA--C 1.522 -0.117 0 CA-C-N 119.623 1.101 . . . . 0.0 111.623 -176.027 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 9.6 m-85 -118.98 123.93 45.75 Favored 'General case' 0 N--CA 1.45 -0.448 0 N-CA-C 106.318 -1.734 . . . . 0.0 106.318 -177.788 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 22.6 mt -124.1 167.81 13.72 Favored 'General case' 0 N--CA 1.464 0.252 0 C-N-CA 126.478 1.911 . . . . 0.0 110.495 -177.032 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 9.3 p90 -134.23 148.88 50.92 Favored 'General case' 0 N--CA 1.448 -0.573 0 O-C-N 120.948 -1.095 . . . . 0.0 108.197 164.722 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 39.6 t-105 -70.92 130.49 41.75 Favored 'General case' 0 C--O 1.236 0.365 0 N-CA-C 106.242 -1.762 . . . . 0.0 106.242 167.128 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 18.9 t0 -122.82 92.08 3.63 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-N 119.329 0.968 . . . . 0.0 109.788 174.758 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -59.51 -12.81 20.47 Favored Glycine 0 CA--C 1.529 0.93 0 CA-C-O 117.645 -1.642 . . . . 0.0 113.58 -178.454 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 -69.57 -20.98 63.65 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 120.389 2.094 . . . . 0.0 111.508 174.149 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 78.6 mtt85 -134.58 -0.07 2.95 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 126.771 2.028 . . . . 0.0 111.334 -167.756 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 5.9 mpt_? 44.63 48.3 8.65 Favored 'General case' 0 N--CA 1.463 0.177 0 C-N-CA 129.093 2.957 . . . . 0.0 112.593 174.579 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 13.9 t -143.67 -174.63 4.3 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 107.473 -1.306 . . . . 0.0 107.473 172.052 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 51.6 m-85 -106.05 135.73 46.99 Favored 'General case' 0 C--O 1.234 0.277 0 N-CA-C 106.913 -1.514 . . . . 0.0 106.913 169.77 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -125.87 157.3 69.54 Favored Pre-proline 0 C--N 1.328 -0.359 0 C-N-CA 126.043 1.737 . . . . 0.0 109.176 178.598 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -70.77 142.08 42.64 Favored 'Trans proline' 0 N--CA 1.452 -0.932 0 C-N-CA 121.232 1.288 . . . . 0.0 111.331 179.629 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.488 0 C-N-CA 125.589 1.555 . . . . 0.0 111.245 -177.29 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 45.6 m-85 . . . . . 0 CA--C 1.536 0.433 0 CA-C-O 119.507 -0.282 . . . . 0.0 111.567 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 61.9 Cg_endo -73.11 -177.8 3.18 Favored 'Trans proline' 0 CA--C 1.537 0.672 0 C-N-CA 124.747 3.631 . . . . 0.0 112.084 174.686 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 29.7 t -110.88 87.33 6.78 Favored Pre-proline 0 CA--C 1.532 0.284 0 C-N-CA 126.818 2.047 . . . . 0.0 108.697 -176.184 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 41.0 Cg_endo -67.27 162.1 40.11 Favored 'Trans proline' 0 CA--C 1.542 0.89 0 C-N-CA 121.847 1.698 . . . . 0.0 109.955 171.539 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.47 ' C ' ' H ' ' A' ' 16' ' ' SER . 50.8 t0 -159.45 32.94 0.2 Allowed 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 123.12 0.568 . . . . 0.0 111.302 -172.817 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . 0.376 7.5 p 43.78 -22.68 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.552 1.055 1 C-N-CA 133.408 4.683 . . . . 0.0 116.727 -165.94 . . . . . . . . 3 2 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' SER . . . . . 0.47 ' H ' ' C ' ' A' ' 14' ' ' ASP . 2.8 p -70.18 -18.22 63.19 Favored 'General case' 0 N--CA 1.446 -0.672 0 C-N-CA 128.635 2.774 . . . . 0.0 111.995 -174.086 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 16.5 p -87.62 -13.95 41.37 Favored 'General case' 0 CA--C 1.538 0.501 0 O-C-N 121.139 -0.976 . . . . 0.0 110.712 175.455 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 13.7 m-30 -72.56 148.35 45.04 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-O 122.501 1.143 . . . . 0.0 111.023 -161.014 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 84.7 mt-30 -87.4 101.95 14.06 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 105.921 -1.881 . . . . 0.0 105.921 170.178 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 88.3 t80 -59.05 142.72 50.57 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 107.742 -1.207 . . . . 0.0 107.742 159.817 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -128.13 88.95 2.84 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 104.692 -2.336 . . . . 0.0 104.692 -176.484 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -56.09 -27.89 55.5 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 124.544 1.138 . . . . 0.0 113.699 -171.017 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 10.6 t -45.74 -52.93 10.26 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 126.024 1.73 . . . . 0.0 111.124 177.741 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 22.2 m -93.22 -35.71 12.98 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 118.513 0.597 . . . . 0.0 110.86 169.548 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 80.16 58.36 2.8 Favored Glycine 0 CA--C 1.524 0.61 0 N-CA-C 110.044 -1.222 . . . . 0.0 110.044 -173.198 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 30.3 m-85 -142.23 169.95 16.62 Favored 'General case' 0 C--O 1.24 0.597 0 C-N-CA 130.237 3.415 . . . . 0.0 106.229 173.138 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 82.2 m-85 -101.64 150.89 22.64 Favored 'General case' 0 CA--C 1.522 -0.116 0 O-C-N 121.906 -0.496 . . . . 0.0 111.043 178.709 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 41.6 t80 -119.84 140.92 50.06 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 127.848 2.459 . . . . 0.0 107.886 174.279 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 51.4 t0 -104.92 86.4 1.49 Allowed Pre-proline 0 N--CA 1.467 0.4 0 C-N-CA 127.468 2.307 . . . . 0.0 109.95 -177.134 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo -62.26 -13.77 34.36 Favored 'Trans proline' 0 CA--C 1.533 0.455 0 C-N-CA 122.716 2.278 . . . . 0.0 113.765 -175.924 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -74.32 -14.42 60.89 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 124.169 0.988 . . . . 0.0 111.453 -179.42 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 2.9 p -141.12 -45.77 0.38 Allowed 'General case' 0 C--N 1.332 -0.17 0 C-N-CA 125.519 1.528 . . . . 0.0 110.426 -172.204 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 98.31 46.06 2.25 Favored Glycine 0 N--CA 1.446 -0.654 0 N-CA-C 109.731 -1.348 . . . . 0.0 109.731 -175.719 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 12.7 mt -118.77 173.2 7.01 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 127.111 2.164 . . . . 0.0 107.568 172.535 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 26.4 m-85 -117.86 166.1 12.88 Favored 'General case' 0 C--O 1.238 0.481 0 C-N-CA 123.962 0.905 . . . . 0.0 109.443 168.358 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 69.2 t80 -143.87 158.65 43.55 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 125.995 1.718 . . . . 0.0 109.63 -178.372 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -131.24 143.76 50.66 Favored Pre-proline 0 CA--C 1.538 0.501 0 C-N-CA 125.406 1.482 . . . . 0.0 110.825 175.2 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -74.26 -35.12 4.18 Favored 'Trans proline' 0 CA--C 1.536 0.614 0 C-N-CA 123.465 2.777 . . . . 0.0 114.346 -178.183 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 13.6 m-80 -76.51 -23.32 53.7 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 120.085 1.311 . . . . 0.0 110.851 174.667 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -134.91 85.99 2.22 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 124.135 0.974 . . . . 0.0 108.895 -158.495 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 6.1 mp0 -62.85 -0.08 0.61 Allowed 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 124.598 1.159 . . . . 0.0 114.084 -176.038 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 60.8 m-85 -77.85 110.12 12.46 Favored 'General case' 0 C--O 1.237 0.402 0 O-C-N 120.052 -1.655 . . . . 0.0 108.449 174.525 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 14.5 m-85 -63.03 146.04 54.1 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 125.507 1.523 . . . . 0.0 109.811 -176.094 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 74.7 t80 -102.23 112.81 25.64 Favored 'General case' 0 CA--C 1.516 -0.34 0 CA-C-O 122.735 1.255 . . . . 0.0 108.206 177.785 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 49.3 t30 -84.64 80.88 9.1 Favored 'General case' 0 N--CA 1.44 -0.944 0 C-N-CA 125.266 1.427 . . . . 0.0 108.728 175.785 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -44.42 -37.17 3.25 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 125.182 1.393 . . . . 0.0 111.817 175.737 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 3.2 tt0 -44.35 -43.11 7.3 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 127.842 2.457 . . . . 0.0 112.766 179.927 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 17.9 m -131.78 21.04 4.6 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 125.438 1.495 . . . . 0.0 110.835 177.878 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 43.4 mt-30 48.27 27.99 1.47 Allowed 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 126.153 1.781 . . . . 0.0 112.571 -173.433 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.1 tp-100 -94.09 169.8 10.0 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 124.638 1.175 . . . . 0.0 110.594 -170.422 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 3.4 m-85 -108.29 144.57 35.62 Favored 'General case' 0 C--O 1.236 0.386 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 169.461 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 83.4 mt -142.6 179.93 6.68 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 127.197 2.199 . . . . 0.0 107.663 -178.991 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 17.8 p90 -135.83 146.09 47.13 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 124.435 1.094 . . . . 0.0 108.817 167.75 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 64.8 t-105 -73.43 132.95 43.54 Favored 'General case' 0 C--O 1.236 0.379 0 N-CA-C 105.676 -1.972 . . . . 0.0 105.676 164.961 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 58.9 t0 -129.63 76.6 1.73 Allowed 'General case' 0 CA--C 1.514 -0.412 0 C-N-CA 123.921 0.888 . . . . 0.0 109.004 -174.46 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -57.48 -7.16 2.78 Favored Glycine 0 CA--C 1.534 1.268 0 C-N-CA 124.692 1.139 . . . . 0.0 113.074 -176.079 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 34.3 mm-40 -65.2 -32.68 74.49 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 119.157 1.479 . . . . 0.0 109.414 169.461 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 62.5 mtt180 -118.67 -13.37 9.62 Favored 'General case' 0 C--O 1.231 0.093 0 C-N-CA 127.11 2.164 . . . . 0.0 113.466 -174.732 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 81.9 mtt180 56.58 59.72 3.44 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 124.702 1.201 . . . . 0.0 110.705 -173.8 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 4.7 t -153.94 -179.23 7.67 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 123.515 0.726 . . . . 0.0 109.051 174.475 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 98.7 m-85 -116.73 123.0 46.11 Favored 'General case' 0 C--O 1.233 0.207 0 N-CA-C 108.587 -0.894 . . . . 0.0 108.587 172.239 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -124.31 157.26 65.24 Favored Pre-proline 0 C--N 1.328 -0.357 0 C-N-CA 126.029 1.731 . . . . 0.0 110.29 -168.689 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo -72.0 130.87 17.25 Favored 'Trans proline' 0 N--CA 1.454 -0.852 0 C-N-CA 122.013 1.809 . . . . 0.0 110.933 -171.909 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 0.395 0 CA-C-O 122.156 0.979 . . . . 0.0 111.089 -176.551 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 . . . . . 0 C--O 1.239 0.53 0 CA-C-O 120.28 0.086 . . . . 0.0 110.96 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_endo -75.79 -178.07 4.07 Favored 'Trans proline' 0 N--CA 1.455 -0.757 0 C-N-CA 123.571 2.847 . . . . 0.0 110.288 168.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 13.8 t -109.81 87.64 5.83 Favored Pre-proline 0 CA--C 1.544 0.719 0 C-N-CA 126.95 2.1 . . . . 0.0 108.58 -170.38 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 25.1 Cg_endo -77.1 -178.25 4.44 Favored 'Trans proline' 0 CA--C 1.539 0.769 0 C-N-CA 124.552 3.501 . . . . 0.0 111.726 -173.76 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 22.7 t0 -152.5 142.48 22.19 Favored 'General case' 0 N--CA 1.468 0.437 0 O-C-N 121.473 -0.767 . . . . 0.0 110.102 166.417 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 12.5 p -62.65 -19.95 24.02 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.64 0 O-C-N 121.336 -0.853 . . . . 0.0 110.971 174.089 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 17.4 m -59.41 -10.55 3.3 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.804 1.242 . . . . 0.0 113.914 173.276 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.4 t -115.97 9.26 14.85 Favored 'General case' 0 CA--C 1.545 0.767 0 CA-C-N 120.159 1.345 . . . . 0.0 111.199 177.729 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 11.4 m-30 -89.01 167.68 12.97 Favored 'General case' 0 C--O 1.236 0.36 0 O-C-N 120.837 -1.165 . . . . 0.0 111.756 -178.224 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 43.9 mt-30 -98.54 129.69 45.1 Favored 'General case' 0 C--O 1.224 -0.268 0 N-CA-C 107.455 -1.313 . . . . 0.0 107.455 170.652 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 69.2 t80 -73.62 150.25 41.49 Favored 'General case' 0 C--O 1.24 0.577 0 CA-C-N 119.239 0.927 . . . . 0.0 108.742 161.281 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -126.25 93.83 3.92 Favored 'General case' 0 C--O 1.233 0.206 0 N-CA-C 107.513 -1.292 . . . . 0.0 107.513 175.541 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.82 -27.46 51.47 Favored 'General case' 0 N--CA 1.462 0.141 0 C-N-CA 124.864 1.265 . . . . 0.0 112.676 -179.677 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 13.5 t -50.95 -30.67 15.54 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 126.084 1.754 . . . . 0.0 112.385 173.43 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 31.0 m -139.18 -13.11 1.19 Allowed 'General case' 0 CA--C 1.532 0.255 0 N-CA-C 114.004 1.113 . . . . 0.0 114.004 -172.759 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 77.11 39.65 26.79 Favored Glycine 0 CA--C 1.527 0.841 0 CA-C-N 119.623 1.101 . . . . 0.0 111.651 174.181 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 4.8 m-85 -129.0 171.56 12.23 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 126.833 2.053 . . . . 0.0 107.317 170.691 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 84.2 m-85 -102.79 151.35 22.51 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 124.851 1.261 . . . . 0.0 107.717 163.92 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 37.4 t80 -117.59 139.98 50.24 Favored 'General case' 0 N--CA 1.45 -0.446 0 C-N-CA 126.801 2.04 . . . . 0.0 107.977 174.824 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -113.91 84.06 8.29 Favored Pre-proline 0 N--CA 1.439 -1.014 0 C-N-CA 125.705 1.602 . . . . 0.0 108.939 -162.184 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_endo -64.83 -14.42 44.88 Favored 'Trans proline' 0 C--N 1.349 0.587 0 C-N-CA 123.143 2.562 . . . . 0.0 113.176 -176.881 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 26.9 tt0 -69.38 -20.29 63.82 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 126.349 1.859 . . . . 0.0 111.495 -178.786 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -146.69 -33.63 0.3 Allowed 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 125.235 1.414 . . . . 0.0 112.391 -166.732 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 91.98 39.3 5.51 Favored Glycine 0 CA--C 1.527 0.831 0 C-N-CA 125.079 1.323 . . . . 0.0 111.648 -176.89 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 10.0 mt -122.66 -179.2 4.14 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 125.707 1.603 . . . . 0.0 108.012 177.546 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 47.2 m-85 -123.14 154.98 37.91 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 123.447 0.699 . . . . 0.0 109.369 166.61 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 39.7 t80 -124.41 158.38 32.87 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 127.376 2.27 . . . . 0.0 110.195 177.081 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 15.5 t0 -132.42 142.05 43.5 Favored Pre-proline 0 N--CA 1.468 0.461 0 C-N-CA 126.124 1.77 . . . . 0.0 108.253 -179.414 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo -81.1 -30.18 1.74 Allowed 'Trans proline' 0 C--O 1.239 0.572 0 C-N-CA 122.345 2.03 . . . . 0.0 114.18 -174.577 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -76.74 -30.4 56.58 Favored 'General case' 0 N--CA 1.453 -0.309 0 O-C-N 121.141 -0.974 . . . . 0.0 110.833 173.365 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' SER . . . . . 0.408 ' C ' ' H ' ' A' ' 42' ' ' TYR . 48.9 m -136.92 98.08 3.68 Favored 'General case' 0 C--O 1.219 -0.527 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 -168.82 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 26.9 mp0 -56.97 -6.68 0.37 Allowed 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 125.942 1.697 . . . . 0.0 113.782 -178.985 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . 0.408 ' H ' ' C ' ' A' ' 40' ' ' SER . 25.4 m-85 -66.26 103.51 1.01 Allowed 'General case' 0 N--CA 1.446 -0.643 0 C-N-CA 126.049 1.74 . . . . 0.0 107.803 173.549 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 50.2 m-85 -59.56 156.94 12.42 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 125.056 1.342 . . . . 0.0 109.771 178.235 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 66.7 t80 -111.57 112.76 24.71 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 125.169 1.388 . . . . 0.0 108.042 177.579 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 50.3 t30 -84.15 81.41 8.82 Favored 'General case' 0 N--CA 1.446 -0.651 0 C-N-CA 125.875 1.67 . . . . 0.0 109.098 178.096 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -50.21 -30.83 12.36 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 124.82 1.248 . . . . 0.0 112.354 178.425 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -53.65 -36.61 62.27 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 127.182 2.193 . . . . 0.0 113.68 -179.35 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 60.5 m -128.59 -1.0 5.52 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.656 1.182 . . . . 0.0 112.543 -179.505 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 20.6 mt-30 65.7 35.97 6.6 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.799 1.639 . . . . 0.0 110.166 -169.494 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -103.78 170.39 7.95 Favored 'General case' 0 N--CA 1.468 0.451 0 O-C-N 120.435 -1.416 . . . . 0.0 110.822 -175.331 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 4.2 m-85 -117.98 133.02 56.32 Favored 'General case' 0 C--O 1.234 0.245 0 C-N-CA 124.888 1.275 . . . . 0.0 107.898 177.771 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 41.9 mt -132.9 177.84 7.34 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 125.777 1.631 . . . . 0.0 109.135 -175.136 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 32.5 p90 -139.16 153.15 47.89 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 125.457 1.503 . . . . 0.0 108.697 168.611 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 57.2 t-105 -85.71 128.6 34.83 Favored 'General case' 0 C--O 1.233 0.227 0 N-CA-C 106.806 -1.554 . . . . 0.0 106.806 168.927 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 61.8 t0 -121.16 100.01 6.81 Favored 'General case' 0 N--CA 1.446 -0.657 0 N-CA-C 108.444 -0.946 . . . . 0.0 108.444 -174.743 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -71.23 -15.79 74.89 Favored Glycine 0 CA--C 1.526 0.732 0 CA-C-O 118.317 -1.268 . . . . 0.0 112.835 176.95 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -62.99 -43.96 97.35 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 119.615 1.708 . . . . 0.0 107.028 173.389 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 5.6 mtt180 -107.1 -6.44 17.39 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 125.097 1.359 . . . . 0.0 113.288 -170.494 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 86.1 mtt180 43.88 60.81 2.55 Favored 'General case' 0 CA--C 1.52 -0.205 0 C-N-CA 127.989 2.515 . . . . 0.0 109.753 -169.874 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 6.2 t -150.2 172.2 15.71 Favored 'General case' 0 N--CA 1.447 -0.594 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 -179.831 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 74.0 m-85 -104.43 129.16 52.41 Favored 'General case' 0 C--O 1.236 0.363 0 N-CA-C 108.701 -0.852 . . . . 0.0 108.701 166.223 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -126.16 154.98 74.32 Favored Pre-proline 0 C--N 1.327 -0.388 0 C-N-CA 127.272 2.229 . . . . 0.0 108.815 -177.142 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 68.5 Cg_endo -75.39 137.73 21.24 Favored 'Trans proline' 0 N--CA 1.456 -0.691 0 C-N-CA 122.104 1.869 . . . . 0.0 111.726 -176.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.461 0.113 0 C-N-CA 124.847 1.259 . . . . 0.0 111.703 -178.047 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 27.9 m-85 . . . . . 0 CA--C 1.536 0.432 0 CA-C-O 119.646 -0.216 . . . . 0.0 111.52 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -65.67 170.09 11.83 Favored 'Trans proline' 0 CA--C 1.536 0.582 0 C-N-CA 123.819 3.012 . . . . 0.0 109.842 165.313 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 42.4 t -109.23 86.19 3.96 Favored Pre-proline 0 CA--C 1.536 0.428 0 C-N-CA 125.277 1.431 . . . . 0.0 108.539 -170.479 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 42.1 Cg_endo -75.93 166.78 27.44 Favored 'Trans proline' 0 N--CA 1.449 -1.103 0 C-N-CA 121.74 1.627 . . . . 0.0 110.34 -174.366 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 61.5 t0 -142.61 129.38 20.47 Favored 'General case' 0 C--O 1.237 0.412 0 N-CA-C 107.08 -1.452 . . . . 0.0 107.08 173.838 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 12.3 p -53.85 -24.55 10.57 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.352 0 C-N-CA 124.626 1.17 . . . . 0.0 111.995 176.039 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 38.7 t -45.54 -29.54 1.2 Allowed 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.74 1.616 . . . . 0.0 112.389 170.267 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 49.0 p -109.68 2.22 20.03 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 125.149 1.38 . . . . 0.0 112.879 -171.557 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 15.7 m-30 -77.37 175.49 9.72 Favored 'General case' 0 C--O 1.236 0.382 0 O-C-N 121.302 -0.873 . . . . 0.0 110.605 -178.973 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 80.9 mt-30 -116.85 106.59 13.62 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 125.263 1.425 . . . . 0.0 107.473 -176.313 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 49.4 t80 -66.34 147.11 53.78 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.826 -0.435 . . . . 0.0 109.826 176.371 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -135.08 86.0 2.22 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 125.319 1.448 . . . . 0.0 107.203 176.709 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -49.86 -32.22 13.86 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 126.946 2.098 . . . . 0.0 113.635 179.415 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 7.1 t -60.54 -18.65 53.61 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 125.035 1.334 . . . . 0.0 112.503 179.165 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 58.6 m -107.17 -50.3 3.11 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 118.965 0.802 . . . . 0.0 109.582 153.967 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 117.27 9.56 10.38 Favored Glycine 0 CA--C 1.522 0.499 0 C-N-CA 125.452 1.501 . . . . 0.0 112.05 -172.048 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -105.63 168.94 8.77 Favored 'General case' 0 CA--C 1.519 -0.236 0 CA-C-N 118.576 1.188 . . . . 0.0 109.011 -175.443 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 94.8 m-85 -93.33 147.37 22.99 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 107.602 -1.258 . . . . 0.0 107.602 167.884 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 14.9 t80 -111.96 136.11 51.72 Favored 'General case' 0 N--CA 1.442 -0.871 0 C-N-CA 126.35 1.86 . . . . 0.0 107.027 171.57 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -119.69 77.71 21.29 Favored Pre-proline 0 N--CA 1.437 -1.091 0 C-N-CA 125.407 1.483 . . . . 0.0 108.773 -162.874 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 22.6 Cg_endo -62.9 -12.13 27.82 Favored 'Trans proline' 0 C--N 1.348 0.518 0 C-N-CA 122.83 2.354 . . . . 0.0 113.445 -176.861 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 21.0 mm-40 -62.71 -19.92 64.38 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.68 0.792 . . . . 0.0 111.111 174.459 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 5.8 p -141.74 -23.58 0.71 Allowed 'General case' 0 C--O 1.234 0.286 0 N-CA-C 113.834 1.049 . . . . 0.0 113.834 178.569 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 79.03 43.2 11.08 Favored Glycine 0 CA--C 1.531 1.034 0 N-CA-C 109.905 -1.278 . . . . 0.0 109.905 -166.301 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 42.3 mt -111.84 178.55 4.28 Favored 'General case' 0 C--O 1.234 0.282 0 C-N-CA 124.712 1.205 . . . . 0.0 108.175 165.659 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 36.9 m-85 -123.65 154.63 39.09 Favored 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 124.883 1.273 . . . . 0.0 107.605 166.304 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 24.3 t80 -131.02 156.06 45.79 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 125.414 1.485 . . . . 0.0 109.358 -178.217 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -127.22 144.15 49.62 Favored Pre-proline 0 CA--C 1.536 0.436 0 C-N-CA 123.649 0.78 . . . . 0.0 110.359 175.529 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -74.28 -31.75 7.21 Favored 'Trans proline' 0 CA--C 1.535 0.54 0 C-N-CA 122.894 2.396 . . . . 0.0 113.849 -176.758 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 8.5 m-80 -75.38 -29.62 59.91 Favored 'General case' 0 N--CA 1.462 0.144 0 CA-C-N 119.346 0.976 . . . . 0.0 109.925 170.395 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' SER . . . . . 0.416 ' C ' ' H ' ' A' ' 42' ' ' TYR . 0.7 OUTLIER -129.64 89.73 2.88 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 123.881 0.873 . . . . 0.0 109.841 -158.267 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -68.15 9.94 0.27 Allowed 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 124.49 1.116 . . . . 0.0 112.913 -177.627 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . 0.416 ' H ' ' C ' ' A' ' 40' ' ' SER . 56.6 m-85 -81.78 112.77 19.24 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 126.589 1.956 . . . . 0.0 106.947 170.314 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 23.1 m-85 -77.96 124.49 28.07 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 124.255 1.022 . . . . 0.0 111.036 -177.681 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 92.1 t80 -77.2 118.85 20.12 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 125.153 1.381 . . . . 0.0 108.983 178.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 26.4 t30 -90.41 83.96 5.96 Favored 'General case' 0 CA--C 1.512 -0.489 0 C-N-CA 125.432 1.493 . . . . 0.0 109.565 -178.558 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -53.26 -26.03 16.64 Favored 'General case' 0 CA--C 1.538 0.504 0 N-CA-C 114.37 1.248 . . . . 0.0 114.37 -173.734 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -52.67 -66.01 0.46 Allowed 'General case' 0 C--O 1.236 0.343 0 C-N-CA 125.898 1.679 . . . . 0.0 109.084 178.178 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 19.2 m -112.69 22.67 14.3 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 124.922 1.289 . . . . 0.0 111.258 -171.272 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . 0.337 5.3 pt20 44.65 34.14 1.08 Allowed 'General case' 0 CA--C 1.554 1.11 0 C-N-CA 126.72 2.008 . . . . 0.0 113.312 -178.525 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 7.0 mm-40 -97.47 152.69 18.73 Favored 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 126.483 1.913 . . . . 0.0 112.26 178.844 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 3.4 m-30 -95.57 139.72 31.42 Favored 'General case' 0 N--CA 1.47 0.566 0 O-C-N 120.833 -1.167 . . . . 0.0 108.762 172.862 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 41.4 mt -131.33 174.29 10.21 Favored 'General case' 0 N--CA 1.465 0.279 0 C-N-CA 126.749 2.02 . . . . 0.0 110.267 -176.478 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 31.2 p90 -143.53 149.14 37.03 Favored 'General case' 0 C--O 1.238 0.493 0 C-N-CA 124.107 0.963 . . . . 0.0 110.361 168.077 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 50.1 t-105 -93.16 92.6 7.84 Favored 'General case' 0 CA--C 1.516 -0.36 0 N-CA-C 105.075 -2.195 . . . . 0.0 105.075 -176.53 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 43.8 t0 -87.52 96.45 10.4 Favored 'General case' 0 N--CA 1.446 -0.669 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 -177.691 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -59.44 -15.37 31.55 Favored Glycine 0 CA--C 1.53 0.971 0 CA-C-O 118.414 -1.215 . . . . 0.0 112.694 178.754 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 22.7 mt-10 -66.92 -34.84 78.65 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 119.987 1.894 . . . . 0.0 110.1 175.4 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 21.1 mtt180 -109.58 -4.97 15.86 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 125.541 1.536 . . . . 0.0 111.453 -177.05 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 76.1 mtm180 44.21 49.16 7.77 Favored 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 126.374 1.87 . . . . 0.0 110.169 -174.697 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 3.2 t -147.13 178.81 8.09 Favored 'General case' 0 N--CA 1.443 -0.798 0 N-CA-C 108.909 -0.775 . . . . 0.0 108.909 -177.451 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 89.3 m-85 -109.76 131.72 54.8 Favored 'General case' 0 C--O 1.24 0.572 0 N-CA-C 108.146 -1.057 . . . . 0.0 108.146 178.1 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -125.88 154.43 73.56 Favored Pre-proline 0 C--N 1.325 -0.484 0 C-N-CA 125.788 1.635 . . . . 0.0 108.907 176.092 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -75.43 124.03 8.06 Favored 'Trans proline' 0 N--CA 1.453 -0.871 0 C-N-CA 122.562 2.174 . . . . 0.0 111.105 179.497 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.236 0.355 0 CA-C-O 122.531 1.158 . . . . 0.0 109.379 166.674 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 68.6 m-85 . . . . . 0 CA--C 1.537 0.457 0 CA-C-O 119.479 -0.296 . . . . 0.0 111.208 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -71.7 178.47 5.71 Favored 'Trans proline' 0 N--CA 1.459 -0.514 0 C-N-CA 123.964 3.109 . . . . 0.0 110.848 167.498 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 37.1 t -104.6 85.85 1.26 Allowed Pre-proline 0 CA--C 1.541 0.609 0 C-N-CA 127.009 2.123 . . . . 0.0 108.987 -171.494 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_endo -69.91 171.71 14.14 Favored 'Trans proline' 0 C--O 1.237 0.462 0 C-N-CA 123.142 2.561 . . . . 0.0 111.045 179.845 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 14.0 t0 -144.61 139.94 28.41 Favored 'General case' 0 C--O 1.224 -0.238 0 N-CA-C 107.412 -1.329 . . . . 0.0 107.412 178.401 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 6.5 p -65.61 -19.89 26.46 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.599 0 CA-C-N 119.291 0.951 . . . . 0.0 111.22 175.382 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 10.6 t -60.42 -17.83 46.87 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-O 117.334 -1.317 . . . . 0.0 112.092 173.079 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 29.7 p -100.15 -6.13 26.7 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 121.577 1.989 . . . . 0.0 113.028 176.005 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 13.3 m-30 -70.74 173.67 6.96 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 119.531 1.06 . . . . 0.0 112.472 -174.322 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 77.0 mt-30 -114.79 109.28 17.94 Favored 'General case' 0 CA--C 1.528 0.122 0 C-N-CA 126.142 1.777 . . . . 0.0 108.949 176.745 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 81.8 t80 -68.64 142.08 55.2 Favored 'General case' 0 C--O 1.238 0.491 0 CA-C-N 119.343 0.974 . . . . 0.0 110.674 169.708 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 3.6 t0 -119.71 111.42 18.0 Favored 'General case' 0 CA--C 1.504 -0.822 0 N-CA-C 106.686 -1.598 . . . . 0.0 106.686 170.817 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -64.2 -21.94 66.75 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 118.155 -0.926 . . . . 0.0 112.927 178.082 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 1.3 t -61.34 -38.76 88.1 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 118.327 0.512 . . . . 0.0 110.555 -171.82 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 7.8 m -113.36 -19.34 11.77 Favored 'General case' 0 C--O 1.233 0.219 0 C-N-CA 124.703 1.201 . . . . 0.0 111.018 173.87 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 81.46 34.49 25.51 Favored Glycine 0 C--N 1.337 0.599 0 N-CA-C 110.74 -0.944 . . . . 0.0 110.74 174.692 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 4.4 m-85 -119.69 171.05 8.66 Favored 'General case' 0 N--CA 1.463 0.213 0 C-N-CA 126.482 1.913 . . . . 0.0 108.352 178.475 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 67.5 m-85 -103.76 141.01 36.83 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 107.701 -1.222 . . . . 0.0 107.701 171.929 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 52.3 t80 -102.2 136.91 41.21 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 125.868 1.667 . . . . 0.0 106.574 169.91 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 16.7 t0 -97.82 87.45 0.53 Allowed Pre-proline 0 C--N 1.327 -0.387 0 C-N-CA 126.458 1.903 . . . . 0.0 110.332 179.826 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -61.51 -10.54 16.63 Favored 'Trans proline' 0 CA--C 1.537 0.647 0 C-N-CA 121.618 1.546 . . . . 0.0 113.236 176.22 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -80.88 -13.52 58.85 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 124.643 1.177 . . . . 0.0 112.219 -177.784 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 69.8 p -146.48 -23.81 0.43 Allowed 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 113.98 1.104 . . . . 0.0 113.98 168.2 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 108.14 3.27 33.7 Favored Glycine 0 CA--C 1.53 1.009 0 C-N-CA 124.881 1.229 . . . . 0.0 113.936 -179.272 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 39.4 mt -71.38 178.19 3.55 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 125.562 1.545 . . . . 0.0 110.587 173.983 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 54.3 m-85 -116.7 167.19 11.31 Favored 'General case' 0 C--O 1.237 0.424 0 C-N-CA 124.682 1.193 . . . . 0.0 108.333 158.295 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 80.3 t80 -141.4 163.06 33.97 Favored 'General case' 0 C--O 1.237 0.431 0 C-N-CA 126.376 1.87 . . . . 0.0 108.916 176.808 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -133.11 143.9 50.39 Favored Pre-proline 0 CA--C 1.536 0.406 0 C-N-CA 124.189 0.996 . . . . 0.0 110.503 177.971 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -73.71 -38.65 2.27 Favored 'Trans proline' 0 N--CA 1.454 -0.84 0 C-N-CA 123.236 2.624 . . . . 0.0 112.656 -176.017 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 27.0 m-80 -78.13 -35.97 48.38 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-N 119.091 0.86 . . . . 0.0 110.414 -178.272 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 48.8 p -130.86 91.95 3.14 Favored 'General case' 0 C--O 1.223 -0.301 0 N-CA-C 108.379 -0.971 . . . . 0.0 108.379 -159.886 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -60.79 0.17 0.23 Allowed 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 126.311 1.844 . . . . 0.0 115.549 -163.828 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 38.2 m-85 -68.53 123.98 22.33 Favored 'General case' 0 N--CA 1.448 -0.575 0 C-N-CA 125.134 1.374 . . . . 0.0 108.927 174.271 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 25.6 m-85 -75.92 141.64 42.25 Favored 'General case' 0 N--CA 1.448 -0.54 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 175.789 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 56.9 t80 -102.51 115.32 30.34 Favored 'General case' 0 C--N 1.33 -0.242 0 C-N-CA 123.949 0.899 . . . . 0.0 109.288 176.318 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 26.4 t30 -88.29 87.16 7.21 Favored 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 106.992 -1.484 . . . . 0.0 106.992 172.43 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -48.62 -39.6 24.59 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 124.618 1.167 . . . . 0.0 110.112 175.858 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -55.95 -11.34 1.02 Allowed 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 127.673 2.389 . . . . 0.0 116.409 -177.807 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -145.02 6.56 1.16 Allowed 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 119.728 1.149 . . . . 0.0 111.268 160.847 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 50.4 mt-30 64.94 15.78 10.14 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 129.345 3.058 . . . . 0.0 113.273 -168.045 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.92 148.64 49.89 Favored 'General case' 0 N--CA 1.466 0.334 0 O-C-N 121.096 -1.003 . . . . 0.0 111.19 -179.399 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 8.8 m-85 -106.34 132.31 52.53 Favored 'General case' 0 C--O 1.234 0.262 0 N-CA-C 108.165 -1.05 . . . . 0.0 108.165 168.037 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 78.5 mt -135.17 -176.03 4.12 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 127.136 2.174 . . . . 0.0 107.511 -172.741 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 19.6 p90 -146.7 160.24 42.47 Favored 'General case' 0 C--O 1.235 0.316 0 O-C-N 120.758 -1.213 . . . . 0.0 109.527 163.871 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 45.9 t-105 -82.39 105.07 13.15 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 125.15 1.38 . . . . 0.0 108.068 173.104 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 23.1 t0 -89.94 96.86 10.87 Favored 'General case' 0 C--O 1.235 0.339 0 N-CA-C 105.986 -1.857 . . . . 0.0 105.986 170.858 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -76.49 -7.38 85.35 Favored Glycine 0 CA--C 1.531 1.075 0 CA-C-O 118.235 -1.314 . . . . 0.0 112.804 -179.989 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 25.3 mt-10 -73.58 -48.6 31.55 Favored 'General case' 0 C--N 1.341 0.236 0 CA-C-N 119.853 1.827 . . . . 0.0 108.808 172.158 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -81.02 -14.62 57.74 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.631 1.172 . . . . 0.0 112.449 174.01 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.9 mpt_? 46.91 61.42 2.85 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 125.436 1.495 . . . . 0.0 109.913 -164.339 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 5.6 t -150.38 174.85 12.42 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-O 121.543 0.687 . . . . 0.0 109.978 174.059 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 93.6 m-85 -108.63 121.25 44.63 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 125.158 1.383 . . . . 0.0 108.106 179.028 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -125.21 154.31 71.82 Favored Pre-proline 0 C--N 1.324 -0.514 0 C-N-CA 125.403 1.481 . . . . 0.0 110.25 -170.263 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_endo -70.0 126.57 13.3 Favored 'Trans proline' 0 N--CA 1.454 -0.843 0 C-N-CA 122.479 2.119 . . . . 0.0 110.527 178.937 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.332 -0.158 0 N-CA-C 114.235 1.198 . . . . 0.0 114.235 -173.621 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 49.9 m-85 . . . . . 0 CA--C 1.547 0.837 0 N-CA-C 112.579 0.585 . . . . 0.0 112.579 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -69.08 -176.51 1.32 Allowed 'Trans proline' 0 CA--C 1.539 0.742 0 C-N-CA 124.672 3.582 . . . . 0.0 110.699 164.336 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 45.9 t -107.89 86.79 3.26 Favored Pre-proline 0 CA--C 1.541 0.625 0 C-N-CA 125.612 1.565 . . . . 0.0 109.351 -178.881 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 94.3 Cg_endo -67.76 154.81 72.17 Favored 'Trans proline' 0 C--N 1.348 0.523 0 C-N-CA 123.276 2.651 . . . . 0.0 111.772 175.513 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -127.13 129.17 47.41 Favored 'General case' 0 N--CA 1.433 -1.277 0 C-N-CA 126.003 1.721 . . . . 0.0 109.723 -175.254 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 11.8 p -60.03 -24.44 30.02 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 O-C-N 121.776 -0.577 . . . . 0.0 111.41 173.452 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -49.84 -53.73 23.74 Favored 'General case' 0 N--CA 1.438 -1.044 0 C-N-CA 125.818 1.647 . . . . 0.0 112.213 173.507 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 4.4 t -77.91 -4.22 45.71 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-O 117.897 -1.049 . . . . 0.0 112.716 -178.985 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 11.9 m-30 -64.6 156.51 29.75 Favored 'General case' 0 C--O 1.238 0.479 0 CA-C-N 121.412 1.915 . . . . 0.0 111.018 178.888 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 63.0 mt-30 -92.74 121.67 34.37 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 124.332 1.053 . . . . 0.0 108.219 169.148 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 33.8 t80 -63.28 158.67 19.64 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 118.653 0.661 . . . . 0.0 110.639 163.085 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -135.32 108.05 7.49 Favored 'General case' 0 CA--C 1.513 -0.465 0 C-N-CA 123.992 0.917 . . . . 0.0 109.375 160.158 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 1.9 pt-20 -61.34 -25.24 67.01 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 124.636 1.174 . . . . 0.0 112.675 177.912 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 1.4 t -62.73 -50.46 71.0 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 119.388 0.995 . . . . 0.0 109.587 -177.245 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 74.2 m -78.03 -47.76 17.69 Favored 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 124.651 1.18 . . . . 0.0 109.315 173.671 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 102.43 13.51 30.36 Favored Glycine 0 CA--C 1.53 1.027 0 C-N-CA 125.153 1.359 . . . . 0.0 111.004 -168.834 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 3.8 m-85 -111.53 178.28 4.38 Favored 'General case' 0 C--O 1.227 -0.129 0 C-N-CA 126.713 2.005 . . . . 0.0 109.347 -168.635 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 72.1 m-85 -117.13 156.28 27.89 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 108.521 -0.918 . . . . 0.0 108.521 170.889 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 42.3 t80 -114.33 134.95 54.6 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 127.213 2.205 . . . . 0.0 108.78 175.866 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 56.3 t0 -98.56 87.13 0.54 Allowed Pre-proline 0 C--O 1.237 0.404 0 C-N-CA 127.366 2.266 . . . . 0.0 110.381 -178.593 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 61.7 Cg_endo -62.28 -8.55 12.7 Favored 'Trans proline' 0 N--CA 1.457 -0.671 0 C-N-CA 122.085 1.857 . . . . 0.0 114.254 -178.565 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -74.14 -28.2 61.21 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 119.473 1.033 . . . . 0.0 110.703 178.907 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' THR . . . . . 0.446 ' HB ' ' CD2' ' A' ' 34' ' ' LEU . 0.1 OUTLIER -142.35 -22.78 0.68 Allowed 'General case' 0 C--O 1.238 0.48 0 C-N-CA 124.238 1.015 . . . . 0.0 113.317 -164.901 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 103.0 -3.41 48.32 Favored Glycine 0 N--CA 1.444 -0.784 0 C-N-CA 125.091 1.329 . . . . 0.0 112.841 169.593 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.446 ' CD2' ' HB ' ' A' ' 32' ' ' THR . 0.0 OUTLIER -74.86 173.86 10.02 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 118.807 1.304 . . . . 0.0 108.298 -178.721 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 37.2 m-85 -107.14 165.05 11.65 Favored 'General case' 0 C--N 1.321 -0.639 0 C-N-CA 124.389 1.075 . . . . 0.0 108.609 162.509 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 71.2 t80 -144.0 144.69 31.78 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 126.618 1.967 . . . . 0.0 108.092 -172.672 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -113.26 143.08 28.57 Favored Pre-proline 0 C--O 1.236 0.378 0 C-N-CA 124.952 1.301 . . . . 0.0 108.513 175.706 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 91.2 Cg_endo -77.64 -29.33 4.66 Favored 'Trans proline' 0 N--CA 1.456 -0.729 0 C-N-CA 121.917 1.744 . . . . 0.0 112.423 -178.519 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -73.97 -34.6 64.32 Favored 'General case' 0 C--O 1.234 0.279 0 C-N-CA 123.983 0.913 . . . . 0.0 110.734 174.488 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 1.1 m -131.64 93.5 3.34 Favored 'General case' 0 C--O 1.222 -0.381 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 -157.471 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 8.2 mp0 -64.88 6.68 0.21 Allowed 'General case' 0 CA--C 1.549 0.922 0 O-C-N 121.083 -1.011 . . . . 0.0 113.487 -178.013 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 24.3 m-85 -77.13 104.42 7.62 Favored 'General case' 0 C--O 1.235 0.333 0 O-C-N 120.626 -1.296 . . . . 0.0 108.668 166.893 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 29.0 m-85 -64.3 162.89 13.94 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 126.955 2.102 . . . . 0.0 110.784 179.727 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 64.2 t80 -120.25 110.25 16.36 Favored 'General case' 0 CA--C 1.521 -0.143 0 C-N-CA 125.934 1.694 . . . . 0.0 109.038 179.19 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 41.9 t30 -85.29 86.6 7.36 Favored 'General case' 0 C--N 1.32 -0.716 0 C-N-CA 125.082 1.353 . . . . 0.0 109.142 175.985 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -58.37 -15.55 11.07 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 125.401 1.48 . . . . 0.0 114.049 -176.356 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -54.63 -76.5 0.03 OUTLIER 'General case' 0 CA--C 1.528 0.111 0 C-N-CA 125.027 1.331 . . . . 0.0 108.923 170.475 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 10.3 m -94.59 13.69 23.35 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.243 0.617 . . . . 0.0 110.624 -174.342 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 49.4 mt-30 56.28 24.61 8.41 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 127.3 2.24 . . . . 0.0 112.802 -173.049 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -92.75 166.84 12.25 Favored 'General case' 0 CA--C 1.532 0.285 0 O-C-N 121.269 -0.894 . . . . 0.0 111.629 -167.103 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 4.8 m-85 -109.79 138.64 45.87 Favored 'General case' 0 N--CA 1.467 0.401 0 O-C-N 121.4 -0.812 . . . . 0.0 109.117 -179.996 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 32.8 mt -134.48 179.69 6.13 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 124.82 1.248 . . . . 0.0 110.294 -177.172 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 14.1 p90 -145.75 154.35 41.95 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 124.545 1.138 . . . . 0.0 109.113 161.019 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 53.7 t-105 -80.43 120.26 24.21 Favored 'General case' 0 C--O 1.24 0.558 0 N-CA-C 107.181 -1.415 . . . . 0.0 107.181 167.714 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 42.3 t0 -114.76 95.36 5.19 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 123.926 0.89 . . . . 0.0 108.975 174.552 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -66.67 -15.94 64.96 Favored Glycine 0 N--CA 1.444 -0.796 0 CA-C-O 117.492 -1.727 . . . . 0.0 112.564 174.244 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -64.54 -23.83 67.4 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 120.681 2.24 . . . . 0.0 109.551 171.324 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 4.5 mtt-85 -120.11 -2.3 10.22 Favored 'General case' 0 C--O 1.233 0.208 0 C-N-CA 126.062 1.745 . . . . 0.0 112.677 -177.537 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 81.3 mtp180 44.07 50.28 7.38 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 125.643 1.577 . . . . 0.0 110.607 -171.919 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 4.9 t -151.31 174.85 12.81 Favored 'General case' 0 N--CA 1.45 -0.437 0 O-C-N 121.691 -0.631 . . . . 0.0 110.49 179.399 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . 0.406 ' CE2' HG21 ' A' ' 32' ' ' THR . 97.4 m-85 -100.11 135.23 41.84 Favored 'General case' 0 C--O 1.238 0.467 0 N-CA-C 108.547 -0.909 . . . . 0.0 108.547 171.181 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -126.06 153.81 74.02 Favored Pre-proline 0 C--N 1.321 -0.645 0 C-N-CA 125.081 1.353 . . . . 0.0 107.431 -178.86 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 88.2 Cg_endo -84.43 131.28 4.76 Favored 'Trans proline' 0 N--CA 1.457 -0.672 0 C-N-CA 122.257 1.971 . . . . 0.0 109.99 -177.591 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.497 0 N-CA-C 115.87 1.804 . . . . 0.0 115.87 -167.08 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 27.6 m-85 . . . . . 0 CA--C 1.54 0.586 0 N-CA-C 110.163 -0.31 . . . . 0.0 110.163 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -72.19 -173.12 1.01 Allowed 'Trans proline' 0 CA--C 1.534 0.482 0 C-N-CA 124.4 3.4 . . . . 0.0 110.415 166.82 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 61.1 t -113.56 85.66 9.38 Favored Pre-proline 0 CA--C 1.539 0.55 0 N-CA-C 106.204 -1.776 . . . . 0.0 106.204 172.739 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 69.7 Cg_endo -72.86 161.85 42.62 Favored 'Trans proline' 0 CA--C 1.539 0.751 0 C-N-CA 122.399 2.066 . . . . 0.0 110.572 -177.816 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -136.13 137.14 40.69 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 123.773 0.829 . . . . 0.0 110.627 -175.161 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.459 ' HA ' ' CD2' ' A' ' 18' ' ' TYR . 11.9 p -61.2 -22.01 26.21 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.664 0 N-CA-C 112.992 0.738 . . . . 0.0 112.992 179.479 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 3.0 t -68.98 8.35 0.55 Allowed 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 125.145 1.378 . . . . 0.0 112.586 171.748 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.3 t -126.3 4.85 7.02 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 120.598 1.545 . . . . 0.0 111.358 169.174 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . 0.459 ' CD2' ' HA ' ' A' ' 15' ' ' VAL . 16.0 m-30 -82.78 150.49 26.61 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 118.921 0.782 . . . . 0.0 109.719 179.768 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 71.8 mt-30 -95.42 103.92 15.8 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 127.17 2.188 . . . . 0.0 111.035 177.477 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 88.0 t80 -58.12 151.48 18.85 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 120.271 1.396 . . . . 0.0 110.376 -179.991 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -129.61 93.58 3.57 Favored 'General case' 0 CA--C 1.516 -0.354 0 N-CA-C 106.091 -1.818 . . . . 0.0 106.091 177.345 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 1.9 pt-20 -51.99 -33.09 36.52 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-O 118.528 -0.748 . . . . 0.0 112.291 176.487 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 1.3 t -68.82 -5.68 22.32 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 123.297 0.639 . . . . 0.0 111.645 -174.408 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 50.7 m -137.1 -12.91 1.64 Allowed 'General case' 0 CA--C 1.53 0.204 0 O-C-N 120.185 -1.572 . . . . 0.0 112.463 167.874 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 88.39 18.77 54.59 Favored Glycine 0 C--N 1.338 0.64 0 CA-C-N 118.983 0.81 . . . . 0.0 112.124 169.936 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 7.1 m-85 -125.04 175.16 7.53 Favored 'General case' 0 C--N 1.332 -0.195 0 C-N-CA 126.88 2.072 . . . . 0.0 108.122 -171.725 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 58.8 m-85 -99.26 135.35 40.8 Favored 'General case' 0 N--CA 1.448 -0.529 0 N-CA-C 106.892 -1.522 . . . . 0.0 106.892 176.114 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 25.3 t80 -99.41 141.24 32.46 Favored 'General case' 0 C--O 1.238 0.472 0 N-CA-C 107.047 -1.464 . . . . 0.0 107.047 168.026 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 29.5 m-20 -118.45 76.44 12.96 Favored Pre-proline 0 CA--C 1.535 0.389 0 N-CA-C 108.935 -0.765 . . . . 0.0 108.935 -159.088 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -65.05 -10.64 26.36 Favored 'Trans proline' 0 CA--C 1.534 0.486 0 C-N-CA 124.326 3.35 . . . . 0.0 114.722 -167.644 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 33.7 tt0 -76.58 -25.73 54.29 Favored 'General case' 0 CA--C 1.537 0.474 0 O-C-N 121.504 -0.747 . . . . 0.0 110.979 175.985 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -136.34 -26.32 1.13 Allowed 'General case' 0 C--O 1.234 0.278 0 C-N-CA 124.215 1.006 . . . . 0.0 112.495 -165.642 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 108.12 -3.77 33.5 Favored Glycine 0 CA--C 1.527 0.811 0 C-N-CA 124.069 0.843 . . . . 0.0 115.074 169.924 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -84.36 -177.11 6.54 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 126.591 1.957 . . . . 0.0 109.975 -172.739 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 25.0 m-85 -115.95 139.04 50.63 Favored 'General case' 0 C--O 1.238 0.459 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 155.569 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 62.4 t80 -104.25 154.43 19.79 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 125.426 1.49 . . . . 0.0 108.246 178.911 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 37.0 t70 -127.4 143.57 47.76 Favored Pre-proline 0 N--CA 1.467 0.388 0 N-CA-C 112.157 0.428 . . . . 0.0 112.157 167.184 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -67.61 -31.01 34.16 Favored 'Trans proline' 0 N--CA 1.455 -0.771 0 C-N-CA 122.953 2.435 . . . . 0.0 114.205 -179.555 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 4.2 m-80 -87.19 -17.57 32.36 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 119.58 1.082 . . . . 0.0 111.626 172.692 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' SER . . . . . 0.452 ' C ' ' H ' ' A' ' 42' ' ' TYR . 0.7 OUTLIER -138.85 81.57 1.85 Allowed 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 -162.52 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -60.5 5.91 0.04 OUTLIER 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.146 1.378 . . . . 0.0 113.709 177.171 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . 0.452 ' H ' ' C ' ' A' ' 40' ' ' SER . 24.3 m-85 -75.64 93.56 3.08 Favored 'General case' 0 N--CA 1.444 -0.74 0 C-N-CA 125.302 1.441 . . . . 0.0 107.766 171.598 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 43.8 m-85 -58.54 123.97 18.07 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 124.378 1.071 . . . . 0.0 108.675 -179.74 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 8.0 t80 -86.22 108.22 18.27 Favored 'General case' 0 N--CA 1.447 -0.609 0 C-N-CA 125.243 1.417 . . . . 0.0 107.219 -176.65 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 33.6 t30 -82.62 79.42 9.04 Favored 'General case' 0 N--CA 1.446 -0.655 0 N-CA-C 107.997 -1.112 . . . . 0.0 107.997 171.326 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -53.28 -33.12 51.92 Favored 'General case' 0 C--N 1.341 0.213 0 C-N-CA 123.553 0.741 . . . . 0.0 112.129 -178.783 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -44.3 -62.23 1.24 Allowed 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 128.261 2.625 . . . . 0.0 109.904 177.379 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.1 t -106.97 11.22 30.05 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.634 1.173 . . . . 0.0 110.578 -175.233 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 34.0 mt-30 46.98 40.81 9.98 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 127.011 2.125 . . . . 0.0 110.67 -176.433 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 17.4 mm-40 -103.95 159.73 15.41 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 126.238 1.815 . . . . 0.0 109.017 174.66 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -112.09 129.42 56.23 Favored 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 106.679 -1.6 . . . . 0.0 106.679 170.987 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 50.8 mt -118.4 177.51 4.79 Favored 'General case' 0 N--CA 1.442 -0.875 0 C-N-CA 126.124 1.769 . . . . 0.0 107.352 -179.748 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 14.0 p90 -141.71 154.2 45.15 Favored 'General case' 0 N--CA 1.441 -0.889 0 N-CA-C 106.786 -1.561 . . . . 0.0 106.786 158.751 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 20.3 t-105 -76.22 136.78 39.71 Favored 'General case' 0 N--CA 1.445 -0.687 0 N-CA-C 106.195 -1.78 . . . . 0.0 106.195 169.453 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 6.6 t0 -131.92 99.43 4.75 Favored 'General case' 0 CA--C 1.507 -0.695 0 CA-C-O 122.442 1.115 . . . . 0.0 109.719 175.102 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -65.89 -8.26 40.6 Favored Glycine 0 N--CA 1.442 -0.913 0 CA-C-O 117.256 -1.858 . . . . 0.0 113.221 -174.449 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . 0.507 ' HG3' ' H ' ' A' ' 58' ' ' ARG . 1.8 pt-20 -72.67 -64.82 0.88 Allowed 'General case' 0 C--N 1.338 0.108 0 CA-C-N 120.363 2.082 . . . . 0.0 107.47 177.342 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . 0.507 ' H ' ' HG3' ' A' ' 57' ' ' GLU . 82.3 mtt180 -74.85 -7.12 52.5 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 125.181 1.392 . . . . 0.0 111.817 179.059 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 90.5 mtt180 44.79 56.25 5.39 Favored 'General case' 0 C--O 1.231 0.128 0 C-N-CA 126.51 1.924 . . . . 0.0 110.55 -172.595 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 7.4 t -146.62 164.0 34.05 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 109.217 -0.66 . . . . 0.0 109.217 167.781 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 27.4 m-85 -81.66 135.93 35.52 Favored 'General case' 0 C--O 1.237 0.426 0 N-CA-C 107.216 -1.402 . . . . 0.0 107.216 166.877 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -126.01 154.77 73.93 Favored Pre-proline 0 C--N 1.323 -0.587 0 C-N-CA 125.806 1.642 . . . . 0.0 108.863 176.585 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -67.98 135.67 35.75 Favored 'Trans proline' 0 N--CA 1.451 -1.012 0 C-N-CA 121.949 1.766 . . . . 0.0 109.715 171.791 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.463 0.187 0 C-N-CA 124.154 0.982 . . . . 0.0 112.698 -178.316 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 51.7 m-85 . . . . . 0 C--O 1.239 0.514 0 N-CA-C 109.43 -0.581 . . . . 0.0 109.43 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -70.62 -175.12 1.25 Allowed 'Trans proline' 0 CA--C 1.537 0.646 0 C-N-CA 124.489 3.459 . . . . 0.0 111.239 167.277 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 38.8 t -104.97 88.12 2.21 Favored Pre-proline 0 CA--C 1.543 0.709 0 C-N-CA 125.991 1.717 . . . . 0.0 109.478 -178.744 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 19.8 Cg_endo -70.55 173.66 11.35 Favored 'Trans proline' 0 CA--C 1.546 1.079 0 C-N-CA 123.087 2.525 . . . . 0.0 110.856 173.549 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -156.62 133.61 10.4 Favored 'General case' 0 N--CA 1.468 0.439 0 O-C-N 121.272 -0.893 . . . . 0.0 110.053 171.932 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.439 ' HA ' ' CD2' ' A' ' 18' ' ' TYR . 12.5 p -54.24 -25.14 12.97 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.42 0 N-CA-C 113.604 0.964 . . . . 0.0 113.604 177.928 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 14.0 m -62.02 -14.07 32.08 Favored 'General case' 0 C--O 1.237 0.406 0 O-C-N 120.943 -1.098 . . . . 0.0 112.96 179.987 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 5.5 t -120.55 9.94 10.98 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 124.012 0.925 . . . . 0.0 111.85 176.187 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . 0.439 ' CD2' ' HA ' ' A' ' 15' ' ' VAL . 17.0 m-30 -73.4 152.6 40.76 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-N 119.708 1.14 . . . . 0.0 109.719 168.858 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 51.6 mt-30 -87.38 115.58 24.9 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 108.529 -0.915 . . . . 0.0 108.529 174.236 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 85.4 t80 -66.32 147.89 52.65 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 118.224 0.465 . . . . 0.0 110.233 168.693 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -119.13 112.58 19.7 Favored 'General case' 0 N--CA 1.442 -0.871 0 C-N-CA 127.681 2.393 . . . . 0.0 106.517 177.829 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -81.6 -15.85 53.39 Favored 'General case' 0 CA--C 1.533 0.314 0 O-C-N 121.396 -0.815 . . . . 0.0 113.087 178.178 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 5.2 t -67.09 -31.77 72.49 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.533 1.133 . . . . 0.0 111.335 179.619 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 69.2 m -128.26 -26.16 2.86 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 119.883 1.22 . . . . 0.0 112.889 171.386 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 104.24 25.3 7.12 Favored Glycine 0 CA--C 1.527 0.806 0 CA-C-O 117.889 -1.506 . . . . 0.0 113.674 172.651 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 2.7 m-85 -110.91 -179.58 3.78 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 120.206 2.003 . . . . 0.0 108.821 -179.84 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 68.2 m-85 -120.88 123.35 42.33 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 124.636 1.174 . . . . 0.0 108.239 178.055 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 23.5 t80 -91.14 134.77 34.26 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 125.571 1.548 . . . . 0.0 110.76 -179.642 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 12.6 t0 -101.11 88.06 0.99 Allowed Pre-proline 0 CA--C 1.533 0.319 0 C-N-CA 128.034 2.534 . . . . 0.0 112.429 178.543 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -64.81 -6.84 13.33 Favored 'Trans proline' 0 CA--C 1.533 0.47 0 C-N-CA 121.656 1.571 . . . . 0.0 115.332 172.002 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 3.3 tm0? -64.92 -52.03 58.66 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 119.852 1.206 . . . . 0.0 108.297 176.032 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 77.7 p -99.97 -51.96 3.56 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-N 118.295 0.498 . . . . 0.0 111.081 174.461 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 125.98 5.82 6.13 Favored Glycine 0 CA--C 1.535 1.341 0 C-N-CA 126.818 2.151 . . . . 0.0 112.135 -166.257 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 84.5 mt -74.21 174.36 8.86 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 119.126 1.463 . . . . 0.0 110.935 176.476 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 27.0 m-85 -120.38 169.77 9.99 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 125.902 1.681 . . . . 0.0 108.294 161.604 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 28.3 t80 -145.52 153.57 41.26 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 128.913 2.885 . . . . 0.0 107.67 -174.935 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 8.9 t0 -121.32 142.51 35.42 Favored Pre-proline 0 CA--C 1.532 0.267 0 C-N-CA 124.968 1.307 . . . . 0.0 107.89 179.419 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -74.74 -32.95 5.37 Favored 'Trans proline' 0 N--CA 1.453 -0.887 0 C-N-CA 121.635 1.557 . . . . 0.0 115.279 -174.101 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -73.32 -35.6 66.08 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 120.508 1.503 . . . . 0.0 108.45 172.072 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' SER . . . . . 0.446 ' C ' ' H ' ' A' ' 42' ' ' TYR . 69.4 m -126.43 93.52 3.82 Favored 'General case' 0 N--CA 1.449 -0.494 0 C-N-CA 123.493 0.717 . . . . 0.0 110.246 -157.349 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 25.6 mp0 -55.72 -0.92 0.04 OUTLIER 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 127.34 2.256 . . . . 0.0 114.597 179.531 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . 0.446 ' H ' ' C ' ' A' ' 40' ' ' SER . 49.3 m-85 -70.9 106.19 3.53 Favored 'General case' 0 N--CA 1.442 -0.839 0 C-N-CA 125.595 1.558 . . . . 0.0 108.194 170.351 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 40.7 m-85 -65.75 153.82 40.72 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 125.613 1.565 . . . . 0.0 109.972 179.01 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 74.9 t80 -108.58 133.95 52.01 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 125.668 1.587 . . . . 0.0 107.983 175.41 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 43.1 t30 -110.8 73.9 0.85 Allowed 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 128.944 2.898 . . . . 0.0 109.619 -173.305 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -49.53 -26.4 3.44 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 125.651 1.58 . . . . 0.0 114.036 -172.014 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 3.1 tt0 -53.95 -31.18 49.62 Favored 'General case' 0 N--CA 1.446 -0.656 0 C-N-CA 128.989 2.915 . . . . 0.0 113.315 174.858 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 4.1 m -143.9 9.6 1.52 Allowed 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 124.894 1.277 . . . . 0.0 111.479 -168.537 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 52.0 mt-30 47.39 30.43 1.57 Allowed 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 126.415 1.886 . . . . 0.0 113.623 -173.907 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -104.22 161.48 14.0 Favored 'General case' 0 C--O 1.233 0.213 0 C-N-CA 125.083 1.353 . . . . 0.0 112.653 -175.995 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -103.26 134.86 45.95 Favored 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 124.7 1.2 . . . . 0.0 110.783 178.336 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 53.8 mt -133.34 179.8 5.98 Favored 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 125.943 1.697 . . . . 0.0 109.193 -177.091 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 14.1 p90 -148.52 155.21 40.85 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 125.103 1.361 . . . . 0.0 108.684 164.518 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 68.9 t-105 -77.42 119.29 20.83 Favored 'General case' 0 C--O 1.233 0.232 0 N-CA-C 107.333 -1.358 . . . . 0.0 107.333 167.878 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 39.7 t0 -98.68 94.44 6.64 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 107.88 -1.155 . . . . 0.0 107.88 167.505 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -62.7 -14.98 53.27 Favored Glycine 0 CA--C 1.531 1.091 0 CA-C-O 119.081 -0.844 . . . . 0.0 113.394 178.13 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -74.6 -17.29 60.74 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 119.228 1.514 . . . . 0.0 110.667 174.941 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 83.9 mtt85 -123.34 -4.49 8.35 Favored 'General case' 0 C--O 1.223 -0.299 0 C-N-CA 125.342 1.457 . . . . 0.0 111.799 178.711 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 97.2 mtt180 44.34 59.36 3.31 Favored 'General case' 0 C--O 1.233 0.209 0 C-N-CA 125.389 1.476 . . . . 0.0 110.335 -173.096 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 5.8 t -152.95 173.67 15.1 Favored 'General case' 0 N--CA 1.448 -0.551 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 177.681 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 82.2 m-85 -104.96 134.34 48.23 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 107.624 -1.25 . . . . 0.0 107.624 173.185 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -126.12 154.6 74.21 Favored Pre-proline 0 C--N 1.324 -0.527 0 C-N-CA 125.327 1.451 . . . . 0.0 109.492 -178.223 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -74.16 125.68 9.95 Favored 'Trans proline' 0 N--CA 1.458 -0.581 0 C-N-CA 123.413 2.742 . . . . 0.0 111.08 -178.916 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.463 0.187 0 N-CA-C 114.607 1.336 . . . . 0.0 114.607 -173.25 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 82.0 m-85 . . . . . 0 CA--C 1.543 0.706 0 CA-C-O 119.572 -0.251 . . . . 0.0 110.865 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_endo -72.71 -167.44 0.34 Allowed 'Trans proline' 0 CA--C 1.536 0.578 0 C-N-CA 123.991 3.128 . . . . 0.0 109.891 166.255 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 43.2 t -106.99 86.5 2.43 Favored Pre-proline 0 CA--C 1.541 0.634 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 174.016 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 91.8 Cg_endo -65.08 164.6 24.51 Favored 'Trans proline' 0 CA--C 1.536 0.604 0 C-N-CA 123.577 2.852 . . . . 0.0 110.252 178.205 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -152.94 142.97 22.28 Favored 'General case' 0 N--CA 1.475 0.776 0 O-C-N 120.608 -1.307 . . . . 0.0 113.236 -179.64 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 14.4 p -60.13 -19.82 18.75 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.287 0 C-N-CA 124.906 1.282 . . . . 0.0 112.885 171.494 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.4 t -57.59 -5.59 0.38 Allowed 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 124.632 1.173 . . . . 0.0 113.079 170.267 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.4 t -137.11 12.67 3.07 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-N 119.617 1.099 . . . . 0.0 113.74 176.468 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 16.4 m-30 -72.42 164.18 26.78 Favored 'General case' 0 C--O 1.236 0.363 0 O-C-N 120.476 -1.39 . . . . 0.0 111.295 175.028 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 19.2 mt-30 -108.08 129.22 55.16 Favored 'General case' 0 CA--C 1.519 -0.217 0 C-N-CA 125.179 1.392 . . . . 0.0 108.794 169.726 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 49.8 t80 -77.94 150.71 33.97 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 118.357 0.526 . . . . 0.0 110.073 170.017 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -128.58 88.08 2.68 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 107.504 -1.295 . . . . 0.0 107.504 173.846 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.7 pt-20 -52.77 -19.89 2.8 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 127.831 2.452 . . . . 0.0 113.589 175.057 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 6.7 t -51.33 -36.72 44.15 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 124.137 0.975 . . . . 0.0 111.413 168.344 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 54.3 m -138.61 -8.07 1.46 Allowed 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 124.7 1.2 . . . . 0.0 113.834 -178.05 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 88.47 19.96 50.2 Favored Glycine 0 CA--C 1.528 0.859 0 O-C-N 120.198 -1.564 . . . . 0.0 113.723 167.798 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 32.7 m-85 -110.37 174.88 5.65 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 125.673 1.589 . . . . 0.0 109.381 -179.025 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 83.8 m-85 -120.56 151.45 39.4 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 124.675 1.19 . . . . 0.0 109.098 177.117 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 55.3 t80 -125.6 137.08 53.88 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 125.412 1.485 . . . . 0.0 110.715 -175.511 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -97.75 88.74 0.65 Allowed Pre-proline 0 N--CA 1.463 0.182 0 C-N-CA 128.088 2.555 . . . . 0.0 112.418 -179.817 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo -58.09 -10.51 8.2 Favored 'Trans proline' 0 CA--C 1.536 0.614 0 CA-C-N 121.19 1.461 . . . . 0.0 115.012 175.265 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -66.81 -41.55 87.38 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 120.058 1.299 . . . . 0.0 109.786 176.295 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 22.4 p -137.34 -11.09 1.66 Allowed 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 116.156 1.909 . . . . 0.0 116.156 -173.819 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 95.14 6.68 60.04 Favored Glycine 0 CA--C 1.528 0.904 0 O-C-N 121.21 -0.931 . . . . 0.0 113.329 171.921 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 15.2 mt -82.1 163.15 22.21 Favored 'General case' 0 C--O 1.237 0.426 0 CA-C-N 118.169 0.985 . . . . 0.0 109.196 174.901 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 57.6 m-85 -108.9 157.44 18.62 Favored 'General case' 0 C--O 1.234 0.274 0 C-N-CA 123.141 0.576 . . . . 0.0 109.954 171.07 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 56.0 t80 -127.93 151.37 49.19 Favored 'General case' 0 C--O 1.238 0.448 0 C-N-CA 128.918 2.887 . . . . 0.0 107.865 -178.995 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -130.14 144.02 51.47 Favored Pre-proline 0 C--N 1.331 -0.213 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 173.345 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -64.99 -24.43 60.28 Favored 'Trans proline' 0 N--CA 1.455 -0.769 0 C-N-CA 122.539 2.159 . . . . 0.0 114.038 -175.427 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 17.7 m-80 -104.07 -19.04 14.31 Favored 'General case' 0 C--O 1.237 0.417 0 C-N-CA 123.721 0.808 . . . . 0.0 112.002 176.527 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 33.6 t -120.77 84.52 2.24 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 125.278 1.431 . . . . 0.0 109.163 177.63 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 24.9 mp0 -58.61 -8.16 1.18 Allowed 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 124.459 1.104 . . . . 0.0 111.657 162.443 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 26.8 m-85 -70.3 99.56 1.57 Allowed 'General case' 0 N--CA 1.45 -0.452 0 N-CA-C 107.357 -1.349 . . . . 0.0 107.357 164.732 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 54.3 m-85 -59.92 146.4 42.43 Favored 'General case' 0 C--O 1.237 0.432 0 C-N-CA 125.877 1.671 . . . . 0.0 109.974 -174.722 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 73.9 t80 -96.81 118.77 33.97 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-O 122.417 1.103 . . . . 0.0 109.748 173.634 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . 0.598 HD21 ' HG2' ' A' ' 50' ' ' GLN . 17.2 t30 -88.07 79.57 7.92 Favored 'General case' 0 N--CA 1.443 -0.806 0 C-N-CA 127.108 2.163 . . . . 0.0 107.557 -179.273 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -53.64 -32.65 52.29 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 123.684 0.794 . . . . 0.0 111.034 177.652 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.7 tt0 -51.01 -28.09 9.26 Favored 'General case' 0 N--CA 1.449 -0.496 0 C-N-CA 127.454 2.302 . . . . 0.0 114.365 -176.8 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -144.95 4.75 1.12 Allowed 'General case' 0 CA--C 1.535 0.39 0 N-CA-C 112.697 0.629 . . . . 0.0 112.697 174.692 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 26.8 mt-30 68.16 60.68 0.41 Allowed 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 125.968 1.707 . . . . 0.0 109.997 -177.461 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.598 ' HG2' HD21 ' A' ' 45' ' ' ASN . 0.0 OUTLIER -124.89 168.18 13.64 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 125.929 1.692 . . . . 0.0 114.871 174.715 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 4.4 m-85 -107.14 149.82 27.25 Favored 'General case' 0 C--O 1.233 0.202 0 N-CA-C 107.898 -1.149 . . . . 0.0 107.898 162.246 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 90.9 mt -145.99 -176.78 5.28 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 127.279 2.232 . . . . 0.0 107.025 -178.607 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 4.4 p90 -127.68 179.81 5.33 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 125.165 1.386 . . . . 0.0 108.278 162.726 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 27.5 t-105 -105.08 135.71 45.91 Favored 'General case' 0 C--O 1.238 0.499 0 N-CA-C 105.055 -2.202 . . . . 0.0 105.055 160.685 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -124.01 115.97 22.08 Favored 'General case' 0 N--CA 1.446 -0.628 0 C-N-CA 124.742 1.217 . . . . 0.0 108.013 177.886 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -77.27 -15.93 81.04 Favored Glycine 0 N--CA 1.445 -0.758 0 CA-C-O 117.407 -1.774 . . . . 0.0 112.361 177.316 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -65.7 -47.85 74.0 Favored 'General case' 0 C--N 1.345 0.388 0 CA-C-N 121.308 2.554 . . . . 0.0 108.241 -177.167 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 5.4 mtt85 -102.19 5.0 39.98 Favored 'General case' 0 CA--C 1.529 0.149 0 C-N-CA 125.805 1.642 . . . . 0.0 111.293 -179.051 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 3.2 mtt180 44.78 60.34 2.97 Favored 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 126.601 1.96 . . . . 0.0 109.798 -178.174 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 5.5 t -149.85 173.05 14.19 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-O 121.763 0.792 . . . . 0.0 110.193 -168.551 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 82.2 m-85 -113.74 116.39 29.33 Favored 'General case' 0 C--O 1.234 0.283 0 C-N-CA 124.906 1.283 . . . . 0.0 108.246 172.802 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -125.58 158.98 62.86 Favored Pre-proline 0 C--N 1.327 -0.382 0 C-N-CA 126.831 2.052 . . . . 0.0 110.409 -168.941 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -72.89 124.14 9.44 Favored 'Trans proline' 0 N--CA 1.458 -0.602 0 C-N-CA 122.931 2.421 . . . . 0.0 111.924 -175.986 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.245 0 C-N-CA 123.737 0.815 . . . . 0.0 112.713 179.855 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.463 0.452 0 N-CA-C 109.824 -1.31 . . . . 0.0 109.824 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 2.8 p-80 -144.8 4.38 1.13 Allowed 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 125.011 1.324 . . . . 0.0 111.792 -175.571 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 6.5 mtm -117.34 175.62 5.53 Favored 'General case' 0 C--O 1.234 0.244 0 C-N-CA 125.101 1.36 . . . . 0.0 108.939 174.572 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 36.6 tt0 46.79 81.61 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 127.521 2.329 . . . . 0.0 111.767 -171.038 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 8.1 tt0 -70.07 -17.82 63.25 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-O 118.079 -0.963 . . . . 0.0 112.702 175.525 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 73.2 m 59.3 93.21 0.04 OUTLIER 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.816 1.247 . . . . 0.0 113.277 172.063 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 25.7 p90 -118.56 -169.07 1.65 Allowed 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 126.084 1.754 . . . . 0.0 109.965 -175.056 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 46.4 m 58.87 76.4 0.35 Allowed 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 125.445 1.498 . . . . 0.0 113.019 177.525 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -142.41 -171.25 3.36 Favored 'General case' 0 N--CA 1.445 -0.687 0 C-N-CA 125.425 1.49 . . . . 0.0 110.442 -178.795 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 17.7 m-85 -111.71 166.7 10.35 Favored Pre-proline 0 CA--C 1.54 0.59 0 C-N-CA 127.558 2.343 . . . . 0.0 108.919 -176.138 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 96.2 Cg_endo -65.36 -176.06 0.48 Allowed 'Trans proline' 0 CA--C 1.537 0.644 0 C-N-CA 123.623 2.882 . . . . 0.0 111.594 169.404 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 48.8 t -113.95 85.82 10.4 Favored Pre-proline 0 CA--C 1.541 0.609 0 N-CA-C 106.987 -1.486 . . . . 0.0 106.987 178.09 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -67.0 175.53 5.47 Favored 'Trans proline' 0 C--N 1.35 0.614 0 C-N-CA 123.39 2.726 . . . . 0.0 112.121 -176.881 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 63.3 t0 -142.46 125.23 15.99 Favored 'General case' 0 C--O 1.237 0.445 0 N-CA-C 105.154 -2.165 . . . . 0.0 105.154 166.429 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 5.3 p -55.33 -23.05 13.0 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.433 0 C-N-CA 123.816 0.846 . . . . 0.0 111.499 175.531 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 31.6 t -67.65 2.29 1.96 Allowed 'General case' 0 CA--C 1.54 0.573 0 O-C-N 120.895 -1.128 . . . . 0.0 112.248 175.565 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 47.3 p -114.65 3.22 14.72 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 125.272 1.429 . . . . 0.0 110.878 174.608 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 14.7 m-30 -85.57 175.79 8.58 Favored 'General case' 0 C--O 1.236 0.391 0 O-C-N 121.03 -1.044 . . . . 0.0 109.579 -179.362 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 15.7 mt-30 -120.14 114.27 21.7 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 124.271 1.029 . . . . 0.0 110.119 -178.348 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 69.0 t80 -72.79 135.74 45.31 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 123.344 0.658 . . . . 0.0 110.407 175.116 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -118.98 75.81 1.06 Allowed 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 125.421 1.488 . . . . 0.0 108.649 -173.543 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -56.52 -19.49 15.82 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 125.343 1.457 . . . . 0.0 114.662 -167.528 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 1.3 t -54.67 -30.76 56.32 Favored 'General case' 0 CA--C 1.554 1.111 0 C-N-CA 124.705 1.202 . . . . 0.0 110.234 170.427 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 47.1 m -132.12 -16.94 2.77 Favored 'General case' 0 C--N 1.346 0.439 0 N-CA-C 115.61 1.707 . . . . 0.0 115.61 -178.854 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 99.78 2.39 56.25 Favored Glycine 0 CA--C 1.535 1.326 0 CA-C-N 120.865 1.666 . . . . 0.0 114.297 172.223 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 80.4 m-85 -95.32 169.3 10.17 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 125.106 1.363 . . . . 0.0 110.657 178.083 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 71.3 m-85 -102.09 151.91 21.6 Favored 'General case' 0 N--CA 1.453 -0.319 0 N-CA-C 106.335 -1.728 . . . . 0.0 106.335 160.411 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 40.6 t80 -115.68 140.4 49.23 Favored 'General case' 0 C--O 1.241 0.625 0 C-N-CA 125.926 1.69 . . . . 0.0 107.457 175.525 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -121.96 76.34 39.65 Favored Pre-proline 0 N--CA 1.444 -0.763 0 N-CA-C 106.636 -1.616 . . . . 0.0 106.636 -158.561 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 27.2 Cg_endo -60.9 -19.49 62.53 Favored 'Trans proline' 0 CA--C 1.537 0.665 0 C-N-CA 122.415 2.077 . . . . 0.0 114.353 -168.536 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 14.8 tt0 -68.09 -22.79 64.9 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.539 1.135 . . . . 0.0 111.33 178.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -116.13 -58.21 2.12 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 127.725 2.41 . . . . 0.0 107.091 -178.309 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 113.88 -7.59 23.71 Favored Glycine 0 CA--C 1.53 1.005 0 C-N-CA 127.443 2.449 . . . . 0.0 110.861 -169.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -59.5 168.71 1.49 Allowed 'General case' 0 N--CA 1.434 -1.237 0 C-N-CA 129.118 2.967 . . . . 0.0 111.086 170.95 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 63.4 m-85 -116.1 140.46 49.26 Favored 'General case' 0 C--O 1.238 0.478 0 CA-C-N 114.45 -1.25 . . . . 0.0 108.658 158.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 58.6 t80 -105.41 153.9 21.04 Favored 'General case' 0 C--N 1.325 -0.493 0 C-N-CA 125.387 1.475 . . . . 0.0 108.093 171.345 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 6.9 t0 -119.76 142.77 33.64 Favored Pre-proline 0 C--N 1.329 -0.31 0 N-CA-C 105.898 -1.89 . . . . 0.0 105.898 171.255 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -73.48 -28.68 11.84 Favored 'Trans proline' 0 N--CA 1.455 -0.779 0 C-N-CA 121.369 1.38 . . . . 0.0 113.01 -174.35 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 52.3 m-80 -95.24 -25.41 16.37 Favored 'General case' 0 N--CA 1.448 -0.528 0 C-N-CA 125.986 1.714 . . . . 0.0 110.467 -177.603 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 4.1 m -121.03 95.65 4.78 Favored 'General case' 0 C--O 1.223 -0.317 0 C-N-CA 124.536 1.135 . . . . 0.0 108.733 -178.654 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 20.7 mp0 -64.06 1.15 0.74 Allowed 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 125.665 1.586 . . . . 0.0 114.121 179.417 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 26.4 m-85 -77.29 109.04 10.86 Favored 'General case' 0 C--O 1.234 0.26 0 C-N-CA 126.024 1.73 . . . . 0.0 108.97 169.657 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 18.8 m-85 -67.23 157.38 33.97 Favored 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 125.472 1.509 . . . . 0.0 109.442 179.872 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . 0.427 ' CZ ' ' HA ' ' A' ' 46' ' ' ALA . 7.8 t80 -118.86 105.17 11.24 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 125.443 1.497 . . . . 0.0 107.885 178.875 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 30.1 t30 -79.25 92.18 5.09 Favored 'General case' 0 N--CA 1.445 -0.7 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 168.152 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . 0.427 ' HA ' ' CZ ' ' A' ' 44' ' ' TYR . . . -56.54 -35.18 67.81 Favored 'General case' 0 N--CA 1.456 -0.144 0 C-N-CA 124.046 0.938 . . . . 0.0 112.482 179.743 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -45.76 -55.78 6.11 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 126.157 1.783 . . . . 0.0 111.606 -176.941 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.9 m -109.99 -1.84 17.42 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 123.736 0.814 . . . . 0.0 111.36 -172.827 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 40.9 mt-30 50.46 60.59 3.74 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 126.302 1.841 . . . . 0.0 109.442 -163.741 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -106.85 149.29 27.57 Favored 'General case' 0 C--O 1.233 0.198 0 N-CA-C 107.992 -1.114 . . . . 0.0 107.992 167.237 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 3.8 m-85 -104.79 131.03 52.75 Favored 'General case' 0 CA--C 1.515 -0.397 0 N-CA-C 105.475 -2.046 . . . . 0.0 105.475 168.498 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 49.9 mt -127.08 177.89 6.36 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 125.521 1.528 . . . . 0.0 108.164 -171.709 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 26.1 p90 -142.94 156.3 44.86 Favored 'General case' 0 N--CA 1.447 -0.618 0 N-CA-C 108.845 -0.798 . . . . 0.0 108.845 160.89 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 26.6 t-105 -82.52 118.95 23.63 Favored 'General case' 0 N--CA 1.448 -0.562 0 N-CA-C 106.937 -1.505 . . . . 0.0 106.937 171.288 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 20.9 t0 -109.39 93.58 4.58 Favored 'General case' 0 CA--C 1.516 -0.365 0 N-CA-C 107.918 -1.141 . . . . 0.0 107.918 171.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -62.89 -12.4 42.29 Favored Glycine 0 CA--C 1.53 1.029 0 CA-C-O 117.947 -1.474 . . . . 0.0 113.641 179.846 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 11.7 mt-10 -75.77 -32.95 60.14 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 121.228 2.514 . . . . 0.0 109.363 173.911 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 51.0 mtt85 -104.43 -5.06 22.02 Favored 'General case' 0 CA--C 1.529 0.137 0 C-N-CA 125.201 1.4 . . . . 0.0 111.727 -177.807 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 38.9 mtp180 44.28 43.75 6.16 Favored 'General case' 0 CA--C 1.514 -0.436 0 C-N-CA 128.604 2.762 . . . . 0.0 110.836 178.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 4.9 t -145.43 172.18 13.57 Favored 'General case' 0 N--CA 1.444 -0.737 0 N-CA-C 106.573 -1.639 . . . . 0.0 106.573 177.874 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 71.0 m-85 -94.58 140.42 29.88 Favored 'General case' 0 C--O 1.242 0.71 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 170.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -125.79 154.45 73.35 Favored Pre-proline 0 C--N 1.321 -0.661 0 C-N-CA 126.161 1.784 . . . . 0.0 107.182 173.124 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_endo -68.33 145.52 65.96 Favored 'Trans proline' 0 N--CA 1.45 -1.081 0 C-N-CA 122.132 1.888 . . . . 0.0 109.62 172.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -106.19 30.8 5.61 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 124.207 1.003 . . . . 0.0 111.411 173.872 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 5.9 mp -80.7 99.85 8.4 Favored 'General case' 0 C--N 1.332 -0.184 0 O-C-N 121.073 -1.017 . . . . 0.0 108.371 179.311 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 67.68 154.7 0.1 Allowed 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 126.769 2.028 . . . . 0.0 111.989 175.919 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 5.2 mt-30 -163.65 164.47 23.97 Favored 'General case' 0 C--N 1.316 -0.873 0 C-N-CA 128.529 2.732 . . . . 0.0 110.91 -176.265 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 45.09 77.23 0.08 Allowed 'General case' 0 C--O 1.236 0.373 0 C-N-CA 126.763 2.025 . . . . 0.0 110.946 174.398 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -61.74 80.12 0.02 OUTLIER 'General case' 0 C--O 1.233 0.198 0 C-N-CA 126.979 2.112 . . . . 0.0 112.047 -168.728 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 -131.56 -6.92 3.69 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 128.045 2.538 . . . . 0.0 109.919 168.291 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -112.31 -86.65 1.61 Allowed Glycine 0 C--N 1.339 0.718 0 N-CA-C 108.306 -1.918 . . . . 0.0 108.306 171.643 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 6.9 t-160 49.53 35.1 7.75 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 125.042 1.337 . . . . 0.0 111.904 -166.388 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 3.1 mmmt -129.44 6.21 5.24 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 124.816 1.246 . . . . 0.0 112.599 -171.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -149.74 -171.53 3.92 Favored 'General case' 0 C--N 1.324 -0.523 0 C-N-CA 129.512 3.125 . . . . 0.0 106.406 171.703 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -57.81 -41.56 82.45 Favored 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 125.572 1.549 . . . . 0.0 113.348 167.684 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -117.06 179.28 17.43 Favored Glycine 0 N--CA 1.443 -0.862 0 N-CA-C 108.477 -1.849 . . . . 0.0 108.477 -176.794 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -121.4 79.44 36.91 Favored Pre-proline 0 CA--C 1.54 0.582 0 C-N-CA 122.812 0.445 . . . . 0.0 110.148 -171.617 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 67.3 Cg_endo -67.01 -4.35 11.31 Favored 'Trans proline' 0 CA--C 1.541 0.861 0 C-N-CA 125.195 3.93 . . . . 0.0 114.897 -172.211 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -77.76 13.76 1.25 Allowed 'General case' 0 C--N 1.327 -0.413 0 C-N-CA 127.368 2.267 . . . . 0.0 114.969 -165.288 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 6.1 mtpm? -98.2 -8.02 28.21 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 120.199 1.363 . . . . 0.0 112.073 177.468 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 9.8 tt0 -69.33 -21.92 63.8 Favored 'General case' 0 C--O 1.233 0.223 0 N-CA-C 113.261 0.837 . . . . 0.0 113.261 -166.354 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 106.42 -19.2 37.28 Favored Glycine 0 CA--C 1.524 0.651 0 C-N-CA 124.654 1.121 . . . . 0.0 113.401 -176.847 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 25.2 mttp -91.74 -51.65 5.13 Favored 'General case' 0 C--O 1.218 -0.576 0 CA-C-N 119.019 1.41 . . . . 0.0 108.131 167.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . 0.308 11.5 pt-20 56.59 -74.49 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 117.309 2.337 . . . . 0.0 117.309 154.694 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 20.8 mmmt -118.79 14.62 13.42 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 125.675 1.59 . . . . 0.0 111.846 174.335 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 60.57 176.38 0.1 Allowed 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 131.035 3.734 . . . . 0.0 111.313 -162.882 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -49.47 -34.75 17.7 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 125.842 1.657 . . . . 0.0 112.513 -178.35 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 54.38 -152.33 0.33 Allowed 'General case' 0 CA--C 1.538 0.481 0 N-CA-C 108.26 -1.015 . . . . 0.0 108.26 -179.872 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 30.1 m170 56.2 9.33 0.49 Allowed 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 119.882 3.29 . . . . 0.0 119.882 146.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 13.5 tptt 70.25 -164.58 0.16 Allowed 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 121.071 1.76 . . . . 0.0 108.046 -167.603 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 9.1 m -115.26 24.73 11.4 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 124.512 1.125 . . . . 0.0 108.484 -176.542 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 11.9 mptt . . . . . 0 C--O 1.255 1.379 0 C-N-CA 125.659 1.584 . . . . 0.0 107.779 -133.461 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 0.986 0 N-CA-C 109.683 -1.367 . . . . 0.0 109.683 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 12.4 p-80 -100.91 13.32 35.49 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-N 119.425 1.613 . . . . 0.0 111.296 176.351 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 83.0 mtp -142.45 114.27 8.06 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 127.889 2.475 . . . . 0.0 105.605 178.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -158.48 66.35 0.44 Allowed 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 125.428 1.491 . . . . 0.0 107.926 167.364 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 -128.04 -6.98 5.46 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.384 -179.136 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 46.0 m 53.35 32.34 13.57 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 112.488 0.551 . . . . 0.0 112.488 -179.699 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 3.0 p90 -61.53 -14.92 33.51 Favored 'General case' 0 CA--C 1.539 0.54 0 O-C-N 121.178 -0.951 . . . . 0.0 112.665 178.268 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 6.3 t -107.19 122.58 46.8 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 126.486 1.915 . . . . 0.0 109.426 177.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -68.4 -62.33 1.44 Allowed 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 123.376 0.671 . . . . 0.0 109.257 165.414 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 28.5 m-85 -108.84 165.01 13.44 Favored Pre-proline 0 C--O 1.239 0.544 0 C-N-CA 124.054 0.942 . . . . 0.0 111.49 -168.237 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 68.5 Cg_endo -74.51 -178.98 4.38 Favored 'Trans proline' 0 C--N 1.349 0.586 0 C-N-CA 122.957 2.438 . . . . 0.0 110.207 171.896 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 25.0 t -104.73 86.46 1.46 Allowed Pre-proline 0 CA--C 1.538 0.506 0 N-CA-C 106.05 -1.833 . . . . 0.0 106.05 176.422 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -68.67 170.62 14.81 Favored 'Trans proline' 0 N--CA 1.457 -0.639 0 C-N-CA 123.125 2.55 . . . . 0.0 109.134 -176.616 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 12.0 t0 -144.53 138.28 27.43 Favored 'General case' 0 CA--C 1.511 -0.532 0 N-CA-C 107.342 -1.355 . . . . 0.0 107.342 176.011 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.516 ' HA ' ' CD2' ' A' ' 18' ' ' TYR . 1.5 t -69.1 -19.27 23.6 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 N-CA-C 107.902 -1.147 . . . . 0.0 107.902 178.399 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 86.7 p -61.66 -15.66 41.87 Favored 'General case' 0 N--CA 1.43 -1.446 0 N-CA-C 113.606 0.965 . . . . 0.0 113.606 -179.384 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 14.0 t -124.08 9.92 8.73 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 126.308 1.843 . . . . 0.0 112.807 177.836 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . 0.516 ' CD2' ' HA ' ' A' ' 15' ' ' VAL . 18.3 m-30 -68.86 170.59 9.35 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-N 120.393 1.451 . . . . 0.0 108.488 166.577 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 14.3 mt-30 -118.1 106.25 12.67 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 124.521 1.128 . . . . 0.0 110.028 177.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 84.8 t80 -56.03 141.76 38.78 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 124.599 1.16 . . . . 0.0 111.456 170.879 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -126.04 95.09 4.28 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 124.158 0.983 . . . . 0.0 109.312 179.727 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -57.35 -23.21 47.51 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 125.176 1.39 . . . . 0.0 113.285 -177.637 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 5.2 t -48.59 -35.58 13.82 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 127.128 2.171 . . . . 0.0 109.659 172.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -120.68 -55.76 1.99 Allowed 'General case' 0 N--CA 1.445 -0.719 0 C-N-CA 124.167 0.987 . . . . 0.0 108.538 -177.768 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 117.0 28.71 2.36 Favored Glycine 0 CA--C 1.527 0.833 0 C-N-CA 123.965 0.793 . . . . 0.0 114.424 -174.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 39.4 m-85 -130.82 165.33 23.24 Favored 'General case' 0 C--O 1.239 0.504 0 C-N-CA 126.244 1.817 . . . . 0.0 106.804 -176.261 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 79.6 m-85 -90.41 140.17 29.97 Favored 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 124.554 1.141 . . . . 0.0 108.037 173.265 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 31.3 t80 -102.34 134.86 44.95 Favored 'General case' 0 C--O 1.237 0.433 0 N-CA-C 107.459 -1.311 . . . . 0.0 107.459 170.039 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -112.69 77.0 2.28 Favored Pre-proline 0 N--CA 1.447 -0.587 0 C-N-CA 125.89 1.676 . . . . 0.0 109.429 -166.347 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -67.22 -6.27 15.81 Favored 'Trans proline' 0 N--CA 1.46 -0.465 0 C-N-CA 122.929 2.42 . . . . 0.0 114.145 -170.82 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 3.9 tt0 -63.29 -26.11 68.62 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 118.516 0.598 . . . . 0.0 110.408 174.314 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 7.3 p -139.98 -21.15 0.88 Allowed 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 124.78 1.232 . . . . 0.0 113.474 179.453 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 97.45 14.81 39.95 Favored Glycine 0 CA--C 1.529 0.963 0 CA-C-N 119.054 0.843 . . . . 0.0 112.764 -178.463 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 24.3 mt -86.51 -178.33 6.39 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 118.634 1.217 . . . . 0.0 109.18 175.664 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 39.0 m-85 -126.63 146.42 50.18 Favored 'General case' 0 C--O 1.238 0.461 0 C-N-CA 124.507 1.123 . . . . 0.0 109.825 166.374 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 85.9 t80 -117.83 154.79 31.21 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.932 1.693 . . . . 0.0 109.348 177.878 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -124.95 143.81 45.11 Favored Pre-proline 0 CA--C 1.535 0.383 0 C-N-CA 126.248 1.819 . . . . 0.0 109.151 171.927 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 70.7 Cg_endo -79.33 -31.92 1.93 Allowed 'Trans proline' 0 N--CA 1.459 -0.516 0 C-N-CA 123.691 2.927 . . . . 0.0 113.853 -176.238 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 8.2 m-80 -81.98 -22.04 36.82 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 124.049 0.939 . . . . 0.0 109.592 176.656 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 38.4 m -137.6 98.1 3.61 Favored 'General case' 0 CA--C 1.513 -0.477 0 C-N-CA 125.501 1.521 . . . . 0.0 108.94 -170.554 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 19.7 mp0 -67.35 24.33 0.02 OUTLIER 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 127.733 2.413 . . . . 0.0 113.203 -179.278 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 33.2 m-85 -99.25 101.44 12.76 Favored 'General case' 0 CA--C 1.536 0.42 0 O-C-N 120.202 -1.561 . . . . 0.0 108.261 177.501 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 29.6 m-85 -65.69 111.83 3.38 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 128.554 2.741 . . . . 0.0 110.604 -179.747 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 63.8 t80 -75.33 127.29 32.81 Favored 'General case' 0 C--N 1.326 -0.452 0 C-N-CA 125.618 1.567 . . . . 0.0 110.448 -176.495 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 45.0 t30 -99.3 81.33 2.53 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 126.886 2.074 . . . . 0.0 109.54 175.364 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -46.08 -36.79 6.08 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 124.749 1.22 . . . . 0.0 111.992 176.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.7 tt0 -49.78 -31.07 10.75 Favored 'General case' 0 N--CA 1.447 -0.611 0 C-N-CA 127.573 2.349 . . . . 0.0 114.121 -178.425 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 40.2 m -134.04 17.13 3.81 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 123.52 0.728 . . . . 0.0 111.223 172.146 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 40.8 mt-30 44.99 32.31 0.83 Allowed 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 125.519 1.528 . . . . 0.0 112.006 -163.376 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -93.6 168.33 11.1 Favored 'General case' 0 N--CA 1.452 -0.345 0 O-C-N 120.9 -1.125 . . . . 0.0 109.848 -176.167 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 5.7 m-85 -116.57 128.07 55.08 Favored 'General case' 0 N--CA 1.446 -0.633 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 -174.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 22.6 mt -124.02 178.24 5.39 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 127.326 2.25 . . . . 0.0 109.885 179.686 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 5.1 p90 -145.69 152.44 39.62 Favored 'General case' 0 C--O 1.235 0.318 0 C-N-CA 127.788 2.435 . . . . 0.0 106.943 168.441 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 69.2 t-105 -77.1 142.98 39.53 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 107.316 -1.364 . . . . 0.0 107.316 164.569 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 63.9 t0 -131.85 104.53 6.93 Favored 'General case' 0 C--O 1.234 0.272 0 N-CA-C 108.876 -0.786 . . . . 0.0 108.876 169.708 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -75.81 -7.63 83.82 Favored Glycine 0 CA--C 1.533 1.163 0 C-N-CA 124.362 0.982 . . . . 0.0 113.345 -178.935 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 73.7 mt-10 -75.04 -31.57 61.34 Favored 'General case' 0 CA--C 1.531 0.222 0 O-C-N 121.066 -1.255 . . . . 0.0 109.933 170.342 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 63.9 mtt180 -110.04 -7.31 14.95 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 125.502 1.521 . . . . 0.0 112.668 -177.115 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 61.3 mtt85 44.98 55.66 5.97 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 128.294 2.638 . . . . 0.0 110.752 -174.02 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 11.3 t -150.72 169.46 21.56 Favored 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 123.268 0.627 . . . . 0.0 109.833 174.051 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 93.4 m-85 -92.43 134.88 34.52 Favored 'General case' 0 C--O 1.238 0.458 0 N-CA-C 107.23 -1.396 . . . . 0.0 107.23 164.071 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -126.95 157.7 71.02 Favored Pre-proline 0 C--N 1.322 -0.608 0 C-N-CA 127.026 2.13 . . . . 0.0 111.113 178.362 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_endo -75.23 123.41 7.74 Favored 'Trans proline' 0 CA--C 1.533 0.471 0 C-N-CA 123.925 3.083 . . . . 0.0 112.568 -177.939 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -90.03 14.13 13.11 Favored 'General case' 0 N--CA 1.465 0.298 0 N-CA-C 115.831 1.789 . . . . 0.0 115.831 -169.091 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -45.53 -75.21 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 126.776 2.031 . . . . 0.0 111.726 -167.706 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 14.8 mp0 -87.13 -50.47 6.6 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-N 118.448 0.567 . . . . 0.0 110.155 179.088 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 51.26 17.41 0.49 Allowed 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 127.398 2.279 . . . . 0.0 113.281 -174.503 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 24.9 p -159.82 144.04 14.71 Favored 'General case' 0 N--CA 1.443 -0.784 0 O-C-N 120.597 -1.314 . . . . 0.0 108.744 170.327 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -128.81 8.88 5.8 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 127.378 2.271 . . . . 0.0 110.509 174.157 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 29.7 t0 -124.55 93.95 4.06 Favored 'General case' 0 C--O 1.241 0.648 0 N-CA-C 107.758 -1.201 . . . . 0.0 107.758 -178.754 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 119.55 162.15 11.85 Favored Glycine 0 CA--C 1.524 0.654 0 C-N-CA 125.137 1.351 . . . . 0.0 109.955 178.355 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 38.8 m170 -75.61 86.0 2.67 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 123.95 0.9 . . . . 0.0 109.796 177.391 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 2.1 mptt -130.29 170.79 13.66 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-N 118.833 0.742 . . . . 0.0 110.611 166.428 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -144.45 -56.4 0.35 Allowed 'General case' 0 C--O 1.224 -0.273 0 C-N-CA 123.804 0.842 . . . . 0.0 109.713 172.359 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 5.7 p -141.6 -24.88 0.71 Allowed 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 123.92 0.888 . . . . 0.0 112.953 166.596 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -168.9 -159.76 15.32 Favored Glycine 0 C--N 1.334 0.419 0 N-CA-C 110.577 -1.009 . . . . 0.0 110.577 -161.75 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -131.85 68.55 80.62 Favored Pre-proline 0 C--O 1.239 0.545 0 CA-C-N 117.541 0.67 . . . . 0.0 111.231 168.31 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_endo -57.41 106.83 0.26 Allowed 'Trans proline' 0 N--CA 1.454 -0.829 0 C-N-CA 124.367 3.378 . . . . 0.0 109.392 174.88 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 58.5 m 45.0 42.74 6.64 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 123.666 0.787 . . . . 0.0 112.323 -175.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -135.24 14.3 3.52 Favored 'General case' 0 N--CA 1.461 0.102 0 C-N-CA 123.232 0.613 . . . . 0.0 111.232 178.834 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 22.6 tt0 -153.69 61.21 0.74 Allowed 'General case' 0 C--O 1.235 0.309 0 N-CA-C 108.088 -1.078 . . . . 0.0 108.088 176.487 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 76.48 -30.47 1.44 Allowed Glycine 0 CA--C 1.534 1.226 0 O-C-N 120.718 -1.239 . . . . 0.0 113.922 172.48 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 1.6 mtmm -52.91 -25.68 12.53 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 118.735 1.267 . . . . 0.0 111.162 168.509 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -51.58 -36.04 43.78 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 125.508 1.523 . . . . 0.0 112.728 176.023 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.38 4.51 15.38 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 124.059 0.944 . . . . 0.0 111.02 -176.856 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 73.3 mttt -97.28 -44.72 6.79 Favored 'General case' 0 CA--C 1.51 -0.567 0 O-C-N 120.774 -1.204 . . . . 0.0 109.733 167.881 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 14.5 tt0 56.82 68.88 0.8 Allowed 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 124.638 1.175 . . . . 0.0 110.348 177.719 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -138.95 75.36 1.51 Allowed 'General case' 0 C--O 1.232 0.166 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 -169.42 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 31.1 t-80 -74.61 109.21 7.9 Favored 'General case' 0 C--O 1.239 0.514 0 N-CA-C 107.219 -1.4 . . . . 0.0 107.219 170.199 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 15.6 tptt -152.36 -22.49 0.17 Allowed 'General case' 0 N--CA 1.464 0.262 0 CA-C-O 116.266 -1.826 . . . . 0.0 113.03 -178.081 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 5.2 m 44.02 61.32 2.38 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 125.525 1.53 . . . . 0.0 111.799 160.227 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 1.2 mtpt . . . . . 0 C--O 1.253 1.244 0 N-CA-C 104.446 -2.427 . . . . 0.0 104.446 -178.031 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.73 0 N-CA-C 110.14 -1.184 . . . . 0.0 110.14 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 13.3 m80 69.79 -167.02 0.17 Allowed 'General case' 0 C--O 1.24 0.574 0 C-N-CA 125.767 1.627 . . . . 0.0 109.868 -167.438 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' MET . . . . . 0.431 ' HG2' ' H ' ' A' ' 4' ' ' GLN . 7.6 ttt -74.57 -162.69 0.17 Allowed 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 125.728 1.611 . . . . 0.0 109.608 178.421 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . 0.431 ' H ' ' HG2' ' A' ' 3' ' ' MET . 10.7 mt-30 -140.91 152.58 45.15 Favored 'General case' 0 N--CA 1.452 -0.333 0 O-C-N 120.912 -1.118 . . . . 0.0 109.594 170.607 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -65.27 -17.42 64.49 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 125.219 1.408 . . . . 0.0 113.281 -177.367 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 8.4 t 59.59 64.53 1.31 Allowed 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 125.825 1.65 . . . . 0.0 111.856 170.25 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 40.9 p90 -112.88 -22.06 10.84 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 124.28 1.032 . . . . 0.0 113.581 -176.111 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 2.1 t 49.77 58.66 5.2 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 125.972 1.709 . . . . 0.0 113.041 174.22 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 38.8 mm-40 -130.68 176.31 8.29 Favored 'General case' 0 C--O 1.233 0.225 0 C-N-CA 124.659 1.184 . . . . 0.0 112.019 177.174 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 61.4 m-85 -60.0 163.0 8.53 Favored Pre-proline 0 C--O 1.242 0.708 0 C-N-CA 126.05 1.74 . . . . 0.0 112.013 -169.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 92.3 Cg_endo -68.62 179.28 3.2 Favored 'Trans proline' 0 N--CA 1.456 -0.713 0 C-N-CA 123.541 2.827 . . . . 0.0 109.976 167.639 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 10.7 t -105.1 88.39 2.41 Favored Pre-proline 0 N--CA 1.45 -0.445 0 N-CA-C 106.748 -1.575 . . . . 0.0 106.748 176.403 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_endo -58.67 170.89 2.26 Favored 'Trans proline' 0 CA--C 1.545 1.048 0 CA-C-N 120.248 1.124 . . . . 0.0 110.397 171.703 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 15.3 t0 -132.84 129.25 38.22 Favored 'General case' 0 N--CA 1.447 -0.621 0 N-CA-C 106.139 -1.8 . . . . 0.0 106.139 164.524 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 1.7 t -59.0 -26.6 33.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 114.515 -1.221 . . . . 0.0 108.149 173.545 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 36.4 p -60.34 -38.22 83.1 Favored 'General case' 0 N--CA 1.437 -1.114 0 C-N-CA 118.033 -1.467 . . . . 0.0 109.047 -172.42 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 16.4 p -87.68 18.33 4.09 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 126.436 1.894 . . . . 0.0 111.778 179.374 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 13.3 m-30 -79.96 160.6 25.88 Favored 'General case' 0 C--O 1.234 0.258 0 O-C-N 119.903 -1.748 . . . . 0.0 110.049 170.518 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 25.6 mt-30 -100.56 109.6 21.71 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 107.975 -1.12 . . . . 0.0 107.975 -178.429 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 66.9 t80 -63.45 152.68 37.68 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 124.081 0.953 . . . . 0.0 110.421 176.042 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -128.73 105.3 8.16 Favored 'General case' 0 CA--C 1.512 -0.505 0 C-N-CA 125.139 1.376 . . . . 0.0 108.498 168.135 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -61.09 -27.47 68.39 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 119.172 -0.442 . . . . 0.0 112.109 169.917 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 15.1 t -66.08 -4.98 8.36 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.347 1.059 . . . . 0.0 113.184 -178.132 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 12.5 t -140.75 -47.8 0.42 Allowed 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 123.301 0.641 . . . . 0.0 109.555 172.619 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 112.0 43.66 0.92 Allowed Glycine 0 CA--C 1.526 0.743 0 C-N-CA 124.921 1.248 . . . . 0.0 111.929 -177.75 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 68.8 m-85 -136.13 170.28 16.27 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 119.401 1.601 . . . . 0.0 111.161 -177.785 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 79.4 m-85 -110.91 125.96 54.22 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 124.76 1.224 . . . . 0.0 107.707 173.685 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 34.8 t80 -88.56 139.48 30.43 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 124.368 1.067 . . . . 0.0 108.396 177.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 27.7 t0 -97.4 86.54 0.42 Allowed Pre-proline 0 CA--C 1.529 0.145 0 C-N-CA 126.946 2.098 . . . . 0.0 109.247 177.796 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -70.37 -5.08 15.77 Favored 'Trans proline' 0 N--CA 1.456 -0.702 0 C-N-CA 122.592 2.195 . . . . 0.0 113.685 175.798 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 2.4 mm-40 -73.77 -28.26 61.57 Favored 'General case' 0 CA--C 1.533 0.309 0 O-C-N 121.328 -0.858 . . . . 0.0 109.368 175.284 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 23.7 p -140.31 -24.11 0.81 Allowed 'General case' 0 C--O 1.238 0.453 0 N-CA-C 115.079 1.511 . . . . 0.0 115.079 -169.404 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 104.13 9.95 35.49 Favored Glycine 0 CA--C 1.53 1.021 0 C-N-CA 124.135 0.874 . . . . 0.0 112.986 177.426 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 19.8 mt -89.84 179.99 5.86 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 125.544 1.538 . . . . 0.0 109.07 178.253 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 57.4 m-85 -124.3 171.37 9.94 Favored 'General case' 0 C--O 1.234 0.282 0 C-N-CA 124.474 1.11 . . . . 0.0 108.843 162.368 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 68.1 t80 -143.21 159.36 42.46 Favored 'General case' 0 C--O 1.238 0.467 0 C-N-CA 128.224 2.609 . . . . 0.0 108.337 179.24 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -127.66 144.35 50.82 Favored Pre-proline 0 C--O 1.235 0.321 0 C-N-CA 124.576 1.15 . . . . 0.0 108.373 174.229 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 61.9 Cg_endo -75.07 -35.07 3.3 Favored 'Trans proline' 0 N--CA 1.45 -1.057 0 C-N-CA 121.944 1.763 . . . . 0.0 113.324 -173.036 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 3.6 m-80 -83.08 -21.72 33.64 Favored 'General case' 0 CA--C 1.524 -0.056 0 CA-C-N 119.152 0.887 . . . . 0.0 110.91 175.807 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 42.7 t -130.89 89.36 2.74 Favored 'General case' 0 N--CA 1.45 -0.472 0 N-CA-C 107.449 -1.315 . . . . 0.0 107.449 -166.85 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -55.92 -9.25 0.55 Allowed 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.873 1.269 . . . . 0.0 113.255 -177.792 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 11.5 m-85 -62.95 107.04 0.91 Allowed 'General case' 0 N--CA 1.449 -0.486 0 C-N-CA 124.951 1.3 . . . . 0.0 108.807 170.566 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 28.2 m-85 -59.89 156.75 13.76 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 124.756 1.222 . . . . 0.0 109.28 170.915 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 83.0 t80 -117.35 124.45 48.96 Favored 'General case' 0 N--CA 1.447 -0.602 0 C-N-CA 124.508 1.123 . . . . 0.0 108.116 177.74 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 27.1 t30 -98.15 84.65 3.3 Favored 'General case' 0 N--CA 1.446 -0.654 0 C-N-CA 126.754 2.022 . . . . 0.0 107.824 176.084 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -53.85 -26.52 24.89 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 124.324 1.049 . . . . 0.0 112.181 175.639 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -52.49 -41.64 63.58 Favored 'General case' 0 N--CA 1.446 -0.637 0 C-N-CA 124.496 1.118 . . . . 0.0 112.113 176.861 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 14.6 m -128.43 15.91 6.57 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 125.15 1.38 . . . . 0.0 111.726 -179.766 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 40.2 mt-30 50.62 19.01 0.53 Allowed 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 127.091 2.156 . . . . 0.0 114.35 -171.803 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -91.31 159.14 16.17 Favored 'General case' 0 N--CA 1.454 -0.239 0 C-N-CA 124.02 0.928 . . . . 0.0 109.798 -171.071 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -98.49 146.75 25.45 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 108.548 -0.908 . . . . 0.0 108.548 174.849 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 82.7 mt -140.01 -178.03 5.26 Favored 'General case' 0 C--N 1.326 -0.413 0 C-N-CA 125.564 1.546 . . . . 0.0 107.915 -179.386 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 26.5 p90 -143.32 149.69 38.13 Favored 'General case' 0 C--N 1.327 -0.378 0 C-N-CA 125.188 1.395 . . . . 0.0 108.191 168.073 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 42.0 t-105 -85.71 139.38 31.4 Favored 'General case' 0 C--O 1.235 0.337 0 N-CA-C 106.57 -1.641 . . . . 0.0 106.57 168.399 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 7.6 t0 -134.85 113.8 11.95 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 122.899 0.48 . . . . 0.0 110.057 -175.833 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -74.37 -12.01 82.18 Favored Glycine 0 CA--C 1.533 1.183 0 CA-C-O 119.117 -0.824 . . . . 0.0 113.498 176.179 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -67.15 -35.23 79.26 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 119.67 1.735 . . . . 0.0 108.937 176.388 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 43.0 mtt85 -120.21 -4.29 10.0 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 124.556 1.142 . . . . 0.0 112.75 -177.558 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 9.7 mtp85 49.19 51.53 16.08 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 126.695 1.998 . . . . 0.0 110.475 -173.247 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 1.4 t -146.36 173.86 11.89 Favored 'General case' 0 CA--C 1.536 0.424 0 O-C-N 121.345 -0.847 . . . . 0.0 108.793 -179.888 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 99.1 m-85 -111.03 119.66 39.78 Favored 'General case' 0 C--O 1.234 0.276 0 C-N-CA 125.044 1.337 . . . . 0.0 108.547 -179.445 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -126.4 156.84 72.12 Favored Pre-proline 0 N--CA 1.469 0.503 0 C-N-CA 125.946 1.698 . . . . 0.0 111.871 -169.805 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -74.43 118.46 5.36 Favored 'Trans proline' 0 N--CA 1.459 -0.553 0 C-N-CA 122.439 2.092 . . . . 0.0 111.947 -175.505 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -81.74 26.28 0.5 Allowed 'General case' 0 N--CA 1.466 0.347 0 O-C-N 121.479 -0.763 . . . . 0.0 112.069 178.159 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 7.4 mp -88.43 -42.55 12.08 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 124.483 1.113 . . . . 0.0 109.347 178.408 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.9 pt-20 -56.21 -43.45 78.54 Favored 'General case' 0 N--CA 1.463 0.205 0 C-N-CA 123.978 0.911 . . . . 0.0 108.929 -175.37 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -85.35 -1.55 57.11 Favored 'General case' 0 N--CA 1.449 -0.486 0 C-N-CA 126.04 1.736 . . . . 0.0 113.533 -175.664 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.43 10.97 23.09 Favored 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 124.634 1.174 . . . . 0.0 112.3 -172.827 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 51.1 66.8 1.07 Allowed 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 124.629 1.172 . . . . 0.0 111.397 -175.386 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -55.21 -34.96 64.39 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 124.671 1.188 . . . . 0.0 109.588 164.069 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 75.29 -81.87 0.92 Allowed Glycine 0 N--CA 1.444 -0.792 0 N-CA-C 107.824 -2.11 . . . . 0.0 107.824 -173.011 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -156.09 31.6 0.34 Allowed 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 126.291 1.836 . . . . 0.0 111.916 -175.197 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 20.9 mtmm -106.99 -171.22 1.84 Allowed 'General case' 0 C--O 1.237 0.445 0 C-N-CA 123.905 0.882 . . . . 0.0 109.915 -175.785 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -146.62 172.53 13.45 Favored 'General case' 0 C--N 1.326 -0.452 0 C-N-CA 127.568 2.347 . . . . 0.0 106.906 -175.162 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -52.18 -0.22 0.01 OUTLIER 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 128.875 2.87 . . . . 0.0 116.383 173.657 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 173.34 -159.74 29.94 Favored Glycine 0 N--CA 1.444 -0.804 0 CA-C-N 119.776 1.171 . . . . 0.0 110.321 -162.571 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -134.33 157.63 77.04 Favored Pre-proline 0 CA--C 1.537 0.473 0 C-N-CA 125.783 1.633 . . . . 0.0 109.479 179.016 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_endo -64.64 136.77 51.39 Favored 'Trans proline' 0 N--CA 1.457 -0.634 0 C-N-CA 122.918 2.412 . . . . 0.0 111.302 -178.892 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 44.8 m 59.49 -176.0 0.1 Allowed 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 125.678 1.591 . . . . 0.0 111.942 -176.785 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 44.5 tttt 56.0 38.78 30.32 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 123.556 0.742 . . . . 0.0 110.623 177.341 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 20.5 pt-20 -147.62 21.69 1.16 Allowed 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 126.183 1.793 . . . . 0.0 111.229 -177.523 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 82.85 -16.53 26.31 Favored Glycine 0 CA--C 1.533 1.167 0 O-C-N 120.937 -1.102 . . . . 0.0 113.205 -175.179 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 54.2 mttt -100.04 10.42 41.31 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 119.636 1.718 . . . . 0.0 114.14 179.049 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -47.44 -23.16 0.55 Allowed 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 126.392 1.877 . . . . 0.0 115.021 178.542 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 7.8 ptmt -134.0 26.32 3.92 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 124.418 1.087 . . . . 0.0 111.593 176.584 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 15.2 mmtp -134.75 28.19 3.59 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 124.652 1.181 . . . . 0.0 111.588 -171.72 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -61.64 -72.03 0.13 Allowed 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 123.44 0.696 . . . . 0.0 110.454 174.406 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 52.61 66.09 1.32 Allowed 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 124.83 1.252 . . . . 0.0 109.871 -165.997 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 62.2 t-80 -59.19 136.52 57.98 Favored 'General case' 0 C--O 1.239 0.516 0 N-CA-C 109.638 -0.505 . . . . 0.0 109.638 172.036 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 9.0 mtpt -131.46 -78.81 0.52 Allowed 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 124.709 1.204 . . . . 0.0 108.841 176.178 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 10.5 m 45.83 54.79 7.54 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 119.215 0.916 . . . . 0.0 108.951 -162.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 44.9 tttp . . . . . 0 C--O 1.248 1.011 0 O-C-N 120.704 -1.248 . . . . 0.0 108.928 178.002 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.635 0 N-CA-C 109.828 -1.309 . . . . 0.0 109.828 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -144.65 146.3 32.19 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 108.074 -1.084 . . . . 0.0 108.074 174.954 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 5.1 ptt? -65.32 165.76 11.16 Favored 'General case' 0 C--O 1.236 0.348 0 N-CA-C 109.912 -0.403 . . . . 0.0 109.912 178.712 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 32.8 mt-30 -63.33 96.7 0.11 Allowed 'General case' 0 C--O 1.234 0.237 0 C-N-CA 124.05 0.94 . . . . 0.0 109.135 172.406 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -143.09 22.24 1.91 Allowed 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 127.33 2.252 . . . . 0.0 109.33 -174.631 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 8.7 t -71.0 108.5 4.6 Favored 'General case' 0 N--CA 1.454 -0.275 0 O-C-N 119.717 -1.864 . . . . 0.0 107.281 171.921 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 44.6 p90 -63.08 -41.56 99.45 Favored 'General case' 0 N--CA 1.456 -0.162 0 C-N-CA 122.771 0.429 . . . . 0.0 111.034 -175.188 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 52.16 78.16 0.13 Allowed 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 126.485 1.914 . . . . 0.0 110.419 177.73 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -69.39 -38.08 77.84 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 114.955 -1.02 . . . . 0.0 111.622 -169.752 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 12.9 m-85 -126.41 165.74 26.11 Favored Pre-proline 0 CA--C 1.539 0.553 0 C-N-CA 126.605 1.962 . . . . 0.0 110.055 176.61 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -59.23 -164.88 0.03 OUTLIER 'Trans proline' 0 CA--C 1.542 0.916 1 C-N-CA 125.769 4.312 . . . . 0.0 113.881 162.268 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 47.0 t -126.2 88.06 55.01 Favored Pre-proline 0 CA--C 1.541 0.613 0 C-N-CA 127.083 2.153 . . . . 0.0 108.804 -176.473 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_endo -65.24 160.0 44.33 Favored 'Trans proline' 0 CA--C 1.539 0.745 0 C-N-CA 123.657 2.905 . . . . 0.0 112.451 -173.468 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 42.5 t0 -148.73 127.64 12.67 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 106.709 -1.589 . . . . 0.0 106.709 175.797 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 11.3 p -60.4 -21.44 22.9 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.534 0 C-N-CA 123.956 0.902 . . . . 0.0 112.123 177.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 42.6 t -62.77 -7.49 5.06 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 125.489 1.516 . . . . 0.0 113.381 -178.882 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 14.5 t -124.29 12.35 8.82 Favored 'General case' 0 CA--C 1.533 0.296 0 O-C-N 120.549 -1.344 . . . . 0.0 111.34 177.142 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 10.9 m-30 -73.88 169.28 17.74 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-O 122.101 0.953 . . . . 0.0 110.8 175.423 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 27.2 mt-30 -113.55 101.72 9.61 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 125.936 1.694 . . . . 0.0 107.49 177.763 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 74.9 t80 -67.17 147.02 53.62 Favored 'General case' 0 C--N 1.328 -0.348 0 O-C-N 121.82 -0.55 . . . . 0.0 110.215 169.828 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -129.17 87.99 2.64 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 123.351 0.661 . . . . 0.0 110.793 179.789 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -58.72 -21.94 56.27 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 114.075 1.139 . . . . 0.0 114.075 -168.967 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 3.2 t -58.61 -19.12 35.85 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.577 1.151 . . . . 0.0 112.41 174.405 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 48.8 m -137.54 -23.51 1.08 Allowed 'General case' 0 CA--C 1.539 0.519 0 N-CA-C 114.563 1.32 . . . . 0.0 114.563 177.43 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 98.6 19.98 20.98 Favored Glycine 0 CA--C 1.536 1.364 0 CA-C-N 120.361 1.437 . . . . 0.0 115.535 170.413 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 7.7 m-85 -122.62 169.55 10.92 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 119.595 1.698 . . . . 0.0 110.395 175.72 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 88.3 m-85 -102.49 153.43 20.06 Favored 'General case' 0 N--CA 1.448 -0.531 0 C-N-CA 125.186 1.395 . . . . 0.0 109.617 173.656 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 55.2 t80 -118.86 143.75 46.78 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 126.107 1.763 . . . . 0.0 108.699 172.147 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 65.7 t0 -106.15 87.29 2.43 Favored Pre-proline 0 C--N 1.33 -0.272 0 C-N-CA 126.749 2.02 . . . . 0.0 111.941 -175.738 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -61.16 -6.74 6.92 Favored 'Trans proline' 0 CA--C 1.535 0.551 0 C-N-CA 123.038 2.492 . . . . 0.0 114.747 176.145 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 54.5 mt-30 -74.98 -19.97 59.87 Favored 'General case' 0 CA--C 1.535 0.366 0 O-C-N 120.731 -1.23 . . . . 0.0 111.057 173.772 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 27.5 p -143.19 -40.75 0.31 Allowed 'General case' 0 C--O 1.235 0.339 0 C-N-CA 123.687 0.795 . . . . 0.0 112.791 -166.364 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 96.03 40.25 4.09 Favored Glycine 0 CA--C 1.525 0.663 0 C-N-CA 124.606 1.098 . . . . 0.0 111.744 -176.046 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 10.8 mt -115.56 167.01 11.27 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 124.961 1.305 . . . . 0.0 108.997 172.853 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 37.2 m-85 -106.88 160.57 15.41 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 118.801 0.728 . . . . 0.0 110.359 166.37 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 38.3 t80 -141.95 152.02 43.12 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 126.593 1.957 . . . . 0.0 109.23 -174.78 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -124.63 143.71 44.23 Favored Pre-proline 0 CA--C 1.535 0.402 0 C-N-CA 125.762 1.625 . . . . 0.0 108.797 174.863 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 95.5 Cg_endo -77.46 -21.27 11.74 Favored 'Trans proline' 0 CA--C 1.535 0.535 0 C-N-CA 123.089 2.526 . . . . 0.0 115.159 -172.553 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 81.9 m-20 -92.31 -33.94 14.41 Favored 'General case' 0 N--CA 1.447 -0.622 0 C-N-CA 125.513 1.525 . . . . 0.0 110.018 174.731 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 41.5 p -125.19 84.1 2.24 Favored 'General case' 0 N--CA 1.451 -0.375 0 C-N-CA 123.861 0.864 . . . . 0.0 108.806 -165.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 21.0 mp0 -57.87 -1.09 0.09 Allowed 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 127.149 2.18 . . . . 0.0 114.726 -175.666 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 45.3 m-85 -65.4 107.48 1.67 Allowed 'General case' 0 C--O 1.236 0.35 0 C-N-CA 125.529 1.532 . . . . 0.0 107.807 169.764 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 68.9 m-85 -65.72 140.83 58.48 Favored 'General case' 0 C--O 1.235 0.312 0 C-N-CA 123.87 0.868 . . . . 0.0 108.846 -178.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 64.8 t80 -95.29 109.72 21.82 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-O 122.752 1.263 . . . . 0.0 108.2 175.246 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 35.9 t30 -83.29 80.32 9.11 Favored 'General case' 0 N--CA 1.44 -0.946 0 CA-C-N 114.171 -1.377 . . . . 0.0 108.509 173.966 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -46.25 -35.3 5.11 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 125.095 1.358 . . . . 0.0 112.225 178.444 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -44.41 -50.62 9.18 Favored 'General case' 0 N--CA 1.444 -0.756 0 C-N-CA 127.942 2.497 . . . . 0.0 111.908 177.624 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 13.9 m -126.09 19.4 7.67 Favored 'General case' 0 C--N 1.332 -0.169 0 C-N-CA 124.845 1.258 . . . . 0.0 111.065 -178.345 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 11.1 mp0 50.88 18.67 0.54 Allowed 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 127.75 2.42 . . . . 0.0 113.275 -174.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -84.82 164.07 18.68 Favored 'General case' 0 N--CA 1.447 -0.578 0 C-N-CA 125.145 1.378 . . . . 0.0 111.303 -170.463 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 4.9 m-85 -118.57 121.57 40.54 Favored 'General case' 0 N--CA 1.449 -0.516 0 N-CA-C 105.62 -1.993 . . . . 0.0 105.62 -177.119 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 63.7 mt -124.4 176.56 6.4 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 125.076 1.35 . . . . 0.0 108.223 -170.895 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 13.5 p90 -135.4 148.21 49.28 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 108.121 -1.066 . . . . 0.0 108.121 168.604 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 57.8 t-105 -74.89 135.44 41.5 Favored 'General case' 0 C--O 1.236 0.359 0 N-CA-C 106.395 -1.706 . . . . 0.0 106.395 165.898 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 35.3 t0 -129.05 95.05 3.97 Favored 'General case' 0 N--CA 1.448 -0.564 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 177.567 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -66.09 -17.98 66.35 Favored Glycine 0 CA--C 1.526 0.744 0 CA-C-O 119.232 -0.76 . . . . 0.0 112.381 176.647 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 -68.33 -30.29 69.23 Favored 'General case' 0 C--N 1.34 0.166 0 CA-C-N 119.206 1.503 . . . . 0.0 109.366 174.559 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 47.6 mtt180 -102.86 -9.9 19.52 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.67 1.188 . . . . 0.0 112.106 178.327 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 11.8 mtm-85 44.68 54.94 6.23 Favored 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 127.539 2.335 . . . . 0.0 111.111 -167.297 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 7.5 t -154.94 178.15 10.5 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 124.092 0.957 . . . . 0.0 109.104 177.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 97.3 m-85 -109.36 128.28 54.99 Favored 'General case' 0 C--O 1.233 0.221 0 N-CA-C 107.571 -1.27 . . . . 0.0 107.571 168.349 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -126.73 158.34 68.4 Favored Pre-proline 0 C--N 1.324 -0.525 0 C-N-CA 126.494 1.918 . . . . 0.0 110.64 -173.692 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -72.61 136.93 26.74 Favored 'Trans proline' 0 N--CA 1.455 -0.778 0 C-N-CA 122.421 2.081 . . . . 0.0 110.135 -178.057 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -103.12 17.13 24.81 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 123.521 0.728 . . . . 0.0 111.959 -176.824 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 27.1 mt -71.47 -29.08 64.42 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 123.831 0.852 . . . . 0.0 110.019 -173.513 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 12.9 mt-10 -66.17 -18.75 65.54 Favored 'General case' 0 C--O 1.235 0.325 0 C-N-CA 125.592 1.557 . . . . 0.0 112.89 176.281 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 13.4 tt0 -76.94 71.03 3.43 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-N 119.805 1.184 . . . . 0.0 112.534 -169.192 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 1.4 t -137.13 50.31 2.0 Allowed 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 126.246 1.819 . . . . 0.0 107.905 173.381 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -58.07 103.65 0.15 Allowed 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 125.74 1.616 . . . . 0.0 107.243 165.269 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -148.25 1.92 0.64 Allowed 'General case' 0 N--CA 1.466 0.352 0 N-CA-C 113.574 0.953 . . . . 0.0 113.574 -175.073 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 105.0 69.0 0.75 Allowed Glycine 0 C--N 1.333 0.397 0 N-CA-C 109.72 -1.352 . . . . 0.0 109.72 -174.373 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 12.6 m170 48.76 58.78 4.93 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 125.627 1.571 . . . . 0.0 110.241 -179.053 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 48.4 mttm -131.53 27.99 4.66 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 125.726 1.61 . . . . 0.0 109.96 173.745 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -65.0 166.2 9.72 Favored 'General case' 0 C--O 1.24 0.594 0 O-C-N 121.445 -0.785 . . . . 0.0 109.537 176.55 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 2.2 m -48.87 -37.57 19.96 Favored 'General case' 0 N--CA 1.444 -0.742 0 C-N-CA 126.968 2.107 . . . . 0.0 112.643 -178.777 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -65.11 -47.49 80.99 Favored Glycine 0 CA--C 1.521 0.434 0 N-CA-C 111.423 -0.671 . . . . 0.0 111.423 -169.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . 43.66 63.9 7.48 Favored Pre-proline 0 C--O 1.238 0.492 0 C-N-CA 126.666 1.986 . . . . 0.0 113.568 173.885 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo -72.54 -6.58 19.32 Favored 'Trans proline' 0 N--CA 1.455 -0.771 0 C-N-CA 123.313 2.676 . . . . 0.0 112.658 177.124 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 22.7 t -141.91 154.93 45.45 Favored 'General case' 0 N--CA 1.447 -0.602 0 N-CA-C 106.429 -1.693 . . . . 0.0 106.429 160.501 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 72.5 mttt -137.96 19.32 2.82 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.567 1.147 . . . . 0.0 110.124 159.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 68.56 104.33 0.05 Allowed 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 126.248 1.819 . . . . 0.0 111.076 -172.673 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 110.63 -26.08 13.71 Favored Glycine 0 CA--C 1.527 0.816 0 C-N-CA 125.6 1.571 . . . . 0.0 112.844 173.123 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 6.9 mtpt -131.18 20.13 4.88 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 118.337 1.068 . . . . 0.0 112.378 -172.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.4 ' C ' ' H ' ' A' ' 86' ' ' LYS . 8.9 pt-20 -47.4 117.39 1.76 Allowed 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 119.554 1.07 . . . . 0.0 111.772 178.095 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 12.8 mtmt 61.03 -12.78 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 127.039 2.136 . . . . 0.0 114.147 -176.439 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.4 ' H ' ' C ' ' A' ' 84' ' ' GLU . 97.4 mttt -83.6 52.39 2.24 Favored 'General case' 0 N--CA 1.462 0.16 0 O-C-N 119.773 -1.829 . . . . 0.0 108.71 178.778 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -125.99 8.76 7.42 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 124.611 1.165 . . . . 0.0 111.945 -177.854 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . 0.257 0.2 OUTLIER 58.85 -178.97 0.08 Allowed 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 127.799 2.44 . . . . 0.0 112.424 -159.49 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -140.53 163.65 32.28 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 107.554 -1.276 . . . . 0.0 107.554 163.189 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 3.0 tttp -86.6 21.15 2.25 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 123.285 0.634 . . . . 0.0 111.12 175.451 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 4.2 m 64.42 85.13 0.14 Allowed 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 125.288 1.435 . . . . 0.0 109.04 -158.904 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 8.7 mttm . . . . . 0 C--O 1.25 1.124 0 C-N-CA 127.953 2.501 . . . . 0.0 105.998 174.579 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.573 0 N-CA-C 109.451 -1.46 . . . . 0.0 109.451 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 31.7 m170 -123.54 -172.64 2.56 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 126.407 1.883 . . . . 0.0 109.172 -177.578 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 46.3 mtt -130.57 161.51 31.37 Favored 'General case' 0 N--CA 1.467 0.383 0 O-C-N 121.274 -0.891 . . . . 0.0 108.817 178.631 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 5.5 tp60 -102.24 27.28 6.83 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.385 1.474 . . . . 0.0 110.607 -168.715 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 20.1 pt-20 -62.41 -20.43 64.47 Favored 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 114.018 1.118 . . . . 0.0 114.018 -169.768 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 3.1 m 52.12 56.61 7.51 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.834 1.254 . . . . 0.0 112.238 176.474 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -74.5 121.91 22.25 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 177.646 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 88.7 p -160.53 148.79 16.44 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 118.119 -0.944 . . . . 0.0 112.247 176.24 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 6.0 pt20 -153.54 -22.71 0.14 Allowed 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 116.498 2.036 . . . . 0.0 116.498 172.08 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 37.8 m-85 -94.89 165.19 17.59 Favored Pre-proline 0 C--O 1.241 0.614 0 O-C-N 120.958 -1.089 . . . . 0.0 109.202 172.256 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 29.5 Cg_endo -65.29 -178.25 0.81 Allowed 'Trans proline' 0 CA--C 1.54 0.824 0 C-N-CA 122.965 2.443 . . . . 0.0 111.422 160.202 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 59.1 t -111.34 87.99 8.31 Favored Pre-proline 0 CA--C 1.537 0.465 0 C-N-CA 127.653 2.381 . . . . 0.0 107.584 -173.242 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -68.82 164.92 31.57 Favored 'Trans proline' 0 CA--C 1.539 0.74 0 C-N-CA 123.467 2.778 . . . . 0.0 111.751 -179.109 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.9 t0 -143.25 130.58 20.96 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 108.003 -1.11 . . . . 0.0 108.003 167.653 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 14.0 p -58.68 -17.3 10.26 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.769 0 C-N-CA 124.25 1.02 . . . . 0.0 112.047 176.456 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 32.2 t -53.55 -26.2 20.28 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 125.708 1.603 . . . . 0.0 113.061 173.535 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 5.9 t -119.77 17.68 12.68 Favored 'General case' 0 CA--C 1.545 0.774 0 CA-C-N 119.33 0.968 . . . . 0.0 111.738 -175.18 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 8.1 m-30 -73.64 -168.98 0.63 Allowed 'General case' 0 C--O 1.237 0.398 0 C-N-CA 125.305 1.442 . . . . 0.0 110.456 171.741 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 6.8 mt-30 -122.43 150.86 41.9 Favored 'General case' 0 N--CA 1.446 -0.637 0 N-CA-C 107.018 -1.475 . . . . 0.0 107.018 163.81 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 78.2 t80 -93.95 152.42 18.86 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 108.122 -1.066 . . . . 0.0 108.122 163.909 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -136.05 86.52 2.24 Favored 'General case' 0 CA--C 1.511 -0.539 0 N-CA-C 107.477 -1.305 . . . . 0.0 107.477 175.114 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -47.03 -30.89 2.91 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 126.773 2.029 . . . . 0.0 112.773 179.773 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 1.3 t -65.9 -26.78 67.77 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 123.844 0.858 . . . . 0.0 110.682 -176.78 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 30.2 m -109.15 -24.15 11.28 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.599 1.159 . . . . 0.0 111.641 167.544 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 79.93 27.62 52.77 Favored Glycine 0 CA--C 1.526 0.757 0 C-N-CA 124.558 1.075 . . . . 0.0 112.162 -178.384 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 31.4 m-85 -118.09 169.1 9.95 Favored 'General case' 0 CA--C 1.521 -0.169 0 C-N-CA 124.965 1.306 . . . . 0.0 108.426 179.51 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 73.6 m-85 -94.17 154.46 17.56 Favored 'General case' 0 N--CA 1.449 -0.499 0 N-CA-C 108.25 -1.018 . . . . 0.0 108.25 159.848 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 20.1 t80 -117.93 137.1 53.06 Favored 'General case' 0 N--CA 1.447 -0.624 0 C-N-CA 127.845 2.458 . . . . 0.0 106.472 174.636 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 47.9 t0 -100.62 86.72 0.69 Allowed Pre-proline 0 C--N 1.327 -0.384 0 C-N-CA 128.088 2.555 . . . . 0.0 108.359 -179.648 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_endo -66.0 -11.9 33.03 Favored 'Trans proline' 0 N--CA 1.458 -0.593 0 C-N-CA 122.162 1.908 . . . . 0.0 114.244 177.646 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 56.7 mm-40 -63.51 -52.99 58.86 Favored 'General case' 0 C--O 1.233 0.196 0 N-CA-C 107.164 -1.421 . . . . 0.0 107.164 173.276 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 45.4 p -110.35 -32.53 6.92 Favored 'General case' 0 CA--C 1.532 0.274 0 N-CA-C 114.112 1.153 . . . . 0.0 114.112 -169.564 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 106.74 12.16 25.06 Favored Glycine 0 CA--C 1.529 0.968 0 C-N-CA 124.994 1.283 . . . . 0.0 113.378 -175.816 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 50.7 mt -87.58 169.52 12.1 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 118.57 1.185 . . . . 0.0 109.701 178.453 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 42.7 m-85 -112.02 161.53 16.36 Favored 'General case' 0 C--O 1.234 0.284 0 O-C-N 121.454 -0.779 . . . . 0.0 109.062 163.076 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 93.3 t80 -142.63 152.67 42.72 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 126.077 1.751 . . . . 0.0 108.685 -176.384 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -124.15 144.18 44.68 Favored Pre-proline 0 N--CA 1.467 0.38 0 CA-C-N 118.777 0.717 . . . . 0.0 109.892 177.11 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -72.99 -34.25 6.65 Favored 'Trans proline' 0 N--CA 1.456 -0.727 0 C-N-CA 122.263 1.975 . . . . 0.0 114.271 -177.366 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -77.65 -27.59 51.04 Favored 'General case' 0 CA--C 1.517 -0.323 0 CA-C-N 120.043 1.292 . . . . 0.0 112.617 172.791 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -134.08 83.66 2.06 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 106.833 -1.543 . . . . 0.0 106.833 -153.522 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -60.23 -6.77 1.59 Allowed 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 126.167 1.787 . . . . 0.0 114.18 -165.754 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 39.1 m-85 -65.04 123.57 19.82 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 123.956 0.902 . . . . 0.0 110.048 171.766 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 38.8 m-85 -75.44 152.86 37.9 Favored 'General case' 0 N--CA 1.45 -0.451 0 N-CA-C 108.688 -0.856 . . . . 0.0 108.688 174.046 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 9.0 t80 -114.42 109.12 17.83 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 126.099 1.76 . . . . 0.0 106.641 -177.885 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 44.7 t30 -83.62 77.15 9.9 Favored 'General case' 0 N--CA 1.445 -0.688 0 C-N-CA 125.272 1.429 . . . . 0.0 107.357 171.129 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -52.18 -33.14 39.37 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 123.017 0.527 . . . . 0.0 110.32 178.667 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -47.78 -32.04 5.55 Favored 'General case' 0 N--CA 1.448 -0.548 0 C-N-CA 127.663 2.385 . . . . 0.0 114.74 178.069 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 19.9 m -138.36 25.96 2.64 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 123.851 0.86 . . . . 0.0 110.039 170.12 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 24.5 mt-30 52.35 18.44 0.92 Allowed 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 127.503 2.321 . . . . 0.0 114.893 -176.859 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -95.52 159.58 14.92 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 123.638 0.775 . . . . 0.0 110.535 -166.942 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 9.5 m-85 -114.12 127.15 55.78 Favored 'General case' 0 CA--C 1.516 -0.358 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 -169.947 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 53.2 mt -126.53 174.63 8.51 Favored 'General case' 0 C--N 1.324 -0.54 0 C-N-CA 124.415 1.086 . . . . 0.0 108.691 -170.066 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 13.5 p90 -134.59 153.49 51.94 Favored 'General case' 0 N--CA 1.447 -0.608 0 N-CA-C 106.881 -1.526 . . . . 0.0 106.881 162.072 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 46.9 t-105 -78.28 127.69 32.61 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 105.713 -1.958 . . . . 0.0 105.713 164.703 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 19.9 t0 -110.24 108.78 19.02 Favored 'General case' 0 CA--C 1.515 -0.378 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 166.475 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -72.57 -15.39 77.57 Favored Glycine 0 N--CA 1.441 -1.003 0 CA-C-O 116.84 -2.089 . . . . 0.0 112.831 176.266 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -69.87 -56.18 7.76 Favored 'General case' 0 C--N 1.346 0.442 0 CA-C-N 121.021 2.411 . . . . 0.0 107.596 176.667 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 62.3 mtt85 -80.96 -3.97 53.41 Favored 'General case' 0 N--CA 1.456 -0.136 0 C-N-CA 124.047 0.939 . . . . 0.0 113.148 178.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 42.0 mtt180 43.36 58.18 3.52 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 126.982 2.113 . . . . 0.0 109.7 -175.276 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 6.2 t -153.88 157.45 39.29 Favored 'General case' 0 N--CA 1.448 -0.563 0 N-CA-C 107.143 -1.428 . . . . 0.0 107.143 176.759 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 71.7 m-85 -86.88 132.07 33.92 Favored 'General case' 0 C--O 1.237 0.398 0 N-CA-C 106.202 -1.777 . . . . 0.0 106.202 169.662 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -125.8 154.48 73.38 Favored Pre-proline 0 C--N 1.322 -0.627 0 C-N-CA 125.124 1.37 . . . . 0.0 110.391 -176.682 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -72.22 130.3 16.21 Favored 'Trans proline' 0 N--CA 1.454 -0.834 0 C-N-CA 122.523 2.149 . . . . 0.0 110.253 -178.112 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -91.36 14.54 14.31 Favored 'General case' 0 C--O 1.235 0.297 0 N-CA-C 112.992 0.738 . . . . 0.0 112.992 -178.539 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 5.7 mp -71.33 -44.44 65.11 Favored 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 124.869 1.268 . . . . 0.0 112.005 -169.461 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -152.27 -49.74 0.11 Allowed 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 107.302 -1.369 . . . . 0.0 107.302 -165.56 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 61.91 26.85 16.28 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 124.954 1.302 . . . . 0.0 111.273 173.659 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 27.2 m -163.6 96.45 0.84 Allowed 'General case' 0 N--CA 1.453 -0.317 0 N-CA-C 106.456 -1.683 . . . . 0.0 106.456 -177.308 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -156.92 170.23 22.98 Favored 'General case' 0 N--CA 1.448 -0.569 0 N-CA-C 108.04 -1.096 . . . . 0.0 108.04 173.176 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -72.3 -17.96 61.83 Favored 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 124.171 0.988 . . . . 0.0 112.795 -169.175 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 150.0 -15.98 1.04 Allowed Glycine 0 CA--C 1.525 0.692 0 C-N-CA 124.704 1.145 . . . . 0.0 113.068 175.016 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 14.6 m-70 -61.39 -50.35 73.21 Favored 'General case' 0 C--O 1.226 -0.168 0 CA-C-N 118.222 1.011 . . . . 0.0 109.695 165.857 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . 0.305 0.0 OUTLIER 52.28 9.42 0.1 Allowed 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 128.861 2.864 . . . . 0.0 116.34 174.07 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -77.95 -40.79 38.37 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 125.504 1.522 . . . . 0.0 110.652 -173.165 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -157.62 -40.83 0.07 Allowed 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 124.629 1.172 . . . . 0.0 109.328 -177.857 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 174.89 -145.76 8.09 Favored Glycine 0 CA--C 1.524 0.623 0 N-CA-C 111.197 -0.761 . . . . 0.0 111.197 -167.6 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -144.48 165.34 23.67 Favored Pre-proline 0 CA--C 1.538 0.515 0 C-N-CA 125.887 1.675 . . . . 0.0 110.282 -175.208 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 98.9 Cg_endo -69.55 -164.34 0.12 Allowed 'Trans proline' 0 CA--C 1.543 0.946 0 C-N-CA 123.888 3.058 . . . . 0.0 109.824 155.557 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 63.25 8.44 3.39 Favored 'General case' 0 CA--C 1.549 0.918 0 O-C-N 120.415 -1.428 . . . . 0.0 112.543 179.367 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.99 -6.21 51.63 Favored 'General case' 0 N--CA 1.467 0.409 0 O-C-N 120.124 -1.61 . . . . 0.0 112.517 178.188 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 177.11 -46.3 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.131 0 C-N-CA 126.486 1.914 . . . . 0.0 106.12 -168.861 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -78.92 76.41 1.91 Allowed Glycine 0 N--CA 1.447 -0.573 0 C-N-CA 126.268 1.89 . . . . 0.0 110.344 -165.09 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 37.8 mttm 60.84 49.01 6.36 Favored 'General case' 0 N--CA 1.466 0.332 0 C-N-CA 126.288 1.835 . . . . 0.0 110.149 172.878 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.03 -57.19 13.17 Favored 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 127.337 2.255 . . . . 0.0 112.586 166.472 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 46.4 pttt -130.04 12.55 5.66 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 124.023 0.929 . . . . 0.0 113.197 -163.293 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 34.4 mmtp -133.03 93.56 3.21 Favored 'General case' 0 CA--C 1.516 -0.332 0 N-CA-C 106.724 -1.584 . . . . 0.0 106.724 -179.888 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -79.2 10.87 3.2 Favored 'General case' 0 CA--C 1.536 0.433 0 N-CA-C 113.099 0.777 . . . . 0.0 113.099 -176.08 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . 0.256 23.7 pttm 48.34 -153.63 0.09 Allowed 'General case' 0 N--CA 1.474 0.734 0 CA-C-N 119.661 1.119 . . . . 0.0 108.441 -173.784 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -133.1 49.88 2.28 Favored 'General case' 0 CA--C 1.535 0.371 0 O-C-N 120.901 -1.124 . . . . 0.0 108.03 172.575 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.451 ' HG3' ' H ' ' A' ' 91' ' ' THR . 18.3 tptt 49.31 -164.61 0.03 OUTLIER 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 107.884 -1.154 . . . . 0.0 107.884 -142.927 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' THR . . . . . 0.451 ' H ' ' HG3' ' A' ' 90' ' ' LYS . 1.8 m -152.92 111.7 3.75 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 102.144 -3.28 . . . . 0.0 102.144 153.214 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . 0.456 ' HE2' ' C ' ' A' ' 92' ' ' LYS . 0.2 OUTLIER . . . . . 0 C--O 1.245 0.824 0 N-CA-C 103.559 -2.756 . . . . 0.0 103.559 172.787 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.121 0 N-CA-C 108.397 -1.881 . . . . 0.0 108.397 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 30.0 m170 -64.38 -23.45 67.3 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-N 118.813 1.307 . . . . 0.0 110.457 162.453 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 17.5 ptt? -136.26 175.94 9.14 Favored 'General case' 0 C--O 1.243 0.758 0 C-N-CA 127.85 2.46 . . . . 0.0 107.017 170.506 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -151.88 125.48 8.93 Favored 'General case' 0 N--CA 1.453 -0.287 0 N-CA-C 105.812 -1.921 . . . . 0.0 105.812 153.152 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -131.11 -74.39 0.53 Allowed 'General case' 0 C--O 1.237 0.443 0 N-CA-C 105.727 -1.953 . . . . 0.0 105.727 174.56 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.5 t 60.93 30.43 19.62 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 125.213 1.405 . . . . 0.0 110.093 -178.238 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 18.2 p90 -152.15 160.12 43.47 Favored 'General case' 0 N--CA 1.443 -0.782 0 C-N-CA 125.321 1.448 . . . . 0.0 108.255 168.748 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -144.39 -177.49 5.5 Favored 'General case' 0 C--O 1.24 0.557 0 O-C-N 121.742 -0.598 . . . . 0.0 111.326 171.306 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -105.36 -175.58 2.83 Favored 'General case' 0 N--CA 1.443 -0.808 0 C-N-CA 125.018 1.327 . . . . 0.0 108.928 164.117 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 36.6 m-85 -80.09 161.22 66.37 Favored Pre-proline 0 CA--C 1.539 0.52 0 CA-C-O 119.119 -0.467 . . . . 0.0 110.0 -173.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -66.09 169.55 13.37 Favored 'Trans proline' 0 C--N 1.349 0.57 0 C-N-CA 123.78 2.987 . . . . 0.0 109.828 172.803 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 38.8 t -111.94 85.4 6.42 Favored Pre-proline 0 CA--C 1.539 0.547 0 N-CA-C 107.659 -1.237 . . . . 0.0 107.659 177.668 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -72.92 178.38 6.52 Favored 'Trans proline' 0 N--CA 1.457 -0.643 0 C-N-CA 123.669 2.913 . . . . 0.0 111.035 177.285 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -159.3 32.21 0.2 Allowed 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 113.367 0.877 . . . . 0.0 113.367 -177.285 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . 0.373 11.9 p 42.88 23.25 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.553 1.08 0 C-N-CA 128.072 2.549 . . . . 0.0 113.085 -173.805 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 7.5 t -113.51 -12.73 12.88 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 127.795 2.438 . . . . 0.0 109.287 -174.746 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 2.8 p -112.7 1.57 15.73 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 124.516 1.127 . . . . 0.0 111.08 -179.945 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 11.5 m-30 -85.0 173.27 10.65 Favored 'General case' 0 C--N 1.341 0.235 0 C-N-CA 124.597 1.159 . . . . 0.0 111.344 -167.294 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 68.5 mt-30 -119.89 99.1 6.43 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 126.023 1.729 . . . . 0.0 108.541 -174.297 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 87.1 t80 -58.18 143.82 42.83 Favored 'General case' 0 C--N 1.326 -0.422 0 O-C-N 122.302 -0.249 . . . . 0.0 111.012 171.246 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 4.1 t0 -122.64 112.68 18.26 Favored 'General case' 0 CA--C 1.515 -0.379 0 C-N-CA 123.902 0.881 . . . . 0.0 109.802 172.716 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -63.46 -19.36 64.66 Favored 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 124.794 1.238 . . . . 0.0 112.974 176.875 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 3.2 t -59.48 -32.81 70.61 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 123.445 0.698 . . . . 0.0 111.643 176.62 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 66.6 m -132.6 -20.54 2.3 Favored 'General case' 0 N--CA 1.462 0.162 0 C-N-CA 123.953 0.901 . . . . 0.0 112.209 -173.781 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 86.83 10.9 71.6 Favored Glycine 0 CA--C 1.526 0.737 0 C-N-CA 124.084 0.849 . . . . 0.0 111.942 -179.684 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 5.0 m-85 -96.87 168.74 10.3 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-N 118.429 1.115 . . . . 0.0 108.438 -177.313 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 93.8 m-85 -100.94 141.18 34.2 Favored 'General case' 0 N--CA 1.45 -0.44 0 N-CA-C 107.404 -1.332 . . . . 0.0 107.404 171.205 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 39.0 t80 -107.6 139.79 41.59 Favored 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 125.532 1.533 . . . . 0.0 107.634 175.03 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 62.3 t0 -104.1 87.27 1.53 Allowed Pre-proline 0 C--N 1.328 -0.347 0 C-N-CA 126.108 1.763 . . . . 0.0 111.672 -178.734 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -61.5 -12.48 24.61 Favored 'Trans proline' 0 N--CA 1.457 -0.659 0 C-N-CA 122.505 2.137 . . . . 0.0 114.289 176.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 22.4 mm-40 -72.7 -30.12 63.95 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-N 119.205 0.911 . . . . 0.0 110.599 178.65 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 22.0 p -120.54 -50.28 2.21 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 124.657 1.183 . . . . 0.0 109.276 -166.947 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 101.12 46.11 1.77 Allowed Glycine 0 CA--C 1.525 0.709 0 N-CA-C 108.995 -1.642 . . . . 0.0 108.995 -168.68 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 20.9 mt -126.57 171.19 11.31 Favored 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 125.384 1.474 . . . . 0.0 109.295 176.682 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 51.0 m-85 -114.69 164.79 13.56 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 124.69 1.196 . . . . 0.0 108.672 166.18 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 50.3 t80 -145.64 152.11 39.13 Favored 'General case' 0 C--O 1.239 0.518 0 C-N-CA 126.873 2.069 . . . . 0.0 107.576 179.025 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -121.9 143.83 39.54 Favored Pre-proline 0 CA--C 1.535 0.39 0 C-N-CA 123.421 0.689 . . . . 0.0 109.636 175.219 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo -76.33 -25.68 9.62 Favored 'Trans proline' 0 N--CA 1.458 -0.593 0 C-N-CA 121.953 1.768 . . . . 0.0 113.236 -176.093 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 26.8 m-20 -90.9 -21.21 21.51 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 119.538 1.063 . . . . 0.0 112.676 175.262 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 86.4 p -129.26 91.12 3.13 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 123.861 0.864 . . . . 0.0 109.597 179.406 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -56.02 -5.96 0.21 Allowed 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 128.71 2.804 . . . . 0.0 115.63 -171.71 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 54.5 m-85 -68.95 158.47 34.6 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 123.861 0.864 . . . . 0.0 108.851 172.755 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 31.6 m-85 -105.26 133.16 50.48 Favored 'General case' 0 N--CA 1.449 -0.518 0 N-CA-C 108.286 -1.005 . . . . 0.0 108.286 179.788 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 74.6 t80 -90.28 118.18 29.59 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 107.982 -1.118 . . . . 0.0 107.982 175.517 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 20.9 t30 -96.49 86.2 4.09 Favored 'General case' 0 N--CA 1.442 -0.831 0 C-N-CA 126.328 1.851 . . . . 0.0 107.941 179.08 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -50.3 -36.27 31.03 Favored 'General case' 0 N--CA 1.463 0.223 0 C-N-CA 123.957 0.903 . . . . 0.0 111.544 179.584 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 3.8 tt0 -47.19 -37.97 11.15 Favored 'General case' 0 N--CA 1.446 -0.633 0 C-N-CA 127.284 2.234 . . . . 0.0 113.126 -176.764 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 13.6 m -135.79 24.3 3.36 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 124.588 1.155 . . . . 0.0 109.76 176.422 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . 0.364 4.6 pt20 44.65 23.72 0.08 Allowed 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 129.052 2.941 . . . . 0.0 114.403 -175.36 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -92.43 172.18 8.56 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 126.507 1.923 . . . . 0.0 111.361 -171.186 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 4.9 m-85 -118.28 131.55 56.34 Favored 'General case' 0 N--CA 1.45 -0.428 0 N-CA-C 106.965 -1.495 . . . . 0.0 106.965 -177.77 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 48.9 mt -125.92 176.69 6.8 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 126.156 1.782 . . . . 0.0 107.859 -177.063 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 13.9 p90 -139.83 149.35 43.36 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 107.706 -1.22 . . . . 0.0 107.706 168.274 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 39.7 t-105 -78.13 127.19 31.92 Favored 'General case' 0 C--O 1.239 0.506 0 N-CA-C 107.46 -1.311 . . . . 0.0 107.46 172.277 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -120.81 86.88 2.65 Favored 'General case' 0 CA--C 1.512 -0.496 0 CA-C-O 121.631 0.729 . . . . 0.0 109.516 -179.634 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -58.71 -19.33 42.33 Favored Glycine 0 CA--C 1.526 0.778 0 CA-C-O 118.648 -1.085 . . . . 0.0 111.996 175.891 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -59.6 -34.75 73.14 Favored 'General case' 0 C--N 1.342 0.28 0 CA-C-N 118.989 1.395 . . . . 0.0 109.368 176.553 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 21.6 mtt180 -121.77 -1.55 9.44 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 127.232 2.213 . . . . 0.0 111.509 -171.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 60.1 mtt180 44.26 54.39 6.16 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 127.715 2.406 . . . . 0.0 111.489 -171.17 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 10.2 t -148.68 175.56 11.1 Favored 'General case' 0 C--N 1.328 -0.357 0 O-C-N 122.047 -0.408 . . . . 0.0 109.947 175.473 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 87.9 m-85 -98.96 134.78 41.32 Favored 'General case' 0 C--O 1.237 0.405 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 168.149 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -126.44 154.81 75.05 Favored Pre-proline 0 C--N 1.322 -0.627 0 C-N-CA 125.667 1.587 . . . . 0.0 109.359 176.841 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_endo -76.65 122.46 6.43 Favored 'Trans proline' 0 N--CA 1.46 -0.499 0 C-N-CA 123.099 2.533 . . . . 0.0 112.26 -174.276 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -82.64 24.92 0.68 Allowed 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 124.691 1.196 . . . . 0.0 112.999 -178.219 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -57.34 114.43 2.19 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 124.82 1.248 . . . . 0.0 108.215 174.626 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . 0.258 4.9 tp10 64.33 -74.53 0.05 OUTLIER 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 128.31 2.644 . . . . 0.0 111.831 -176.712 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 53.55 32.77 14.87 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 128.17 2.588 . . . . 0.0 113.321 -171.336 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -156.25 -5.24 0.11 Allowed 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 114.955 1.465 . . . . 0.0 114.955 -178.764 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -165.16 179.45 6.32 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 125.05 1.34 . . . . 0.0 109.663 -175.848 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -69.64 -52.18 28.16 Favored 'General case' 0 CA--C 1.534 0.341 0 O-C-N 121.722 -0.612 . . . . 0.0 110.685 -174.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 152.99 -115.92 0.71 Allowed Glycine 0 CA--C 1.527 0.804 0 C-N-CA 124.531 1.063 . . . . 0.0 111.079 173.687 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER 67.93 11.21 8.27 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 128.071 2.548 . . . . 0.0 111.494 -162.981 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 8.7 pttt -165.48 153.99 11.62 Favored 'General case' 0 C--O 1.235 0.302 0 O-C-N 120.359 -1.463 . . . . 0.0 109.186 -173.111 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -84.86 121.35 27.6 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 106.66 -1.607 . . . . 0.0 106.66 160.812 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 3.8 m 46.03 -74.9 0.0 OUTLIER 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 128.167 2.587 . . . . 0.0 115.549 158.761 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -152.89 -75.22 0.01 OUTLIER Glycine 0 N--CA 1.449 -0.493 0 C-N-CA 127.028 2.251 . . . . 0.0 107.99 -173.565 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . 74.95 154.28 0.15 Allowed Pre-proline 0 CA--C 1.548 0.891 0 C-N-CA 129.084 2.954 . . . . 0.0 111.141 -170.151 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 90.8 Cg_endo -86.03 -14.44 5.09 Favored 'Trans proline' 0 C--N 1.351 0.693 0 C-N-CA 124.692 3.594 . . . . 0.0 113.683 178.865 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 1.7 p -61.75 -178.74 0.16 Allowed 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 125.503 1.521 . . . . 0.0 109.526 160.329 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 29.1 tttt 72.36 46.37 0.31 Allowed 'General case' 0 N--CA 1.453 -0.279 0 CA-C-O 123.424 1.583 . . . . 0.0 109.071 168.513 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 73.33 72.12 0.13 Allowed 'General case' 0 CA--C 1.521 -0.168 0 C-N-CA 126.507 1.923 . . . . 0.0 108.15 163.346 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -169.93 -46.84 0.03 OUTLIER Glycine 0 C--N 1.332 0.333 0 CA-C-N 115.725 -0.671 . . . . 0.0 112.273 175.213 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 48.5 tttp -151.86 25.65 0.65 Allowed 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 117.951 0.876 . . . . 0.0 110.567 -173.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.73 -23.33 66.72 Favored 'General case' 0 CA--C 1.551 0.995 0 O-C-N 120.724 -1.235 . . . . 0.0 114.276 -162.504 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -119.5 1.91 11.2 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 127.522 2.329 . . . . 0.0 111.438 166.199 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . 0.304 0.0 OUTLIER 44.0 -168.25 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 127.296 2.238 . . . . 0.0 111.064 -150.431 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -109.99 -85.52 0.54 Allowed 'General case' 0 C--O 1.236 0.361 0 N-CA-C 108.418 -0.956 . . . . 0.0 108.418 -176.647 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -134.45 157.76 45.65 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 119.681 1.128 . . . . 0.0 110.561 177.018 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -82.57 -78.29 0.21 Allowed 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 108.075 -1.083 . . . . 0.0 108.075 172.951 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -157.64 8.34 0.16 Allowed 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 125.46 1.504 . . . . 0.0 111.577 -162.91 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 10.9 m 69.25 90.16 0.1 Allowed 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 125.609 1.563 . . . . 0.0 108.215 -165.082 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.104 0 C-N-CA 127.449 2.3 . . . . 0.0 107.065 172.634 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.72 0 N-CA-C 110.623 -0.991 . . . . 0.0 110.623 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 5.1 t60 75.38 97.92 0.07 Allowed 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 126.269 1.827 . . . . 0.0 110.006 -172.788 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 2.7 tpt 49.44 65.51 1.38 Allowed 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 126.449 1.899 . . . . 0.0 112.138 -178.025 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 68.5 mt-30 -66.58 117.9 9.42 Favored 'General case' 0 CA--C 1.534 0.338 0 O-C-N 121.514 -0.741 . . . . 0.0 109.26 168.307 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -79.36 -80.33 0.12 Allowed 'General case' 0 CA--C 1.532 0.273 0 N-CA-C 107.633 -1.247 . . . . 0.0 107.633 160.443 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 57.9 m 45.4 70.28 0.37 Allowed 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 125.256 1.422 . . . . 0.0 110.821 -163.32 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 3.3 p90 43.96 70.12 0.35 Allowed 'General case' 0 CA--C 1.515 -0.376 0 C-N-CA 127.095 2.158 . . . . 0.0 112.135 159.899 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -141.53 105.91 4.84 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-N 113.11 -1.859 . . . . 0.0 107.246 -173.053 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 1.4 pt20 -152.32 -171.78 4.04 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 126.162 1.785 . . . . 0.0 107.679 168.145 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 32.6 m-85 -88.47 159.36 47.2 Favored Pre-proline 0 CA--C 1.532 0.282 0 O-C-N 120.814 -1.179 . . . . 0.0 109.979 174.438 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 95.5 Cg_endo -67.91 177.7 4.06 Favored 'Trans proline' 0 N--CA 1.454 -0.834 0 C-N-CA 121.782 1.654 . . . . 0.0 109.023 161.282 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 45.7 t -104.71 86.27 1.4 Allowed Pre-proline 0 CA--C 1.537 0.46 0 C-N-CA 124.27 1.028 . . . . 0.0 109.162 -173.093 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_endo -69.62 153.69 69.25 Favored 'Trans proline' 0 N--CA 1.456 -0.694 0 C-N-CA 122.015 1.81 . . . . 0.0 110.386 -178.302 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -136.3 133.17 36.63 Favored 'General case' 0 C--O 1.235 0.305 0 C-N-CA 123.193 0.597 . . . . 0.0 111.808 -176.231 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.409 ' HA ' ' CD2' ' A' ' 18' ' ' TYR . 10.8 p -56.62 -25.95 22.33 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.407 0 C-N-CA 125.382 1.473 . . . . 0.0 113.544 -178.968 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 2.0 t -61.8 -12.3 16.52 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.999 0.919 . . . . 0.0 112.039 174.576 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 37.0 p -113.41 1.06 14.96 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.633 1.173 . . . . 0.0 111.723 -179.648 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . 0.409 ' CD2' ' HA ' ' A' ' 15' ' ' VAL . 15.3 m-30 -79.77 166.56 21.62 Favored 'General case' 0 C--O 1.238 0.499 0 O-C-N 120.858 -1.151 . . . . 0.0 110.159 179.984 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 28.0 mt-30 -105.31 112.55 25.7 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 124.728 1.211 . . . . 0.0 108.573 175.356 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 61.5 t80 -61.34 137.66 58.24 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 108.558 -0.904 . . . . 0.0 108.558 169.86 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 22.2 t0 -117.74 70.44 0.79 Allowed 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 125.932 1.693 . . . . 0.0 109.436 -172.389 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.55 -3.79 1.63 Allowed 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 115.527 1.677 . . . . 0.0 115.527 -169.224 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 1.3 t -65.94 -27.17 67.97 Favored 'General case' 0 C--N 1.315 -0.897 0 C-N-CA 126.659 1.984 . . . . 0.0 111.795 164.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 25.0 p -127.78 -25.83 3.04 Favored 'General case' 0 C--O 1.237 0.419 0 CA-C-N 120.169 1.35 . . . . 0.0 112.464 174.914 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 96.64 9.5 56.39 Favored Glycine 0 CA--C 1.533 1.201 0 CA-C-N 118.737 0.698 . . . . 0.0 112.39 177.206 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 8.3 m-85 -100.58 177.29 5.05 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.774 1.63 . . . . 0.0 109.1 178.119 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 77.9 m-85 -101.59 139.55 37.1 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 106.997 -1.483 . . . . 0.0 106.997 166.698 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 17.4 t80 -101.97 135.62 43.21 Favored 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 125.827 1.651 . . . . 0.0 107.099 172.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -110.55 85.08 4.42 Favored Pre-proline 0 N--CA 1.442 -0.863 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 -171.004 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_endo -61.36 -13.5 29.25 Favored 'Trans proline' 0 C--N 1.348 0.511 0 C-N-CA 122.388 2.059 . . . . 0.0 113.362 -179.919 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 98.6 mm-40 -60.64 -28.96 68.95 Favored 'General case' 0 N--CA 1.448 -0.567 0 C-N-CA 124.877 1.271 . . . . 0.0 111.423 178.697 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 12.6 p -145.96 -18.17 0.45 Allowed 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 113.664 0.987 . . . . 0.0 113.664 -176.745 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 99.53 7.57 53.71 Favored Glycine 0 CA--C 1.531 1.059 0 CA-C-N 119.446 1.021 . . . . 0.0 114.065 179.23 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 40.0 mt -85.69 179.51 7.07 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 124.847 1.259 . . . . 0.0 109.612 175.249 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 25.0 m-85 -118.91 159.79 23.14 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 124.329 1.052 . . . . 0.0 109.35 162.815 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 71.1 t80 -127.19 165.68 19.15 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 128.402 2.681 . . . . 0.0 109.128 173.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 6.1 t0 -137.77 144.1 42.97 Favored Pre-proline 0 N--CA 1.465 0.283 0 O-C-N 120.735 -1.228 . . . . 0.0 108.294 177.829 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 68.9 Cg_endo -71.62 -30.49 14.69 Favored 'Trans proline' 0 N--CA 1.454 -0.808 0 C-N-CA 121.354 1.37 . . . . 0.0 113.422 -175.281 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 77.2 m-20 -87.77 -28.53 21.65 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 125.139 1.375 . . . . 0.0 110.483 175.411 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' SER . . . . . 0.455 ' C ' ' H ' ' A' ' 42' ' ' TYR . 1.6 m -117.76 95.47 4.94 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 123.775 0.83 . . . . 0.0 109.572 -176.084 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 20.4 mp0 -62.18 -2.79 1.05 Allowed 'General case' 0 CA--C 1.547 0.843 0 O-C-N 121.387 -0.821 . . . . 0.0 111.758 166.676 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . 0.455 ' H ' ' C ' ' A' ' 40' ' ' SER . 17.8 m-85 -70.57 98.87 1.55 Allowed 'General case' 0 N--CA 1.444 -0.736 0 C-N-CA 125.39 1.476 . . . . 0.0 107.538 162.736 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 34.3 m-85 -59.27 153.85 17.73 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 125.204 1.402 . . . . 0.0 110.072 175.418 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 76.8 t80 -110.19 113.45 26.14 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 125.011 1.324 . . . . 0.0 108.514 177.826 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 38.7 t30 -87.45 81.58 7.77 Favored 'General case' 0 N--CA 1.445 -0.695 0 C-N-CA 125.22 1.408 . . . . 0.0 108.888 177.553 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -44.9 -38.46 4.66 Favored 'General case' 0 C--N 1.341 0.202 0 C-N-CA 124.273 1.029 . . . . 0.0 111.723 176.07 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 4.4 tt0 -44.41 -38.85 4.29 Favored 'General case' 0 N--CA 1.446 -0.626 0 C-N-CA 127.843 2.457 . . . . 0.0 113.054 -177.376 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 70.8 m -136.61 16.17 3.13 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 124.305 1.042 . . . . 0.0 111.726 176.852 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 25.7 mt-30 58.77 14.89 3.44 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 126.855 2.062 . . . . 0.0 113.494 -173.297 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 41.2 mm-40 -77.31 167.06 22.34 Favored 'General case' 0 C--N 1.334 -0.07 0 O-C-N 121.139 -0.976 . . . . 0.0 111.459 -177.209 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 37.0 m-85 -114.27 132.8 56.02 Favored 'General case' 0 C--O 1.236 0.347 0 C-N-CA 124.145 0.978 . . . . 0.0 109.97 172.141 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 66.6 mt -129.81 179.91 5.57 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 126.55 1.94 . . . . 0.0 108.801 -173.609 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 23.6 p90 -144.64 157.98 43.97 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 124.012 0.925 . . . . 0.0 109.685 165.425 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 54.5 t-105 -89.18 125.49 35.08 Favored 'General case' 0 C--O 1.237 0.434 0 N-CA-C 107.121 -1.437 . . . . 0.0 107.121 170.276 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -120.99 108.69 14.18 Favored 'General case' 0 CA--C 1.516 -0.328 0 CA-C-O 121.304 0.573 . . . . 0.0 110.578 177.557 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -72.6 -1.75 53.84 Favored Glycine 0 CA--C 1.526 0.723 0 CA-C-O 117.99 -1.45 . . . . 0.0 114.294 -172.792 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 2.9 pt-20 -76.23 -54.49 6.72 Favored 'General case' 0 C--N 1.339 0.138 0 CA-C-N 120.072 1.936 . . . . 0.0 110.255 171.511 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 13.0 mtt180 -88.42 -8.11 55.51 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 124.17 0.988 . . . . 0.0 110.567 -177.856 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 3.3 mpt_? 44.88 59.46 3.41 Favored 'General case' 0 C--N 1.342 0.263 0 C-N-CA 125.988 1.715 . . . . 0.0 109.321 -174.326 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 8.4 t -148.88 179.49 7.81 Favored 'General case' 0 C--O 1.238 0.457 0 N-CA-C 108.766 -0.828 . . . . 0.0 108.766 175.917 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 72.0 m-85 -104.32 132.29 50.74 Favored 'General case' 0 C--O 1.241 0.641 0 C-N-CA 123.878 0.871 . . . . 0.0 109.656 172.853 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -127.57 154.96 77.62 Favored Pre-proline 0 C--N 1.326 -0.421 0 C-N-CA 126.638 1.975 . . . . 0.0 110.631 -178.671 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_endo -70.12 131.18 20.2 Favored 'Trans proline' 0 CA--C 1.534 0.5 0 C-N-CA 123.321 2.681 . . . . 0.0 111.732 174.483 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -95.87 63.97 2.4 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 124.729 1.211 . . . . 0.0 108.981 178.693 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 90.7 mt -125.75 97.68 5.24 Favored 'General case' 0 CA--C 1.519 -0.242 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 -166.395 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 75.21 -14.35 0.77 Allowed 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 127.219 2.208 . . . . 0.0 113.112 -171.093 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 4.0 tm0? -45.1 120.04 2.25 Favored 'General case' 0 C--O 1.238 0.487 0 C-N-CA 125.622 1.569 . . . . 0.0 109.382 165.268 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 4.1 m -177.01 108.68 0.07 Allowed 'General case' 0 N--CA 1.447 -0.585 0 C-N-CA 129.012 2.925 . . . . 0.0 106.388 179.519 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 58.02 -174.78 0.08 Allowed 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 126.1 1.76 . . . . 0.0 113.923 176.807 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -106.66 116.81 32.58 Favored 'General case' 0 C--O 1.239 0.533 0 C-N-CA 125.492 1.517 . . . . 0.0 107.727 -166.93 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -140.95 20.73 2.68 Favored Glycine 0 CA--C 1.538 1.525 0 C-N-CA 126.472 1.987 . . . . 0.0 112.894 -178.826 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 9.2 t-160 51.56 52.53 14.49 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 127.959 2.503 . . . . 0.0 112.069 179.602 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 40.5 mtmt -135.63 151.8 50.6 Favored 'General case' 0 C--O 1.234 0.252 0 C-N-CA 124.667 1.187 . . . . 0.0 108.402 177.587 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -72.12 73.14 0.91 Allowed 'General case' 0 C--O 1.233 0.212 0 N-CA-C 107.846 -1.168 . . . . 0.0 107.846 171.303 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 77.2 m 72.64 -46.51 0.65 Allowed 'General case' 0 CA--C 1.536 0.418 0 O-C-N 120.861 -1.15 . . . . 0.0 112.314 172.804 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 166.81 46.86 0.02 OUTLIER Glycine 0 N--CA 1.444 -0.809 0 O-C-N 121.311 -0.868 . . . . 0.0 111.68 -153.222 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -116.63 69.11 4.27 Favored Pre-proline 0 CA--C 1.541 0.628 0 CA-C-N 117.93 0.865 . . . . 0.0 111.093 172.07 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 64.9 Cg_endo -74.03 -4.04 14.76 Favored 'Trans proline' 0 CA--C 1.541 0.86 1 C-N-CA 125.478 4.119 . . . . 0.0 114.815 -175.743 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 70.1 m 50.73 28.69 3.73 Favored 'General case' 0 CA--C 1.544 0.725 0 N-CA-C 116.656 2.095 . . . . 0.0 116.656 165.755 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 1.3 mtpt -127.93 28.88 5.51 Favored 'General case' 0 N--CA 1.473 0.678 0 O-C-N 121.058 -1.026 . . . . 0.0 111.068 170.031 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 12.6 tp10 -124.13 15.98 9.16 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.56 1.144 . . . . 0.0 110.779 174.072 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 82.32 -0.31 89.07 Favored Glycine 0 CA--C 1.529 0.946 0 O-C-N 120.888 -1.132 . . . . 0.0 113.853 170.358 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 9.3 ptmt -98.16 11.17 38.62 Favored 'General case' 0 C--O 1.222 -0.382 0 CA-C-N 119.428 1.614 . . . . 0.0 110.254 168.534 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -52.13 -13.8 0.36 Allowed 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 129.816 3.246 . . . . 0.0 115.298 174.928 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 44.8 pttt -114.86 3.5 14.63 Favored 'General case' 0 C--O 1.233 0.232 0 C-N-CA 125.805 1.642 . . . . 0.0 111.117 -178.333 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 40.2 pttt -148.26 33.98 0.81 Allowed 'General case' 0 N--CA 1.453 -0.307 0 CA-C-O 117.622 -1.18 . . . . 0.0 112.853 -170.032 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -44.26 -58.57 2.82 Favored 'General case' 0 C--O 1.233 0.236 0 C-N-CA 125.149 1.379 . . . . 0.0 111.416 -171.926 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -73.82 -76.88 0.12 Allowed 'General case' 0 C--N 1.343 0.309 0 CA-C-N 119.42 1.009 . . . . 0.0 109.977 173.03 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 23.6 t-80 -152.95 33.44 0.48 Allowed 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 123.766 0.826 . . . . 0.0 110.74 -175.011 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 3.6 ttpm? 60.55 21.96 11.72 Favored 'General case' 0 N--CA 1.474 0.749 0 O-C-N 120.662 -1.274 . . . . 0.0 110.86 -172.901 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -66.98 164.86 16.76 Favored 'General case' 0 N--CA 1.448 -0.548 0 C-N-CA 124.914 1.286 . . . . 0.0 109.964 -176.179 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 38.7 mttp . . . . . 0 C--O 1.252 1.197 0 N-CA-C 104.252 -2.499 . . . . 0.0 104.252 161.418 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.901 0 N-CA-C 109.092 -1.603 . . . . 0.0 109.092 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 53.8 m170 -74.31 152.6 39.6 Favored 'General case' 0 C--O 1.241 0.615 0 CA-C-N 119.04 1.42 . . . . 0.0 108.391 161.895 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -123.99 163.81 20.63 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 125.63 1.572 . . . . 0.0 109.113 -178.269 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 12.4 mt-30 -141.59 -61.64 0.47 Allowed 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 125.773 1.629 . . . . 0.0 107.49 168.548 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 4.8 pt-20 -98.34 -27.3 14.17 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 123.84 0.856 . . . . 0.0 111.577 -169.637 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 20.2 m 44.34 70.75 0.3 Allowed 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 126.451 1.9 . . . . 0.0 112.295 -176.061 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -105.33 152.92 22.32 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-O 121.642 0.734 . . . . 0.0 109.535 169.641 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 5.4 t -166.57 -167.22 0.96 Allowed 'General case' 0 N--CA 1.447 -0.606 0 C-N-CA 124.184 0.993 . . . . 0.0 108.666 -172.527 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 88.4 mt-30 -67.56 164.92 17.95 Favored 'General case' 0 N--CA 1.447 -0.59 0 CA-C-O 121.941 0.877 . . . . 0.0 110.607 167.159 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 18.4 m-85 -94.22 163.03 24.57 Favored Pre-proline 0 CA--C 1.543 0.68 0 C-N-CA 126.511 1.924 . . . . 0.0 110.161 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 79.0 Cg_endo -73.53 -174.31 1.61 Allowed 'Trans proline' 0 CA--C 1.539 0.726 0 C-N-CA 123.989 3.126 . . . . 0.0 111.619 176.396 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 21.2 t -106.93 86.54 2.43 Favored Pre-proline 0 CA--C 1.532 0.276 0 C-N-CA 125.56 1.544 . . . . 0.0 108.452 176.589 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 91.7 Cg_endo -66.66 159.06 52.81 Favored 'Trans proline' 0 N--CA 1.457 -0.67 0 C-N-CA 122.161 1.907 . . . . 0.0 109.335 173.754 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.2 t0 -131.02 134.3 46.56 Favored 'General case' 0 C--O 1.234 0.249 0 N-CA-C 108.333 -0.988 . . . . 0.0 108.333 171.133 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.475 ' HA ' ' CD2' ' A' ' 18' ' ' TYR . 2.9 p -57.02 -25.18 22.0 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.472 0 C-N-CA 123.999 0.92 . . . . 0.0 111.864 178.002 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 56.6 m -59.08 -20.04 49.74 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 119.305 0.957 . . . . 0.0 113.51 173.222 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 12.2 p -119.07 16.33 13.28 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 119.805 1.184 . . . . 0.0 111.914 -176.761 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . 0.475 ' CD2' ' HA ' ' A' ' 15' ' ' VAL . 20.2 m-30 -71.89 159.57 34.05 Favored 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 160.614 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 26.4 mt-30 -111.12 114.6 27.98 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 125.787 1.635 . . . . 0.0 111.788 177.479 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 49.5 t80 -67.08 156.76 35.27 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 120.618 1.554 . . . . 0.0 113.341 -177.654 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -129.47 102.98 6.63 Favored 'General case' 0 C--N 1.342 0.273 0 N-CA-C 107.561 -1.274 . . . . 0.0 107.561 166.075 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -52.75 -29.89 29.72 Favored 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 124.795 1.238 . . . . 0.0 112.063 171.368 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 1.4 t -67.1 -20.73 65.83 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-O 117.899 -1.048 . . . . 0.0 111.987 -174.461 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 72.9 m -136.0 -9.79 2.04 Favored 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 113.795 1.035 . . . . 0.0 113.795 177.505 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 81.54 6.3 89.27 Favored Glycine 0 CA--C 1.526 0.721 0 C-N-CA 124.469 1.033 . . . . 0.0 114.007 169.243 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 5.3 m-85 -97.97 169.26 9.76 Favored 'General case' 0 C--O 1.238 0.485 0 CA-C-N 118.328 1.064 . . . . 0.0 108.746 174.819 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 56.5 m-85 -104.04 140.26 38.0 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 125.799 1.639 . . . . 0.0 108.33 175.379 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 41.6 t80 -107.58 142.42 37.53 Favored 'General case' 0 CA--C 1.512 -0.497 0 N-CA-C 107.386 -1.339 . . . . 0.0 107.386 179.666 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 11.8 m-20 -117.4 78.02 10.64 Favored Pre-proline 0 N--CA 1.441 -0.913 0 N-CA-C 107.71 -1.219 . . . . 0.0 107.71 -160.753 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 22.3 Cg_endo -64.57 -4.69 8.74 Favored 'Trans proline' 0 C--N 1.348 0.513 0 C-N-CA 124.044 3.163 . . . . 0.0 113.989 -173.706 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 99.6 mm-40 -71.89 -24.37 61.64 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-O 118.823 -0.608 . . . . 0.0 111.008 172.421 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 1.1 p -143.57 -15.9 0.64 Allowed 'General case' 0 CA--C 1.532 0.274 0 N-CA-C 114.747 1.388 . . . . 0.0 114.747 -176.061 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 89.69 12.25 62.76 Favored Glycine 0 CA--C 1.531 1.043 0 CA-C-N 119.848 1.204 . . . . 0.0 113.563 -176.198 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 55.0 mt -88.83 178.83 6.34 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.574 1.149 . . . . 0.0 109.256 178.253 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 39.3 m-85 -124.19 149.74 46.0 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 123.577 0.751 . . . . 0.0 109.164 163.583 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 41.0 t80 -118.39 150.26 39.85 Favored 'General case' 0 C--O 1.24 0.56 0 C-N-CA 126.822 2.049 . . . . 0.0 109.628 178.0 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -116.85 143.54 31.69 Favored Pre-proline 0 CA--C 1.537 0.477 0 C-N-CA 123.444 0.698 . . . . 0.0 109.516 171.784 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_endo -81.51 -22.43 5.61 Favored 'Trans proline' 0 N--CA 1.458 -0.617 0 C-N-CA 122.509 2.139 . . . . 0.0 114.922 -174.098 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 56.5 m-80 -77.38 -40.66 42.99 Favored 'General case' 0 N--CA 1.445 -0.681 0 O-C-N 120.915 -1.116 . . . . 0.0 108.675 164.406 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' SER . . . . . 0.423 ' C ' ' H ' ' A' ' 42' ' ' TYR . 38.5 m -124.54 95.61 4.59 Favored 'General case' 0 N--CA 1.452 -0.375 0 CA-C-O 122.028 0.918 . . . . 0.0 110.536 -156.965 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 20.2 mp0 -62.55 3.62 0.2 Allowed 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 125.758 1.623 . . . . 0.0 113.871 -174.388 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . 0.423 ' H ' ' C ' ' A' ' 40' ' ' SER . 19.0 m-85 -79.41 98.63 6.84 Favored 'General case' 0 N--CA 1.438 -1.034 0 C-N-CA 125.333 1.453 . . . . 0.0 108.17 -179.604 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 48.6 m-85 -59.17 120.25 8.84 Favored 'General case' 0 N--CA 1.445 -0.7 0 C-N-CA 125.706 1.603 . . . . 0.0 109.014 177.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 79.5 t80 -78.65 138.52 38.35 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 124.242 1.017 . . . . 0.0 108.385 176.77 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 24.4 t30 -116.65 85.79 2.38 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 127.033 2.133 . . . . 0.0 107.256 175.025 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -45.41 -40.26 7.93 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 127.65 2.38 . . . . 0.0 111.736 178.004 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -44.63 -41.74 6.88 Favored 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 127.397 2.279 . . . . 0.0 112.704 179.823 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 4.0 m -129.87 14.21 5.82 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 125.495 1.518 . . . . 0.0 109.774 -176.723 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . 0.411 4.5 pt20 44.38 30.64 0.49 Allowed 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 128.732 2.813 . . . . 0.0 113.989 -172.745 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -90.77 162.83 14.69 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 127.402 2.281 . . . . 0.0 110.633 -169.435 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 3.4 m-85 -110.44 131.8 54.74 Favored 'General case' 0 C--O 1.233 0.234 0 C-N-CA 124.558 1.143 . . . . 0.0 108.991 174.019 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 60.7 mt -128.67 178.08 6.58 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 126.91 2.084 . . . . 0.0 108.218 -178.129 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 9.6 p90 -138.03 148.38 45.05 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 106.807 -1.553 . . . . 0.0 106.807 166.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 43.8 t-105 -71.96 136.92 46.97 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 105.42 -2.067 . . . . 0.0 105.42 162.412 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -131.07 95.85 3.9 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 178.403 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -71.25 -5.5 59.26 Favored Glycine 0 CA--C 1.528 0.851 0 CA-C-O 118.722 -1.043 . . . . 0.0 112.538 -178.373 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -71.9 -58.77 3.17 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 119.496 1.648 . . . . 0.0 107.096 173.182 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 75.6 mtt-85 -80.36 -18.54 48.74 Favored 'General case' 0 C--O 1.232 0.173 0 C-N-CA 125.381 1.472 . . . . 0.0 112.636 -179.804 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 97.6 mtt180 55.93 58.84 4.12 Favored 'General case' 0 C--O 1.234 0.239 0 C-N-CA 127.094 2.157 . . . . 0.0 109.457 -173.912 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 6.2 t -155.22 -177.69 6.72 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 125.195 1.398 . . . . 0.0 108.55 175.045 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 76.0 m-85 -112.61 129.9 56.22 Favored 'General case' 0 C--O 1.238 0.477 0 C-N-CA 124.321 1.048 . . . . 0.0 108.791 172.462 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -126.29 154.74 74.66 Favored Pre-proline 0 C--N 1.326 -0.441 0 C-N-CA 126.4 1.88 . . . . 0.0 110.499 -171.53 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_endo -75.28 124.84 8.74 Favored 'Trans proline' 0 C--N 1.348 0.506 0 C-N-CA 122.927 2.418 . . . . 0.0 111.204 -178.299 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -85.97 14.59 5.92 Favored 'General case' 0 N--CA 1.467 0.411 0 N-CA-C 115.896 1.813 . . . . 0.0 115.896 -167.18 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 6.6 mp -82.35 -85.3 0.11 Allowed 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 108.817 -0.808 . . . . 0.0 108.817 -168.53 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 16.3 mt-10 -66.59 -45.75 78.22 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 118.289 0.495 . . . . 0.0 110.612 177.316 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 68.9 mt-30 48.58 36.22 7.24 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 123.77 0.828 . . . . 0.0 110.523 -166.327 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 1.4 t -169.18 49.02 0.04 OUTLIER 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 126.571 1.948 . . . . 0.0 107.815 -179.009 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -131.55 148.51 52.63 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 126.074 1.749 . . . . 0.0 110.584 -173.709 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -67.73 -47.51 69.09 Favored 'General case' 0 CA--C 1.529 0.137 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.973 174.497 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -125.08 -166.14 12.29 Favored Glycine 0 CA--C 1.522 0.478 0 C-N-CA 125.669 1.604 . . . . 0.0 110.228 -174.849 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -58.56 -59.22 5.73 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.028 0.931 . . . . 0.0 111.943 -175.897 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 99.5 mttt 49.53 -171.35 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 126.034 1.734 . . . . 0.0 112.009 -169.286 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 87.6 mt-10 -134.45 -176.76 4.32 Favored 'General case' 0 C--O 1.236 0.355 0 N-CA-C 107.438 -1.319 . . . . 0.0 107.438 172.626 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.52 -38.8 75.25 Favored 'General case' 0 CA--C 1.533 0.323 0 O-C-N 121.397 -0.814 . . . . 0.0 111.458 -178.44 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -153.48 -73.85 0.01 OUTLIER Glycine 0 N--CA 1.446 -0.692 0 N-CA-C 108.623 -1.791 . . . . 0.0 108.623 -179.716 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . 58.62 165.14 0.08 OUTLIER Pre-proline 0 CA--C 1.545 0.779 0 C-N-CA 127.193 2.197 . . . . 0.0 112.493 -171.886 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_endo -73.26 118.5 5.55 Favored 'Trans proline' 0 N--CA 1.458 -0.575 0 C-N-CA 121.48 1.453 . . . . 0.0 108.707 172.346 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 62.5 m 44.69 72.43 0.2 Allowed 'General case' 0 C--O 1.235 0.331 0 C-N-CA 125.23 1.412 . . . . 0.0 112.306 177.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 18.3 tptt -140.65 -12.57 1.0 Allowed 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 112.678 0.622 . . . . 0.0 112.678 176.377 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 3.0 pm0 -66.13 -4.56 7.69 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 124.196 0.999 . . . . 0.0 113.571 -178.011 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 95.29 -16.45 61.27 Favored Glycine 0 CA--C 1.531 1.062 0 O-C-N 120.373 -1.454 . . . . 0.0 112.894 -177.574 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 20.6 mmtp -77.86 5.28 9.93 Favored 'General case' 0 CA--C 1.531 0.24 0 O-C-N 120.699 -1.471 . . . . 0.0 110.255 158.076 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.484 ' HG3' ' H ' ' A' ' 85' ' ' LYS . 1.6 pt-20 -44.18 -57.32 3.5 Favored 'General case' 0 C--O 1.234 0.245 0 C-N-CA 127.745 2.418 . . . . 0.0 112.075 -160.518 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . 0.484 ' H ' ' HG3' ' A' ' 84' ' ' GLU . 11.8 pttt -123.57 32.37 5.64 Favored 'General case' 0 N--CA 1.45 -0.425 0 C-N-CA 127.694 2.398 . . . . 0.0 109.319 -178.308 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 18.6 pttt 53.66 -163.04 0.11 Allowed 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 124.738 1.215 . . . . 0.0 112.156 -172.245 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 44.78 67.03 0.76 Allowed 'General case' 0 C--O 1.239 0.541 0 C-N-CA 128.045 2.538 . . . . 0.0 112.473 175.927 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 16.6 mtpt -65.87 132.22 48.13 Favored 'General case' 0 C--O 1.238 0.498 0 N-CA-C 108.273 -1.01 . . . . 0.0 108.273 166.823 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -145.56 -176.15 5.01 Favored 'General case' 0 C--N 1.323 -0.562 0 C-N-CA 126.016 1.726 . . . . 0.0 108.104 174.982 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 6.9 tttm -77.2 -167.17 0.84 Allowed 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 119.068 0.849 . . . . 0.0 110.931 -178.031 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 11.8 t -156.26 149.68 24.6 Favored 'General case' 0 C--O 1.238 0.459 0 N-CA-C 107.092 -1.447 . . . . 0.0 107.092 177.116 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 21.7 ttpt . . . . . 0 C--O 1.251 1.142 0 C-N-CA 125.913 1.685 . . . . 0.0 111.186 -176.721 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.603 0 N-CA-C 109.357 -1.497 . . . . 0.0 109.357 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 49.7 m-70 74.3 146.34 0.08 Allowed 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 127.676 2.39 . . . . 0.0 110.251 -176.942 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 77.2 mtp -149.79 -153.57 0.5 Allowed 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 123.538 0.735 . . . . 0.0 109.592 -170.334 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 20.0 pt20 -137.42 -178.04 5.05 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 129.093 2.957 . . . . 0.0 107.772 -176.365 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -78.01 -21.96 50.0 Favored 'General case' 0 CA--C 1.541 0.609 0 O-C-N 121.035 -1.041 . . . . 0.0 111.359 173.528 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.7 m 53.47 18.46 1.38 Allowed 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 124.346 1.058 . . . . 0.0 112.75 -161.225 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 45.6 t80 73.51 116.56 0.05 Allowed 'General case' 0 N--CA 1.446 -0.669 0 C-N-CA 129.797 3.239 . . . . 0.0 112.518 170.16 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 57.2 m -147.03 26.37 1.1 Allowed 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 115.296 -0.865 . . . . 0.0 113.089 -167.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 83.0 mt-30 -141.52 -178.48 5.65 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 125.371 1.468 . . . . 0.0 109.264 172.647 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 33.7 m-85 -131.21 166.05 30.66 Favored Pre-proline 0 CA--C 1.538 0.509 0 C-N-CA 127.066 2.146 . . . . 0.0 109.596 -175.489 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_endo -65.68 -171.4 0.21 Allowed 'Trans proline' 0 CA--C 1.537 0.646 0 C-N-CA 122.695 2.263 . . . . 0.0 110.339 164.031 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 61.7 t -104.92 87.29 1.79 Allowed Pre-proline 0 C--N 1.329 -0.304 0 N-CA-C 106.646 -1.612 . . . . 0.0 106.646 171.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 96.8 Cg_endo -64.15 156.23 60.41 Favored 'Trans proline' 0 N--CA 1.451 -1.005 0 C-N-CA 122.226 1.951 . . . . 0.0 110.05 -177.547 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -135.12 129.29 33.67 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 123.898 0.879 . . . . 0.0 109.064 177.926 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 9.1 p -63.94 -26.44 40.56 Favored 'Isoleucine or valine' 0 C--O 1.234 0.266 0 C-N-CA 124.586 1.154 . . . . 0.0 111.531 178.758 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 41.5 m -69.6 1.77 3.82 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 119.908 1.231 . . . . 0.0 112.726 -178.103 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 7.0 t -125.9 11.0 7.7 Favored 'General case' 0 CA--C 1.545 0.777 0 O-C-N 120.899 -1.125 . . . . 0.0 111.773 169.757 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 15.0 m-30 -70.02 159.48 33.73 Favored 'General case' 0 C--O 1.24 0.581 0 O-C-N 120.525 -1.359 . . . . 0.0 111.694 172.346 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 54.6 mt-30 -82.59 135.07 35.16 Favored 'General case' 0 C--O 1.225 -0.234 0 N-CA-C 107.1 -1.444 . . . . 0.0 107.1 167.292 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 45.7 t80 -75.81 164.57 26.1 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 118.796 0.726 . . . . 0.0 109.145 160.246 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -143.04 108.82 5.13 Favored 'General case' 0 CA--C 1.51 -0.596 0 N-CA-C 108.868 -0.79 . . . . 0.0 108.868 159.696 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -59.72 -19.81 52.4 Favored 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 113.154 0.798 . . . . 0.0 113.154 174.628 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 1.4 t -55.29 -35.61 65.25 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 123.59 0.756 . . . . 0.0 110.694 -179.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 15.8 m -114.21 -28.06 7.42 Favored 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 125.147 1.379 . . . . 0.0 110.663 173.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 87.19 25.09 34.89 Favored Glycine 0 CA--C 1.528 0.898 0 N-CA-C 110.318 -1.113 . . . . 0.0 110.318 -173.432 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 6.7 m-85 -117.97 175.25 5.76 Favored 'General case' 0 C--O 1.232 0.176 0 C-N-CA 126.103 1.761 . . . . 0.0 107.776 -170.807 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -110.4 151.19 27.78 Favored 'General case' 0 CA--C 1.521 -0.157 0 N-CA-C 109.084 -0.71 . . . . 0.0 109.084 172.77 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 44.7 t80 -118.81 137.84 53.11 Favored 'General case' 0 N--CA 1.446 -0.633 0 C-N-CA 127.612 2.365 . . . . 0.0 107.79 179.761 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 37.3 t0 -106.95 86.22 2.29 Favored Pre-proline 0 C--N 1.33 -0.268 0 C-N-CA 126.129 1.772 . . . . 0.0 111.28 -175.612 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 22.9 Cg_endo -60.81 -14.25 31.13 Favored 'Trans proline' 0 CA--C 1.537 0.664 0 C-N-CA 121.903 1.735 . . . . 0.0 113.798 177.918 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 4.7 tt0 -67.81 -16.33 64.06 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 119.399 0.999 . . . . 0.0 111.276 176.731 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 40.1 p -131.48 -63.12 0.85 Allowed 'General case' 0 N--CA 1.447 -0.612 0 C-N-CA 125.271 1.428 . . . . 0.0 107.896 177.351 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 124.5 12.61 4.12 Favored Glycine 0 CA--C 1.531 1.05 0 C-N-CA 127.041 2.258 . . . . 0.0 112.025 -167.65 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 32.0 mt -87.22 175.59 7.97 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 126.119 1.768 . . . . 0.0 109.85 176.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 42.7 m-85 -117.42 167.41 11.29 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 125.097 1.359 . . . . 0.0 109.617 166.775 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 31.3 t80 -144.66 156.27 44.02 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 128.158 2.583 . . . . 0.0 108.345 -179.565 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 42.6 t0 -126.17 142.33 42.34 Favored Pre-proline 0 N--CA 1.473 0.722 0 N-CA-C 107.716 -1.216 . . . . 0.0 107.716 175.287 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 41.5 Cg_endo -73.15 -38.9 2.45 Favored 'Trans proline' 0 C--N 1.345 0.391 0 CA-C-N 120.952 1.376 . . . . 0.0 112.826 -176.15 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 30.5 m-20 -75.69 -25.66 56.91 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-O 118.533 -0.746 . . . . 0.0 111.383 -178.416 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 67.2 m -131.73 94.38 3.5 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 125.809 1.643 . . . . 0.0 109.434 -174.715 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 12.1 mp0 -59.43 -3.12 0.39 Allowed 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.974 1.31 . . . . 0.0 114.163 -178.119 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 68.4 m-85 -61.25 111.07 1.59 Allowed 'General case' 0 N--CA 1.446 -0.632 0 CA-C-N 119.189 0.904 . . . . 0.0 108.887 171.934 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 30.4 m-85 -62.1 153.63 29.38 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 123.519 0.727 . . . . 0.0 109.45 174.744 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 68.8 t80 -119.69 117.55 28.56 Favored 'General case' 0 N--CA 1.443 -0.811 0 CA-C-O 122.476 1.131 . . . . 0.0 108.802 -179.325 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 21.2 t30 -95.95 89.7 5.32 Favored 'General case' 0 N--CA 1.442 -0.863 0 C-N-CA 125.715 1.606 . . . . 0.0 107.354 175.252 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -48.1 -42.24 28.4 Favored 'General case' 0 CA--C 1.529 0.157 0 C-N-CA 124.838 1.255 . . . . 0.0 112.169 174.819 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -44.49 -48.64 10.11 Favored 'General case' 0 N--CA 1.448 -0.572 0 C-N-CA 126.213 1.805 . . . . 0.0 112.232 -175.621 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -118.43 12.78 13.39 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 125.207 1.403 . . . . 0.0 110.507 -177.052 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 31.2 mt-30 44.24 45.72 7.23 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 128.646 2.778 . . . . 0.0 112.755 -175.925 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -117.24 143.65 45.66 Favored 'General case' 0 N--CA 1.448 -0.557 0 C-N-CA 125.483 1.513 . . . . 0.0 110.233 -171.504 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 58.3 m-85 -101.73 132.29 47.53 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 123.441 0.696 . . . . 0.0 111.704 176.432 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.1 mt -135.87 -177.89 4.89 Favored 'General case' 0 C--N 1.323 -0.555 0 C-N-CA 126.779 2.031 . . . . 0.0 108.739 -165.414 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 25.7 p90 -135.02 164.76 26.91 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 124.179 0.992 . . . . 0.0 109.219 173.182 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 21.4 t-105 -109.23 137.82 46.53 Favored 'General case' 0 CA--C 1.504 -0.794 0 C-N-CA 125.955 1.702 . . . . 0.0 108.501 172.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 22.7 p-10 -133.56 77.29 1.71 Allowed 'General case' 0 N--CA 1.42 -1.958 0 C-N-CA 126.822 2.049 . . . . 0.0 107.208 -171.163 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -61.03 1.09 0.91 Allowed Glycine 0 CA--C 1.53 1.018 0 C-N-CA 125.025 1.298 . . . . 0.0 114.538 179.288 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 14.9 mt-10 -69.72 -63.32 1.1 Allowed 'General case' 0 N--CA 1.444 -0.754 0 N-CA-C 106.552 -1.647 . . . . 0.0 106.552 171.789 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 82.4 mtt180 -72.91 -23.15 60.67 Favored 'General case' 0 C--O 1.226 -0.146 0 C-N-CA 127.157 2.183 . . . . 0.0 111.323 173.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 52.9 mtt85 56.24 69.83 0.7 Allowed 'General case' 0 C--O 1.232 0.151 0 C-N-CA 126.295 1.838 . . . . 0.0 109.456 -162.861 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 6.8 t -144.24 -175.11 4.49 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 118.385 0.539 . . . . 0.0 110.194 170.165 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 91.3 m-85 -120.54 129.1 53.66 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 107.101 -1.444 . . . . 0.0 107.101 164.351 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -126.22 154.92 74.49 Favored Pre-proline 0 C--N 1.325 -0.458 0 C-N-CA 125.95 1.7 . . . . 0.0 113.068 -175.763 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -80.42 132.15 8.91 Favored 'Trans proline' 0 N--CA 1.443 -1.467 0 C-N-CA 121.355 1.37 . . . . 0.0 112.36 -171.907 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -79.13 48.59 0.87 Allowed 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.832 0.853 . . . . 0.0 113.118 -172.704 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 62.4 mt -69.79 -50.66 40.85 Favored 'General case' 0 C--O 1.226 -0.147 0 C-N-CA 124.488 1.115 . . . . 0.0 110.677 -173.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -137.11 -56.54 0.71 Allowed 'General case' 0 C--N 1.333 -0.142 0 C-N-CA 124.766 1.226 . . . . 0.0 108.943 -177.152 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER 65.16 93.74 0.06 Allowed 'General case' 0 CA--C 1.529 0.171 0 C-N-CA 126.208 1.803 . . . . 0.0 108.691 179.886 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 58.7 m -155.33 109.35 2.87 Favored 'General case' 0 C--O 1.236 0.351 0 O-C-N 120.74 -1.225 . . . . 0.0 108.172 -173.266 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 47.38 -157.28 0.05 OUTLIER 'General case' 0 C--O 1.236 0.393 0 C-N-CA 125.278 1.431 . . . . 0.0 111.029 -169.809 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -157.76 -176.72 6.09 Favored 'General case' 0 C--O 1.238 0.497 0 N-CA-C 108.103 -1.073 . . . . 0.0 108.103 179.008 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -172.5 -171.39 37.3 Favored Glycine 0 CA--C 1.524 0.649 0 O-C-N 120.738 -1.226 . . . . 0.0 110.326 173.405 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 11.1 m80 -65.28 -19.82 66.13 Favored 'General case' 0 CA--C 1.542 0.647 0 O-C-N 121.924 -0.751 . . . . 0.0 111.792 162.754 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 19.6 pttp -93.67 -177.74 4.48 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 124.338 1.055 . . . . 0.0 111.089 -179.444 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 21.7 mt-10 -122.9 -178.1 3.85 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 125.116 1.367 . . . . 0.0 108.797 166.044 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -64.46 -31.73 73.07 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 125.791 1.636 . . . . 0.0 112.493 179.427 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -162.23 81.32 0.13 Allowed Glycine 0 CA--C 1.525 0.688 0 C-N-CA 124.69 1.138 . . . . 0.0 110.406 -172.536 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -143.49 85.94 9.16 Favored Pre-proline 0 CA--C 1.545 0.757 0 C-N-CA 125.184 1.394 . . . . 0.0 109.438 177.337 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -78.54 82.66 2.42 Favored 'Trans proline' 0 CA--C 1.549 1.27 0 C-N-CA 124.172 3.248 . . . . 0.0 114.281 -174.806 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 35.0 m 65.03 91.75 0.08 Allowed 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 124.646 1.179 . . . . 0.0 110.979 170.142 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 16.5 mmtt -129.7 -27.42 2.35 Favored 'General case' 0 CA--C 1.52 -0.209 0 CA-C-O 117.673 -1.156 . . . . 0.0 113.743 174.454 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -170.12 -13.47 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.948 0 N-CA-C 116.262 1.949 . . . . 0.0 116.262 -162.131 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -132.67 -80.69 0.18 Allowed Glycine 0 C--N 1.334 0.431 0 N-CA-C 108.444 -1.862 . . . . 0.0 108.444 -178.854 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 15.1 ptpt -60.58 -10.48 5.2 Favored 'General case' 0 N--CA 1.465 0.277 0 N-CA-C 113.585 0.957 . . . . 0.0 113.585 175.586 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -56.93 -29.31 63.0 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 119.488 1.04 . . . . 0.0 111.844 -175.648 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 3.1 mmpt? -126.42 23.37 6.92 Favored 'General case' 0 N--CA 1.463 0.193 0 C-N-CA 125.896 1.679 . . . . 0.0 110.158 178.673 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 52.9 mtpt 51.31 38.33 21.22 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 124.452 1.101 . . . . 0.0 111.18 -175.829 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 53.87 39.02 29.93 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 125.364 1.466 . . . . 0.0 112.509 174.104 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 4.4 mttp -53.24 -70.09 0.1 Allowed 'General case' 0 C--N 1.34 0.152 0 C-N-CA 125.207 1.403 . . . . 0.0 111.319 177.517 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 58.3 t-80 -155.96 160.11 39.8 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 124.399 1.08 . . . . 0.0 108.775 -179.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 7.4 mtmp? -138.95 143.14 38.45 Favored 'General case' 0 C--O 1.232 0.156 0 C-N-CA 125.76 1.624 . . . . 0.0 106.716 174.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 10.1 m -129.45 69.56 1.42 Allowed 'General case' 0 C--O 1.235 0.341 0 C-N-CA 123.839 0.856 . . . . 0.0 109.503 -172.204 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 43.3 mttt . . . . . 0 C--O 1.244 0.786 0 C-N-CA 126.001 1.72 . . . . 0.0 111.332 -168.194 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.463 0.47 0 N-CA-C 110.644 -0.982 . . . . 0.0 110.644 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 19.8 m170 -130.85 167.22 19.29 Favored 'General case' 0 C--O 1.238 0.472 0 C-N-CA 124.437 1.095 . . . . 0.0 108.116 167.263 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' MET . . . . . 0.414 ' HG3' ' H ' ' A' ' 4' ' ' GLN . 16.5 tpp -132.95 -173.39 3.18 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 125.777 1.631 . . . . 0.0 108.063 175.062 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . 0.414 ' H ' ' HG3' ' A' ' 3' ' ' MET . 0.0 OUTLIER -121.86 122.41 39.38 Favored 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 124.465 1.106 . . . . 0.0 109.379 -170.195 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -90.7 -19.06 24.0 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 123.671 0.788 . . . . 0.0 111.318 175.24 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 18.7 m 47.34 56.3 7.12 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.708 1.203 . . . . 0.0 110.783 -177.181 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -132.7 -178.87 5.14 Favored 'General case' 0 C--O 1.233 0.23 0 C-N-CA 125.758 1.623 . . . . 0.0 109.744 -171.695 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 74.75 95.68 0.07 Allowed 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 125.933 1.693 . . . . 0.0 108.39 178.826 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . 0.537 ' NE2' ' HG1' ' A' ' 60' ' ' THR . 19.5 mt-30 -59.65 -25.89 65.08 Favored 'General case' 0 CA--C 1.538 0.487 0 O-C-N 121.87 -0.519 . . . . 0.0 111.638 171.583 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 61.2 m-85 -139.64 164.83 35.6 Favored Pre-proline 0 C--O 1.241 0.637 0 C-N-CA 126.332 1.853 . . . . 0.0 109.371 176.924 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 68.2 Cg_endo -67.67 -175.33 0.71 Allowed 'Trans proline' 0 CA--C 1.538 0.687 0 C-N-CA 123.661 2.908 . . . . 0.0 109.874 161.134 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 18.6 t -116.55 86.09 17.8 Favored Pre-proline 0 CA--C 1.541 0.607 0 C-N-CA 125.222 1.409 . . . . 0.0 107.813 -173.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo -73.17 174.87 11.34 Favored 'Trans proline' 0 C--N 1.347 0.456 0 C-N-CA 124.72 3.613 . . . . 0.0 111.667 -177.723 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -142.79 131.95 23.22 Favored 'General case' 0 N--CA 1.445 -0.692 0 C-N-CA 125.935 1.694 . . . . 0.0 110.881 -175.194 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 7.1 p -63.81 -26.39 40.5 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.423 0 O-C-N 121.061 -1.025 . . . . 0.0 112.558 179.549 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 93.1 p -71.64 0.67 8.14 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 120.06 1.3 . . . . 0.0 113.568 178.846 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 32.1 p -111.32 1.79 17.29 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.475 1.11 . . . . 0.0 112.02 172.076 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 11.0 m-30 -69.46 172.46 7.19 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.647 1.179 . . . . 0.0 111.88 -178.808 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 2.8 mm100 -116.11 101.88 9.12 Favored 'General case' 0 N--CA 1.478 0.926 0 N-CA-C 114.663 1.357 . . . . 0.0 114.663 179.03 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 55.1 t80 -63.68 147.84 50.57 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 118.426 0.557 . . . . 0.0 111.621 -175.637 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 8.4 t0 -124.82 84.42 2.28 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 123.289 0.636 . . . . 0.0 109.769 176.809 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.75 -19.48 50.49 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 115.152 1.538 . . . . 0.0 115.152 -172.351 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 5.9 t -49.16 -46.93 46.0 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-O 118.346 -0.835 . . . . 0.0 110.313 166.264 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 64.8 m -130.07 -8.16 4.36 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 114.203 1.186 . . . . 0.0 114.203 -171.625 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 96.87 14.57 42.56 Favored Glycine 0 CA--C 1.526 0.771 0 CA-C-N 119.081 0.855 . . . . 0.0 114.221 155.707 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 16.9 m-85 -110.49 171.69 7.31 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 118.287 1.044 . . . . 0.0 109.027 -176.967 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 35.0 m-85 -113.03 121.81 45.72 Favored 'General case' 0 CA--C 1.529 0.142 0 C-N-CA 124.644 1.177 . . . . 0.0 108.624 -175.353 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 71.9 t80 -91.26 138.45 31.58 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 124.475 1.11 . . . . 0.0 110.694 -177.467 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 32.3 t0 -98.78 86.81 0.53 Allowed Pre-proline 0 N--CA 1.472 0.645 0 C-N-CA 126.233 1.813 . . . . 0.0 111.992 179.497 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_endo -60.9 -11.84 19.74 Favored 'Trans proline' 0 N--CA 1.459 -0.541 0 C-N-CA 122.415 2.077 . . . . 0.0 114.196 178.218 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -63.86 -29.52 70.7 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 119.743 1.156 . . . . 0.0 110.0 173.928 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 38.4 p -133.98 -42.42 0.82 Allowed 'General case' 0 C--O 1.235 0.301 0 CA-C-N 118.867 0.758 . . . . 0.0 112.833 -174.102 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 113.78 19.35 6.52 Favored Glycine 0 CA--C 1.534 1.228 0 C-N-CA 125.605 1.574 . . . . 0.0 112.322 -179.533 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 22.5 mt -93.11 176.21 6.5 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 126.466 1.906 . . . . 0.0 109.306 178.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 55.6 m-85 -121.96 165.36 16.09 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 124.678 1.191 . . . . 0.0 110.603 172.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 77.0 t80 -147.93 160.06 43.2 Favored 'General case' 0 C--O 1.239 0.534 0 C-N-CA 129.112 2.965 . . . . 0.0 108.475 -175.897 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 8.8 t0 -129.35 143.74 50.07 Favored Pre-proline 0 CA--C 1.537 0.469 0 N-CA-C 107.358 -1.349 . . . . 0.0 107.358 178.712 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_endo -63.72 -42.68 19.35 Favored 'Trans proline' 0 CA--C 1.537 0.633 0 C-N-CA 122.457 2.105 . . . . 0.0 113.262 -179.842 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 88.4 m-20 -75.07 -43.06 55.35 Favored 'General case' 0 N--CA 1.446 -0.647 0 C-N-CA 124.565 1.146 . . . . 0.0 109.596 176.041 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 14.9 m -103.92 97.89 7.81 Favored 'General case' 0 N--CA 1.456 -0.132 0 C-N-CA 123.727 0.811 . . . . 0.0 109.11 -171.177 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 7.4 mp0 -58.83 -15.61 13.3 Favored 'General case' 0 CA--C 1.541 0.621 0 O-C-N 121.78 -0.575 . . . . 0.0 111.135 173.526 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 32.1 m-85 -61.5 105.44 0.52 Allowed 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 125.94 1.696 . . . . 0.0 109.7 170.163 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 27.1 m-85 -67.99 168.36 12.01 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 124.692 1.197 . . . . 0.0 110.52 175.078 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 75.7 t80 -123.48 121.22 35.13 Favored 'General case' 0 N--CA 1.446 -0.649 0 C-N-CA 125.422 1.489 . . . . 0.0 109.559 176.183 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 28.1 t30 -86.18 88.38 7.59 Favored 'General case' 0 N--CA 1.443 -0.784 0 C-N-CA 127.875 2.47 . . . . 0.0 108.744 173.147 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -52.09 -36.39 50.7 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.498 0.719 . . . . 0.0 111.825 175.524 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -48.01 -57.09 6.22 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 126.393 1.877 . . . . 0.0 112.172 -178.257 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -111.23 18.48 19.27 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 125.037 1.335 . . . . 0.0 111.603 179.317 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 3.0 mt-30 48.4 34.0 4.37 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 125.579 1.551 . . . . 0.0 112.606 -176.516 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -105.76 174.56 5.83 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 126.714 2.006 . . . . 0.0 110.975 -174.02 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 5.6 m-85 -114.44 146.47 40.59 Favored 'General case' 0 C--N 1.332 -0.153 0 N-CA-C 108.387 -0.968 . . . . 0.0 108.387 179.601 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 85.2 mt -137.82 174.76 10.24 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.966 1.306 . . . . 0.0 108.874 -175.503 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 8.7 p90 -139.46 142.96 37.35 Favored 'General case' 0 C--O 1.239 0.543 0 C-N-CA 125.687 1.595 . . . . 0.0 107.917 165.948 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 41.8 t-105 -85.12 100.86 12.0 Favored 'General case' 0 N--CA 1.449 -0.524 0 N-CA-C 105.543 -2.021 . . . . 0.0 105.543 176.907 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 51.4 t0 -88.53 87.08 7.15 Favored 'General case' 0 N--CA 1.447 -0.615 0 N-CA-C 107.61 -1.255 . . . . 0.0 107.61 -178.47 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -58.55 -17.3 32.89 Favored Glycine 0 CA--C 1.53 1.02 0 CA-C-O 118.299 -1.278 . . . . 0.0 112.345 177.599 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 17.6 mt-10 -69.7 -22.27 63.43 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 120.021 1.911 . . . . 0.0 111.282 174.47 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 8.8 mtt180 -120.16 -2.71 10.13 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 125.173 1.389 . . . . 0.0 111.359 -179.516 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 2.1 mpt_? 44.55 56.15 5.29 Favored 'General case' 0 C--O 1.234 0.252 0 C-N-CA 126.664 1.986 . . . . 0.0 110.278 -173.54 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' THR . . . . . 0.537 ' HG1' ' NE2' ' A' ' 9' ' ' GLN . 5.0 t -148.89 153.46 38.06 Favored 'General case' 0 N--CA 1.448 -0.53 0 N-CA-C 108.851 -0.796 . . . . 0.0 108.851 176.513 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 80.3 m-85 -93.08 115.74 28.39 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 106.186 -1.783 . . . . 0.0 106.186 175.641 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -125.26 154.92 71.99 Favored Pre-proline 0 C--N 1.326 -0.425 0 C-N-CA 125.667 1.587 . . . . 0.0 110.274 -171.462 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -68.32 130.32 20.96 Favored 'Trans proline' 0 N--CA 1.455 -0.782 0 C-N-CA 122.36 2.04 . . . . 0.0 110.464 -179.032 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -96.47 14.32 24.95 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-O 121.993 0.901 . . . . 0.0 112.764 177.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 7.0 mp -68.31 123.9 22.02 Favored 'General case' 0 N--CA 1.437 -1.115 0 N-CA-C 106.688 -1.597 . . . . 0.0 106.688 170.083 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 73.3 tt0 73.39 -60.53 0.53 Allowed 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 126.508 1.923 . . . . 0.0 113.828 163.518 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 14.4 pt20 44.93 34.33 1.21 Allowed 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 127.309 2.244 . . . . 0.0 114.442 178.84 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 5.5 m 75.27 -12.71 0.93 Allowed 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 127.553 2.341 . . . . 0.0 115.55 173.708 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -81.47 95.25 7.03 Favored 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 125.011 1.325 . . . . 0.0 110.58 -174.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 27.5 t0 71.95 -37.29 0.39 Allowed 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 128.434 2.694 . . . . 0.0 114.37 165.873 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 166.11 -176.6 41.41 Favored Glycine 0 N--CA 1.447 -0.584 0 N-CA-C 109.818 -1.313 . . . . 0.0 109.818 167.534 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 2.4 p80 -77.67 -29.28 51.44 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 112.534 0.568 . . . . 0.0 112.534 175.852 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 67.8 mmtt 58.68 -154.85 0.36 Allowed 'General case' 0 C--O 1.237 0.424 0 C-N-CA 123.559 0.744 . . . . 0.0 110.307 177.866 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -64.35 161.59 16.58 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 109.704 -0.48 . . . . 0.0 109.704 167.322 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -54.42 -1.37 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 130.909 3.683 . . . . 0.0 115.499 -178.487 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -135.66 -86.94 0.23 Allowed Glycine 0 N--CA 1.439 -1.162 0 N-CA-C 106.545 -2.622 . . . . 0.0 106.545 -173.602 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . 44.59 71.13 1.6 Allowed Pre-proline 0 CA--C 1.546 0.809 0 C-N-CA 127.096 2.158 . . . . 0.0 113.156 170.531 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_endo -68.97 -17.36 41.19 Favored 'Trans proline' 0 CA--C 1.536 0.583 0 C-N-CA 124.121 3.214 . . . . 0.0 116.693 -158.548 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 1.6 p 44.86 21.19 0.04 OUTLIER 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 129.197 2.999 . . . . 0.0 117.685 173.836 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 7.9 mtpm? -137.15 23.47 3.01 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 124.712 1.205 . . . . 0.0 110.557 179.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -153.3 29.38 0.49 Allowed 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 112.642 0.608 . . . . 0.0 112.642 178.019 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 163.02 -85.23 0.11 Allowed Glycine 0 C--N 1.335 0.512 0 O-C-N 120.524 -1.36 . . . . 0.0 111.567 173.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 15.8 tttt -92.17 56.41 2.82 Favored 'General case' 0 N--CA 1.455 -0.202 0 CA-C-O 123.284 1.516 . . . . 0.0 108.177 -173.796 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.454 ' HG3' ' H ' ' A' ' 85' ' ' LYS . 7.0 pt-20 -56.96 -53.86 53.27 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 126.078 1.751 . . . . 0.0 110.011 174.25 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . 0.454 ' H ' ' HG3' ' A' ' 84' ' ' GLU . 52.6 pttt -158.12 26.98 0.26 Allowed 'General case' 0 C--O 1.238 0.478 0 C-N-CA 128.669 2.788 . . . . 0.0 109.546 179.565 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.431 ' HA ' ' HE2' ' A' ' 86' ' ' LYS . 7.3 mmpt? -83.94 99.06 10.14 Favored 'General case' 0 C--O 1.231 0.111 0 N-CA-C 107.635 -1.246 . . . . 0.0 107.635 -174.477 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -146.93 -33.35 0.29 Allowed 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 123.983 0.913 . . . . 0.0 111.879 -170.699 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 4.1 mptt -125.41 -174.22 3.01 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 125.116 1.366 . . . . 0.0 110.655 179.571 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 12.4 m80 55.12 98.35 0.02 OUTLIER 'General case' 0 C--O 1.239 0.51 0 C-N-CA 126.633 1.973 . . . . 0.0 113.113 -175.705 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.45 107.08 5.33 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 125.06 1.344 . . . . 0.0 108.638 175.937 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 17.3 m 52.48 69.13 0.72 Allowed 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 125.374 1.469 . . . . 0.0 111.14 178.031 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 1.4 mppt? . . . . . 0 C--O 1.247 0.953 0 N-CA-C 104.454 -2.424 . . . . 0.0 104.454 -127.159 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.113 0 N-CA-C 110.027 -1.229 . . . . 0.0 110.027 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 8.6 t-80 46.9 39.13 6.99 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 125.039 1.336 . . . . 0.0 112.008 -176.525 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 5.3 mpp? 60.3 4.94 0.74 Allowed 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 126.18 1.792 . . . . 0.0 115.075 -178.635 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 12.6 tt0 -47.63 112.7 0.58 Allowed 'General case' 0 C--O 1.236 0.354 0 C-N-CA 126.113 1.765 . . . . 0.0 112.116 -169.431 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 16.4 pt-20 -72.53 -14.85 61.74 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 125.337 1.455 . . . . 0.0 113.295 -177.036 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 67.5 m 53.34 45.59 28.12 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.429 1.092 . . . . 0.0 112.045 176.875 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 20.5 p90 -76.17 -9.41 58.6 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 124.399 1.079 . . . . 0.0 113.545 -174.016 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 44.7 m -77.07 99.02 5.19 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 127.197 2.199 . . . . 0.0 111.856 -169.918 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER 58.88 -60.97 0.04 OUTLIER 'General case' 0 C--O 1.237 0.419 0 C-N-CA 129.88 3.272 . . . . 0.0 114.222 -177.303 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 58.5 m-85 -131.23 154.94 82.1 Favored Pre-proline 0 C--O 1.235 0.329 0 C-N-CA 124.083 0.953 . . . . 0.0 109.542 171.453 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -61.04 169.69 5.73 Favored 'Trans proline' 0 N--CA 1.453 -0.873 0 C-N-CA 121.823 1.682 . . . . 0.0 109.846 161.94 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 59.7 t -104.67 86.69 1.51 Allowed Pre-proline 0 C--O 1.241 0.615 0 N-CA-C 107.073 -1.454 . . . . 0.0 107.073 -173.028 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 69.0 Cg_endo -66.79 169.18 15.13 Favored 'Trans proline' 0 CA--C 1.534 0.48 0 C-N-CA 123.856 3.037 . . . . 0.0 111.525 -168.929 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.434 ' CG ' ' HG ' ' A' ' 16' ' ' SER . 7.4 t0 -146.43 123.15 11.21 Favored 'General case' 0 C--O 1.232 0.164 0 O-C-N 121.535 -0.728 . . . . 0.0 111.057 -175.948 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 13.3 p -58.61 -20.84 17.24 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.671 0 C-N-CA 124.679 1.192 . . . . 0.0 112.695 -178.052 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' SER . . . . . 0.434 ' HG ' ' CG ' ' A' ' 14' ' ' ASP . 38.7 p -64.66 -13.7 55.13 Favored 'General case' 0 N--CA 1.434 -1.229 0 O-C-N 119.856 -1.777 . . . . 0.0 113.705 179.24 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 12.7 t -119.87 8.42 11.1 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 125.185 1.394 . . . . 0.0 110.75 176.669 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 12.9 m-30 -74.68 155.78 37.38 Favored 'General case' 0 C--O 1.238 0.467 0 O-C-N 120.977 -1.077 . . . . 0.0 110.524 170.68 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 25.5 mt-30 -93.47 150.79 20.17 Favored 'General case' 0 C--O 1.224 -0.26 0 CA-C-N 114.915 -1.039 . . . . 0.0 109.79 171.457 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 70.2 t80 -96.46 152.81 18.26 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 124.567 1.147 . . . . 0.0 109.975 167.469 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -132.66 97.28 4.02 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 124.134 0.974 . . . . 0.0 109.415 173.872 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 1.3 pt-20 -62.22 -20.2 63.95 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 125.307 1.443 . . . . 0.0 113.861 -172.403 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 15.1 t -56.74 -24.8 52.39 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 123.495 0.718 . . . . 0.0 111.617 171.38 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 66.2 m -133.14 -19.92 2.19 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.834 1.254 . . . . 0.0 112.775 179.522 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 62.77 25.37 67.49 Favored Glycine 0 CA--C 1.531 1.073 0 O-C-N 121.016 -1.052 . . . . 0.0 112.682 -175.516 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 17.8 m-85 -87.98 170.57 11.01 Favored 'General case' 0 C--O 1.238 0.482 0 N-CA-C 107.419 -1.326 . . . . 0.0 107.419 160.966 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 76.9 m-85 -107.04 152.45 23.99 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 124.316 1.046 . . . . 0.0 108.741 166.782 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 46.6 t80 -111.21 137.63 48.67 Favored 'General case' 0 N--CA 1.447 -0.623 0 C-N-CA 126.933 2.093 . . . . 0.0 108.315 179.162 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 6.2 t0 -96.02 86.7 0.37 Allowed Pre-proline 0 CA--C 1.532 0.267 0 C-N-CA 128.609 2.763 . . . . 0.0 107.048 177.335 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -66.91 -10.27 27.8 Favored 'Trans proline' 0 C--N 1.347 0.485 0 C-N-CA 122.424 2.083 . . . . 0.0 111.983 175.982 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 10.0 tt0 -70.1 -18.54 63.25 Favored 'General case' 0 N--CA 1.447 -0.599 0 C-N-CA 124.578 1.151 . . . . 0.0 110.523 -179.151 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 37.0 p -145.57 -53.29 0.27 Allowed 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 126.165 1.786 . . . . 0.0 111.106 178.438 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 135.1 12.23 1.3 Allowed Glycine 0 CA--C 1.531 1.08 0 C-N-CA 126.329 1.919 . . . . 0.0 113.851 178.727 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 10.7 mt -81.1 177.19 9.2 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 118.92 1.36 . . . . 0.0 110.339 178.332 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 59.5 m-85 -121.95 167.52 12.97 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.275 1.03 . . . . 0.0 110.196 168.915 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 33.9 t80 -149.65 139.73 22.08 Favored 'General case' 0 C--O 1.235 0.317 0 C-N-CA 127.518 2.327 . . . . 0.0 107.835 -172.63 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -99.29 143.25 26.06 Favored Pre-proline 0 CA--C 1.538 0.506 0 N-CA-C 106.951 -1.5 . . . . 0.0 106.951 -178.389 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -66.48 -38.43 19.6 Favored 'Trans proline' 0 C--O 1.236 0.417 0 C-N-CA 121.423 1.415 . . . . 0.0 113.735 -178.841 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 11.2 m-80 -99.78 -14.26 18.91 Favored 'General case' 0 CA--C 1.518 -0.264 0 N-CA-C 113.31 0.855 . . . . 0.0 113.31 -172.414 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 24.2 m -127.93 103.33 7.19 Favored 'General case' 0 C--N 1.32 -0.689 0 C-N-CA 125.954 1.702 . . . . 0.0 107.659 178.161 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -65.62 -1.51 2.75 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 123.56 0.744 . . . . 0.0 112.344 -176.832 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 42.1 m-85 -60.98 120.75 10.82 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 119.414 1.007 . . . . 0.0 108.435 164.769 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 32.5 m-85 -74.1 164.36 26.71 Favored 'General case' 0 N--CA 1.442 -0.838 0 C-N-CA 124.482 1.113 . . . . 0.0 109.355 173.611 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 94.4 t80 -119.44 139.52 51.91 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 125.474 1.509 . . . . 0.0 108.674 173.027 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 18.7 t30 -121.17 79.97 1.59 Allowed 'General case' 0 N--CA 1.444 -0.745 0 C-N-CA 128.169 2.588 . . . . 0.0 106.179 -171.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -52.15 -33.07 38.63 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 123.629 0.772 . . . . 0.0 111.621 179.97 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -46.19 -38.04 7.83 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 127.369 2.268 . . . . 0.0 113.012 177.097 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.3 m -129.05 13.12 6.22 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 125.141 1.376 . . . . 0.0 110.488 179.127 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 52.4 mt-30 44.02 35.25 1.11 Allowed 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 128.859 2.864 . . . . 0.0 113.7 -169.003 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -108.08 -179.83 4.01 Favored 'General case' 0 N--CA 1.448 -0.54 0 C-N-CA 124.839 1.256 . . . . 0.0 112.145 -176.227 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 55.4 m-85 -123.28 139.7 53.78 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 124.723 1.209 . . . . 0.0 109.221 -178.08 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 64.9 mt -130.97 167.25 19.34 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.865 1.266 . . . . 0.0 107.838 -174.28 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 13.6 p90 -126.05 149.85 48.56 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 107.437 -1.319 . . . . 0.0 107.437 165.835 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 62.9 t-105 -88.03 152.92 21.68 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 106.212 -1.774 . . . . 0.0 106.212 166.805 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 49.0 t0 -145.58 155.25 42.93 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 107.595 -1.261 . . . . 0.0 107.595 166.553 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -100.84 -7.93 49.51 Favored Glycine 0 CA--C 1.526 0.758 0 CA-C-O 118.883 -0.954 . . . . 0.0 112.322 177.95 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 75.6 mt-10 -74.11 -44.29 54.42 Favored 'General case' 0 C--N 1.341 0.201 0 CA-C-N 119.664 1.732 . . . . 0.0 107.824 177.251 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 81.3 mtt180 -102.05 -5.21 24.82 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-O 117.703 -1.142 . . . . 0.0 112.499 -178.499 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 60.6 mtt85 43.95 57.89 3.91 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 126.997 2.119 . . . . 0.0 111.941 177.684 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 10.0 t -151.05 156.44 41.11 Favored 'General case' 0 N--CA 1.442 -0.835 0 N-CA-C 107.848 -1.167 . . . . 0.0 107.848 177.174 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 31.3 m-85 -75.27 128.25 35.0 Favored 'General case' 0 C--O 1.238 0.479 0 N-CA-C 106.616 -1.624 . . . . 0.0 106.616 154.499 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -126.04 154.46 73.99 Favored Pre-proline 0 C--N 1.325 -0.481 0 C-N-CA 126.81 2.044 . . . . 0.0 111.429 -178.697 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -71.78 122.68 8.74 Favored 'Trans proline' 0 N--CA 1.456 -0.686 0 C-N-CA 122.87 2.38 . . . . 0.0 111.782 -176.17 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -91.02 14.54 13.67 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 115.144 1.535 . . . . 0.0 115.144 -174.691 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -79.76 -61.4 2.01 Favored 'General case' 0 N--CA 1.44 -0.954 0 N-CA-C 108.774 -0.824 . . . . 0.0 108.774 -173.54 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.8 mp0 -83.35 -57.62 3.18 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 123.531 0.732 . . . . 0.0 110.406 -177.585 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 19.0 mt-30 59.53 177.08 0.08 Allowed 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 127.572 2.349 . . . . 0.0 112.804 -178.253 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 72.0 m 44.98 57.68 4.51 Favored 'General case' 0 C--O 1.238 0.478 0 C-N-CA 125.597 1.559 . . . . 0.0 112.257 -176.789 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -68.62 98.28 0.87 Allowed 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 124.572 1.149 . . . . 0.0 110.641 -175.996 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -139.48 -44.15 0.45 Allowed 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 123.806 0.843 . . . . 0.0 113.142 -175.919 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -83.82 158.27 34.96 Favored Glycine 0 CA--C 1.524 0.641 0 N-CA-C 108.906 -1.678 . . . . 0.0 108.906 171.449 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 2.2 t-80 -73.75 90.79 1.87 Allowed 'General case' 0 CA--C 1.537 0.442 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 -178.658 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 65.3 mttp -136.04 161.92 34.35 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 124.436 1.094 . . . . 0.0 110.86 -172.689 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -127.36 164.64 21.37 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 125.259 1.423 . . . . 0.0 110.008 -179.725 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 7.1 m -52.79 -29.47 27.62 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 126.515 1.926 . . . . 0.0 112.975 178.454 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -67.91 -21.09 73.14 Favored Glycine 0 CA--C 1.53 1.004 0 CA-C-O 119.165 -0.797 . . . . 0.0 111.539 -178.151 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . 44.18 68.5 3.07 Favored Pre-proline 0 CA--C 1.536 0.418 0 C-N-CA 127.077 2.151 . . . . 0.0 111.965 -178.657 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -67.27 163.36 34.67 Favored 'Trans proline' 0 N--CA 1.455 -0.784 0 C-N-CA 123.144 2.562 . . . . 0.0 111.249 -179.529 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 3.7 m -139.06 48.05 1.89 Allowed 'General case' 0 C--O 1.235 0.333 0 C-N-CA 125.594 1.557 . . . . 0.0 108.661 179.057 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 15.3 pttm -128.3 -10.12 5.23 Favored 'General case' 0 N--CA 1.463 0.218 0 C-N-CA 123.603 0.761 . . . . 0.0 113.014 174.813 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -158.0 51.08 0.43 Allowed 'General case' 0 C--O 1.237 0.396 0 CA-C-O 122.67 1.224 . . . . 0.0 107.87 -164.832 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 160.27 -113.99 0.59 Allowed Glycine 0 N--CA 1.447 -0.588 0 N-CA-C 107.216 -2.353 . . . . 0.0 107.216 -170.146 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.64 32.16 0.3 Allowed 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 125.609 1.564 . . . . 0.0 112.623 -171.058 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 2.2 pp20? -44.48 -55.69 4.87 Favored 'General case' 0 C--O 1.241 0.649 0 C-N-CA 126.364 1.866 . . . . 0.0 111.553 -176.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.01 26.43 8.74 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 125.265 1.426 . . . . 0.0 110.844 -179.966 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 68.9 mmtt 57.02 37.99 29.05 Favored 'General case' 0 N--CA 1.468 0.425 0 C-N-CA 123.981 0.913 . . . . 0.0 110.5 -176.363 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 63.07 10.95 4.83 Favored 'General case' 0 C--O 1.234 0.273 0 C-N-CA 125.247 1.419 . . . . 0.0 112.929 174.216 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 44.4 mtpt -73.32 -17.31 61.32 Favored 'General case' 0 C--O 1.224 -0.241 0 CA-C-O 117.297 -1.335 . . . . 0.0 112.053 -172.707 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 68.5 m80 46.01 89.49 0.02 OUTLIER 'General case' 0 C--N 1.343 0.304 0 C-N-CA 126.905 2.082 . . . . 0.0 110.657 -177.608 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . 0.289 21.1 pttp 52.36 -162.49 0.09 Allowed 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 122.54 0.336 . . . . 0.0 110.167 -168.927 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -133.97 159.52 40.48 Favored 'General case' 0 C--O 1.236 0.379 0 N-CA-C 107.128 -1.434 . . . . 0.0 107.128 155.269 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 1.3 tttp . . . . . 0 C--O 1.252 1.21 0 CA-C-O 117.467 -1.254 . . . . 0.0 107.833 -156.434 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 1.305 0 N-CA-C 108.561 -1.816 . . . . 0.0 108.561 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 11.9 p80 -73.54 155.11 39.5 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 124.387 1.075 . . . . 0.0 110.448 -175.346 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -169.59 -51.19 0.02 OUTLIER 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 124.676 1.19 . . . . 0.0 109.737 168.389 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 10.3 tt0 -76.86 143.03 39.96 Favored 'General case' 0 C--O 1.234 0.286 0 N-CA-C 107.657 -1.238 . . . . 0.0 107.657 166.151 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 25.3 tt0 -84.49 -61.42 1.8 Allowed 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 122.765 0.426 . . . . 0.0 110.069 -177.877 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 27.5 t 45.12 72.69 0.19 Allowed 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 125.861 1.664 . . . . 0.0 110.496 -171.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 1.4 m-85 -138.73 144.72 39.63 Favored 'General case' 0 N--CA 1.453 -0.323 0 O-C-N 121.393 -0.817 . . . . 0.0 109.589 173.107 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 3.4 t -150.23 59.36 0.97 Allowed 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 107.078 -1.453 . . . . 0.0 107.078 161.509 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 14.5 pt20 -74.46 -178.74 3.65 Favored 'General case' 0 N--CA 1.446 -0.661 0 C-N-CA 124.392 1.077 . . . . 0.0 109.19 170.055 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 44.0 m-85 -122.4 165.42 21.15 Favored Pre-proline 0 C--O 1.241 0.656 0 C-N-CA 125.74 1.616 . . . . 0.0 109.922 -173.102 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 62.8 Cg_endo -71.82 -169.0 0.4 Allowed 'Trans proline' 0 N--CA 1.46 -0.468 0 C-N-CA 123.598 2.865 . . . . 0.0 110.516 170.497 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 85.9 t -109.38 88.13 5.78 Favored Pre-proline 0 CA--C 1.539 0.544 0 C-N-CA 126.232 1.813 . . . . 0.0 108.341 178.226 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 64.9 Cg_endo -66.4 175.23 5.23 Favored 'Trans proline' 0 CA--C 1.543 0.935 0 C-N-CA 122.957 2.438 . . . . 0.0 112.744 -177.356 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -154.1 147.76 25.26 Favored 'General case' 0 N--CA 1.465 0.295 0 C-N-CA 123.171 0.588 . . . . 0.0 111.144 168.234 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.482 ' HA ' ' CD2' ' A' ' 18' ' ' TYR . 13.0 p -58.01 -22.9 20.01 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.151 0 C-N-CA 125.22 1.408 . . . . 0.0 114.048 178.711 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 8.0 t -64.92 -3.5 3.51 Favored 'General case' 0 CA--C 1.541 0.633 0 O-C-N 121.022 -1.049 . . . . 0.0 112.52 174.476 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 40.9 p -105.48 -7.98 18.36 Favored 'General case' 0 CA--C 1.543 0.707 0 CA-C-N 119.558 1.072 . . . . 0.0 112.369 178.257 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . 0.482 ' CD2' ' HA ' ' A' ' 15' ' ' VAL . 17.8 m-30 -88.99 168.28 12.49 Favored 'General case' 0 C--N 1.342 0.282 0 C-N-CA 124.61 1.164 . . . . 0.0 111.637 -170.226 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 14.5 mt-30 -118.09 116.04 26.05 Favored 'General case' 0 C--O 1.226 -0.181 0 C-N-CA 124.835 1.254 . . . . 0.0 110.099 178.805 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 69.6 t80 -71.27 143.02 50.5 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 118.473 0.578 . . . . 0.0 110.509 172.962 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -131.0 96.75 4.13 Favored 'General case' 0 CA--C 1.515 -0.376 0 C-N-CA 124.425 1.09 . . . . 0.0 110.141 178.529 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.7 pt-20 -53.54 -19.12 3.39 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.86 1.264 . . . . 0.0 113.289 -179.972 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 1.3 t -64.21 -17.92 64.01 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.229 1.412 . . . . 0.0 111.974 178.581 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -143.83 -19.96 0.58 Allowed 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 119.341 0.973 . . . . 0.0 112.467 177.712 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 89.88 10.57 64.63 Favored Glycine 0 CA--C 1.529 0.923 0 CA-C-O 118.331 -1.261 . . . . 0.0 113.433 176.105 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 -110.63 151.08 28.09 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-N 119.257 1.529 . . . . 0.0 108.468 177.602 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 66.0 m-85 -80.29 147.79 31.0 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 106.774 -1.565 . . . . 0.0 106.774 172.764 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 35.9 t80 -105.67 135.32 47.29 Favored 'General case' 0 C--O 1.239 0.515 0 C-N-CA 125.039 1.336 . . . . 0.0 110.223 175.892 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -99.65 85.8 0.51 Allowed Pre-proline 0 N--CA 1.451 -0.403 0 C-N-CA 126.824 2.049 . . . . 0.0 110.771 -178.591 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -65.73 -5.68 12.33 Favored 'Trans proline' 0 N--CA 1.458 -0.58 0 C-N-CA 121.649 1.566 . . . . 0.0 113.994 -179.49 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 36.7 tt0 -77.31 -33.03 55.69 Favored 'General case' 0 N--CA 1.447 -0.594 0 O-C-N 121.263 -0.898 . . . . 0.0 110.46 177.948 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' THR . . . . . 0.495 ' HB ' ' CD2' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -135.37 -19.57 1.67 Allowed 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 126.268 1.827 . . . . 0.0 112.988 -162.913 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 94.84 -4.78 68.8 Favored Glycine 0 N--CA 1.445 -0.725 0 CA-C-O 117.678 -1.623 . . . . 0.0 113.623 175.584 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.495 ' CD2' ' HB ' ' A' ' 32' ' ' THR . 0.0 OUTLIER -76.84 -179.45 5.43 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 119.847 1.824 . . . . 0.0 109.906 178.644 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 41.0 m-85 -116.54 135.34 53.9 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-N 114.672 -1.149 . . . . 0.0 109.688 161.126 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 63.7 t80 -92.18 153.38 19.35 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 126.213 1.805 . . . . 0.0 109.683 168.235 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -128.93 144.28 51.93 Favored Pre-proline 0 CA--C 1.538 0.499 0 O-C-N 121.523 -0.736 . . . . 0.0 110.383 172.461 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 61.9 Cg_endo -72.75 -23.78 18.91 Favored 'Trans proline' 0 N--CA 1.457 -0.654 0 C-N-CA 122.445 2.096 . . . . 0.0 114.573 -176.539 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -84.79 -31.11 24.09 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-N 120.558 1.526 . . . . 0.0 109.935 166.029 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 49.4 m -127.32 92.77 3.57 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-O 122.403 1.096 . . . . 0.0 110.724 -162.924 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 5.5 mp0 -62.7 -5.92 3.14 Favored 'General case' 0 CA--C 1.546 0.825 0 CA-C-N 115.215 -0.902 . . . . 0.0 111.216 168.98 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 24.7 m-85 -62.92 98.0 0.12 Allowed 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 125.829 1.652 . . . . 0.0 107.398 160.395 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 67.9 m-85 -61.69 157.16 18.34 Favored 'General case' 0 C--O 1.232 0.153 0 C-N-CA 126.335 1.854 . . . . 0.0 111.511 177.692 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 10.8 t80 -115.89 108.45 16.3 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 125.029 1.332 . . . . 0.0 108.769 174.812 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 29.7 t30 -90.32 75.74 6.85 Favored 'General case' 0 C--O 1.235 0.299 0 C-N-CA 126.761 2.024 . . . . 0.0 106.111 177.359 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -48.63 -31.07 6.12 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 124.845 1.258 . . . . 0.0 111.413 178.703 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -44.75 -39.25 5.04 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 127.643 2.377 . . . . 0.0 112.594 178.901 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 35.2 m -134.22 20.14 3.72 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.956 1.302 . . . . 0.0 110.101 176.054 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 37.3 mt-30 46.66 17.82 0.06 Allowed 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 128.741 2.817 . . . . 0.0 114.844 -165.995 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 33.7 mm-40 -76.28 166.49 23.37 Favored 'General case' 0 CA--C 1.522 -0.117 0 CA-C-N 119.623 1.101 . . . . 0.0 111.623 -176.027 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 9.6 m-85 -118.98 123.93 45.75 Favored 'General case' 0 N--CA 1.45 -0.448 0 N-CA-C 106.318 -1.734 . . . . 0.0 106.318 -177.788 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 22.6 mt -124.1 167.81 13.72 Favored 'General case' 0 N--CA 1.464 0.252 0 C-N-CA 126.478 1.911 . . . . 0.0 110.495 -177.032 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 9.3 p90 -134.23 148.88 50.92 Favored 'General case' 0 N--CA 1.448 -0.573 0 O-C-N 120.948 -1.095 . . . . 0.0 108.197 164.722 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 39.6 t-105 -70.92 130.49 41.75 Favored 'General case' 0 C--O 1.236 0.365 0 N-CA-C 106.242 -1.762 . . . . 0.0 106.242 167.128 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 18.9 t0 -122.82 92.08 3.63 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-N 119.329 0.968 . . . . 0.0 109.788 174.758 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -59.51 -12.81 20.47 Favored Glycine 0 CA--C 1.529 0.93 0 CA-C-O 117.645 -1.642 . . . . 0.0 113.58 -178.454 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 -69.57 -20.98 63.65 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 120.389 2.094 . . . . 0.0 111.508 174.149 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 78.6 mtt85 -134.58 -0.07 2.95 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 126.771 2.028 . . . . 0.0 111.334 -167.756 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 5.9 mpt_? 44.63 48.3 8.65 Favored 'General case' 0 N--CA 1.463 0.177 0 C-N-CA 129.093 2.957 . . . . 0.0 112.593 174.579 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 13.9 t -143.67 -174.63 4.3 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 107.473 -1.306 . . . . 0.0 107.473 172.052 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 51.6 m-85 -106.05 135.73 46.99 Favored 'General case' 0 C--O 1.234 0.277 0 N-CA-C 106.913 -1.514 . . . . 0.0 106.913 169.77 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -125.87 157.3 69.54 Favored Pre-proline 0 C--N 1.328 -0.359 0 C-N-CA 126.043 1.737 . . . . 0.0 109.176 178.598 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -70.77 142.08 42.64 Favored 'Trans proline' 0 N--CA 1.452 -0.932 0 C-N-CA 121.232 1.288 . . . . 0.0 111.331 179.629 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -114.01 38.07 3.11 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 125.589 1.555 . . . . 0.0 111.245 -177.29 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -65.82 -34.73 78.82 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 123.991 0.916 . . . . 0.0 111.977 -173.516 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -172.29 155.61 3.61 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 129.147 2.979 . . . . 0.0 103.96 175.148 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 11.0 mt-30 -155.6 13.77 0.35 Allowed 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 125.763 1.625 . . . . 0.0 112.025 164.175 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -132.94 77.98 1.77 Allowed 'General case' 0 N--CA 1.462 0.134 0 O-C-N 120.795 -1.19 . . . . 0.0 109.4 -177.691 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 60.16 -166.78 0.19 Allowed 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 125.637 1.575 . . . . 0.0 110.172 -166.312 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 6.7 t0 -153.94 115.36 4.15 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 126.814 2.046 . . . . 0.0 106.685 -166.219 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 154.32 -163.77 31.22 Favored Glycine 0 CA--C 1.526 0.73 0 CA-C-N 120.862 1.665 . . . . 0.0 114.57 -176.753 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 6.4 p80 -57.91 -0.87 0.09 Allowed 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 118.056 2.613 . . . . 0.0 118.056 -165.044 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 29.0 mtmm -81.73 -175.43 5.56 Favored 'General case' 0 C--N 1.329 -0.312 0 O-C-N 121.335 -0.853 . . . . 0.0 109.277 179.431 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 4.6 mp0 -62.99 -178.4 0.21 Allowed 'General case' 0 CA--C 1.541 0.61 0 CA-C-O 121.571 0.7 . . . . 0.0 109.546 159.768 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -49.16 -14.02 0.08 Allowed 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 128.982 2.913 . . . . 0.0 114.875 175.8 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -173.07 173.76 45.72 Favored Glycine 0 N--CA 1.437 -1.292 0 O-C-N 121.125 -0.984 . . . . 0.0 111.744 -179.707 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -157.67 165.81 17.91 Favored Pre-proline 0 N--CA 1.451 -0.38 0 C-N-CA 125.847 1.659 . . . . 0.0 108.86 178.911 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -61.2 114.95 2.42 Favored 'Trans proline' 0 CA--C 1.535 0.561 0 C-N-CA 121.962 1.775 . . . . 0.0 110.784 161.435 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 2.5 p -171.38 59.12 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.186 0 C-N-CA 127.773 2.429 . . . . 0.0 107.457 -179.726 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 19.2 tptt -150.57 0.42 0.43 Allowed 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 168.363 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -131.41 79.98 1.91 Allowed 'General case' 0 C--O 1.236 0.358 0 N-CA-C 105.343 -2.095 . . . . 0.0 105.343 172.895 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 105.2 -78.89 0.27 Allowed Glycine 0 C--N 1.335 0.503 0 CA-C-O 122.135 0.853 . . . . 0.0 111.462 167.629 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.98 5.86 0.12 Allowed 'General case' 0 C--O 1.235 0.322 0 C-N-CA 124.566 1.146 . . . . 0.0 113.706 179.554 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 2.7 pt-20 -55.6 -48.32 75.05 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 120.234 1.379 . . . . 0.0 109.524 172.096 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -129.73 -4.16 4.67 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 115.073 1.508 . . . . 0.0 115.073 178.067 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 24.6 mtmt 70.67 170.02 0.31 Allowed 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 126.266 1.826 . . . . 0.0 111.12 172.876 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 17.2 mp0 -81.53 -70.77 0.51 Allowed 'General case' 0 C--O 1.236 0.392 0 N-CA-C 108.483 -0.932 . . . . 0.0 108.483 178.348 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 47.33 -158.32 0.04 OUTLIER 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 124.428 1.091 . . . . 0.0 109.503 -158.506 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 39.5 m-70 46.73 61.87 2.61 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 125.711 1.604 . . . . 0.0 113.274 179.559 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 2.3 ttpt -120.46 0.11 10.45 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 112.733 0.642 . . . . 0.0 112.733 -178.931 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -107.12 173.98 6.09 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.941 0.896 . . . . 0.0 108.805 -174.57 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . 0.407 ' HE3' ' O ' ' A' ' 92' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.243 0.752 0 N-CA-C 104.877 -2.268 . . . . 0.0 104.877 162.147 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.877 0 N-CA-C 109.888 -1.285 . . . . 0.0 109.888 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 35.5 t-80 -118.73 98.96 6.48 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 125.155 1.382 . . . . 0.0 107.754 -176.23 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 28.1 ptm -147.27 -0.68 0.67 Allowed 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 125.013 1.325 . . . . 0.0 113.386 -177.012 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 17.0 mt-30 -119.29 155.65 31.43 Favored 'General case' 0 C--O 1.233 0.233 0 N-CA-C 106.301 -1.74 . . . . 0.0 106.301 160.003 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 17.6 pt-20 -141.31 4.92 1.83 Allowed 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 114.308 1.225 . . . . 0.0 114.308 173.578 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 50.77 65.86 1.34 Allowed 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 124.057 0.943 . . . . 0.0 111.968 163.156 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -74.13 -179.81 4.03 Favored 'General case' 0 C--O 1.239 0.542 0 C-N-CA 124.692 1.197 . . . . 0.0 109.841 -170.772 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 63.75 76.7 0.35 Allowed 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 179.752 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -61.72 -70.82 0.17 Allowed 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 126.879 2.072 . . . . 0.0 109.032 -179.888 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 45.6 m-85 -115.61 157.48 44.22 Favored Pre-proline 0 CA--C 1.536 0.433 0 O-C-N 123.878 0.736 . . . . 0.0 111.567 179.089 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 61.9 Cg_endo -73.11 -177.8 3.18 Favored 'Trans proline' 0 CA--C 1.537 0.672 0 C-N-CA 124.747 3.631 . . . . 0.0 112.084 174.686 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 29.7 t -110.88 87.33 6.78 Favored Pre-proline 0 CA--C 1.532 0.284 0 C-N-CA 126.818 2.047 . . . . 0.0 108.697 -176.184 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 41.0 Cg_endo -67.27 162.1 40.11 Favored 'Trans proline' 0 CA--C 1.542 0.89 0 C-N-CA 121.847 1.698 . . . . 0.0 109.955 171.539 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.47 ' C ' ' H ' ' A' ' 16' ' ' SER . 50.8 t0 -159.45 32.94 0.2 Allowed 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 123.12 0.568 . . . . 0.0 111.302 -172.817 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . 0.376 7.5 p 43.78 -22.68 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.552 1.055 1 C-N-CA 133.408 4.683 . . . . 0.0 116.727 -165.94 . . . . . . . . 3 2 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' SER . . . . . 0.47 ' H ' ' C ' ' A' ' 14' ' ' ASP . 2.8 p -70.18 -18.22 63.19 Favored 'General case' 0 N--CA 1.446 -0.672 0 C-N-CA 128.635 2.774 . . . . 0.0 111.995 -174.086 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 16.5 p -87.62 -13.95 41.37 Favored 'General case' 0 CA--C 1.538 0.501 0 O-C-N 121.139 -0.976 . . . . 0.0 110.712 175.455 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 13.7 m-30 -72.56 148.35 45.04 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-O 122.501 1.143 . . . . 0.0 111.023 -161.014 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 84.7 mt-30 -87.4 101.95 14.06 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 105.921 -1.881 . . . . 0.0 105.921 170.178 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 88.3 t80 -59.05 142.72 50.57 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 107.742 -1.207 . . . . 0.0 107.742 159.817 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -128.13 88.95 2.84 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 104.692 -2.336 . . . . 0.0 104.692 -176.484 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -56.09 -27.89 55.5 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 124.544 1.138 . . . . 0.0 113.699 -171.017 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 10.6 t -45.74 -52.93 10.26 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 126.024 1.73 . . . . 0.0 111.124 177.741 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 22.2 m -93.22 -35.71 12.98 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 118.513 0.597 . . . . 0.0 110.86 169.548 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 80.16 58.36 2.8 Favored Glycine 0 CA--C 1.524 0.61 0 N-CA-C 110.044 -1.222 . . . . 0.0 110.044 -173.198 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 30.3 m-85 -142.23 169.95 16.62 Favored 'General case' 0 C--O 1.24 0.597 0 C-N-CA 130.237 3.415 . . . . 0.0 106.229 173.138 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 82.2 m-85 -101.64 150.89 22.64 Favored 'General case' 0 CA--C 1.522 -0.116 0 O-C-N 121.906 -0.496 . . . . 0.0 111.043 178.709 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 41.6 t80 -119.84 140.92 50.06 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 127.848 2.459 . . . . 0.0 107.886 174.279 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 51.4 t0 -104.92 86.4 1.49 Allowed Pre-proline 0 N--CA 1.467 0.4 0 C-N-CA 127.468 2.307 . . . . 0.0 109.95 -177.134 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo -62.26 -13.77 34.36 Favored 'Trans proline' 0 CA--C 1.533 0.455 0 C-N-CA 122.716 2.278 . . . . 0.0 113.765 -175.924 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -74.32 -14.42 60.89 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 124.169 0.988 . . . . 0.0 111.453 -179.42 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 2.9 p -141.12 -45.77 0.38 Allowed 'General case' 0 C--N 1.332 -0.17 0 C-N-CA 125.519 1.528 . . . . 0.0 110.426 -172.204 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 98.31 46.06 2.25 Favored Glycine 0 N--CA 1.446 -0.654 0 N-CA-C 109.731 -1.348 . . . . 0.0 109.731 -175.719 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 12.7 mt -118.77 173.2 7.01 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 127.111 2.164 . . . . 0.0 107.568 172.535 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 26.4 m-85 -117.86 166.1 12.88 Favored 'General case' 0 C--O 1.238 0.481 0 C-N-CA 123.962 0.905 . . . . 0.0 109.443 168.358 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 69.2 t80 -143.87 158.65 43.55 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 125.995 1.718 . . . . 0.0 109.63 -178.372 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -131.24 143.76 50.66 Favored Pre-proline 0 CA--C 1.538 0.501 0 C-N-CA 125.406 1.482 . . . . 0.0 110.825 175.2 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -74.26 -35.12 4.18 Favored 'Trans proline' 0 CA--C 1.536 0.614 0 C-N-CA 123.465 2.777 . . . . 0.0 114.346 -178.183 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 13.6 m-80 -76.51 -23.32 53.7 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 120.085 1.311 . . . . 0.0 110.851 174.667 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -134.91 85.99 2.22 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 124.135 0.974 . . . . 0.0 108.895 -158.495 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 6.1 mp0 -62.85 -0.08 0.61 Allowed 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 124.598 1.159 . . . . 0.0 114.084 -176.038 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 60.8 m-85 -77.85 110.12 12.46 Favored 'General case' 0 C--O 1.237 0.402 0 O-C-N 120.052 -1.655 . . . . 0.0 108.449 174.525 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 14.5 m-85 -63.03 146.04 54.1 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 125.507 1.523 . . . . 0.0 109.811 -176.094 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 74.7 t80 -102.23 112.81 25.64 Favored 'General case' 0 CA--C 1.516 -0.34 0 CA-C-O 122.735 1.255 . . . . 0.0 108.206 177.785 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 49.3 t30 -84.64 80.88 9.1 Favored 'General case' 0 N--CA 1.44 -0.944 0 C-N-CA 125.266 1.427 . . . . 0.0 108.728 175.785 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -44.42 -37.17 3.25 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 125.182 1.393 . . . . 0.0 111.817 175.737 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 3.2 tt0 -44.35 -43.11 7.3 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 127.842 2.457 . . . . 0.0 112.766 179.927 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 17.9 m -131.78 21.04 4.6 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 125.438 1.495 . . . . 0.0 110.835 177.878 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 43.4 mt-30 48.27 27.99 1.47 Allowed 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 126.153 1.781 . . . . 0.0 112.571 -173.433 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.1 tp-100 -94.09 169.8 10.0 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 124.638 1.175 . . . . 0.0 110.594 -170.422 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 3.4 m-85 -108.29 144.57 35.62 Favored 'General case' 0 C--O 1.236 0.386 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 169.461 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 83.4 mt -142.6 179.93 6.68 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 127.197 2.199 . . . . 0.0 107.663 -178.991 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 17.8 p90 -135.83 146.09 47.13 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 124.435 1.094 . . . . 0.0 108.817 167.75 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 64.8 t-105 -73.43 132.95 43.54 Favored 'General case' 0 C--O 1.236 0.379 0 N-CA-C 105.676 -1.972 . . . . 0.0 105.676 164.961 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 58.9 t0 -129.63 76.6 1.73 Allowed 'General case' 0 CA--C 1.514 -0.412 0 C-N-CA 123.921 0.888 . . . . 0.0 109.004 -174.46 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -57.48 -7.16 2.78 Favored Glycine 0 CA--C 1.534 1.268 0 C-N-CA 124.692 1.139 . . . . 0.0 113.074 -176.079 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 34.3 mm-40 -65.2 -32.68 74.49 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 119.157 1.479 . . . . 0.0 109.414 169.461 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 62.5 mtt180 -118.67 -13.37 9.62 Favored 'General case' 0 C--O 1.231 0.093 0 C-N-CA 127.11 2.164 . . . . 0.0 113.466 -174.732 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 81.9 mtt180 56.58 59.72 3.44 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 124.702 1.201 . . . . 0.0 110.705 -173.8 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 4.7 t -153.94 -179.23 7.67 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 123.515 0.726 . . . . 0.0 109.051 174.475 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 98.7 m-85 -116.73 123.0 46.11 Favored 'General case' 0 C--O 1.233 0.207 0 N-CA-C 108.587 -0.894 . . . . 0.0 108.587 172.239 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -124.31 157.26 65.24 Favored Pre-proline 0 C--N 1.328 -0.357 0 C-N-CA 126.029 1.731 . . . . 0.0 110.29 -168.689 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo -72.0 130.87 17.25 Favored 'Trans proline' 0 N--CA 1.454 -0.852 0 C-N-CA 122.013 1.809 . . . . 0.0 110.933 -171.909 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -108.01 37.57 2.42 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-O 122.156 0.979 . . . . 0.0 111.089 -176.551 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.21 -28.87 68.33 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 116.061 1.874 . . . . 0.0 116.061 169.878 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -169.16 -55.3 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 119.528 1.058 . . . . 0.0 109.012 -161.307 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER 44.08 76.57 0.08 Allowed 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 128.528 2.731 . . . . 0.0 112.855 -176.762 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 5.9 t -127.84 37.7 4.15 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.3 1.44 . . . . 0.0 109.757 -178.625 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 44.16 71.86 0.23 Allowed 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 126.83 2.052 . . . . 0.0 111.48 178.232 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 51.3 t0 -103.53 75.16 1.31 Allowed 'General case' 0 N--CA 1.445 -0.712 0 N-CA-C 107.301 -1.37 . . . . 0.0 107.301 -167.451 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 76.92 10.7 86.05 Favored Glycine 0 N--CA 1.439 -1.118 0 C-N-CA 118.602 -1.761 . . . . 0.0 115.022 155.298 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 54.7 m80 56.26 21.19 5.13 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 125.086 1.354 . . . . 0.0 112.49 -163.659 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 78.0 mttt -97.53 120.64 38.27 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 106.679 -1.6 . . . . 0.0 106.679 171.885 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -64.31 104.73 0.8 Allowed 'General case' 0 CA--C 1.51 -0.565 0 N-CA-C 104.234 -2.506 . . . . 0.0 104.234 147.406 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER 44.96 -70.68 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 130.045 3.338 . . . . 0.0 114.425 162.89 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 66.75 26.16 73.02 Favored Glycine 0 N--CA 1.443 -0.851 0 N-CA-C 110.439 -1.064 . . . . 0.0 110.439 178.35 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -150.86 85.92 5.06 Favored Pre-proline 0 N--CA 1.446 -0.648 0 C-N-CA 125.891 1.676 . . . . 0.0 108.237 -173.692 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_endo -70.98 94.15 0.63 Allowed 'Trans proline' 0 CA--C 1.536 0.586 0 C-N-CA 123.055 2.503 . . . . 0.0 109.341 175.43 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 11.0 t -112.41 81.08 1.42 Allowed 'General case' 0 CA--C 1.533 0.312 0 O-C-N 121.056 -1.027 . . . . 0.0 109.07 -177.954 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -129.35 16.8 6.02 Favored 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 123.965 0.906 . . . . 0.0 109.433 172.596 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 49.1 mm-40 68.68 120.15 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 126.246 1.818 . . . . 0.0 109.415 -166.293 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 145.19 -49.02 0.68 Allowed Glycine 0 CA--C 1.53 0.97 0 C-N-CA 127.884 2.659 . . . . 0.0 110.52 -175.773 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 9.5 ttmm -148.77 16.99 0.99 Allowed 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 125.054 1.341 . . . . 0.0 111.517 -167.984 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -57.85 -46.0 85.42 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 124.78 1.232 . . . . 0.0 110.393 -167.422 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 17.1 pttm -136.4 -35.52 0.74 Allowed 'General case' 0 CA--C 1.53 0.175 0 CA-C-O 117.113 -1.422 . . . . 0.0 112.303 -178.618 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 18.1 mtmt -76.73 170.34 16.63 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 119.916 1.234 . . . . 0.0 110.472 178.924 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 72.7 mm-40 45.26 61.71 2.45 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 127.212 2.205 . . . . 0.0 111.703 174.21 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 3.7 ptpp? -124.04 49.66 1.74 Allowed 'General case' 0 C--O 1.237 0.436 0 C-N-CA 126.17 1.788 . . . . 0.0 108.785 169.269 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 28.7 m-70 -72.4 175.9 5.81 Favored 'General case' 0 CA--C 1.539 0.532 0 O-C-N 121.741 -0.599 . . . . 0.0 111.729 -178.459 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 57.8 mtpt -119.96 -29.22 4.99 Favored 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 112.868 0.692 . . . . 0.0 112.868 -166.208 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 6.9 t -156.35 42.27 0.38 Allowed 'General case' 0 C--N 1.321 -0.635 0 C-N-CA 127.315 2.246 . . . . 0.0 105.8 -179.889 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 29.2 mtpp . . . . . 0 C--O 1.25 1.098 0 CA-C-O 116.691 -1.623 . . . . 0.0 110.742 -135.973 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.546 0 N-CA-C 110.663 -0.975 . . . . 0.0 110.663 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 22.6 p80 -117.65 -172.76 2.3 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 125.719 1.608 . . . . 0.0 108.572 179.122 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 27.2 ptt? -117.05 161.23 19.74 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 108.639 -0.875 . . . . 0.0 108.639 169.851 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -151.14 171.19 17.76 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 124.581 1.152 . . . . 0.0 108.419 173.243 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -118.13 -87.09 0.63 Allowed 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 106.504 -1.665 . . . . 0.0 106.504 173.173 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 4.7 t -153.1 35.4 0.47 Allowed 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 129.028 2.931 . . . . 0.0 106.71 168.405 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 9.2 p90 -77.48 -11.79 59.89 Favored 'General case' 0 C--O 1.236 0.349 0 O-C-N 120.985 -1.072 . . . . 0.0 112.228 -174.593 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 5.3 t -63.55 171.1 2.75 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-O 122.001 0.905 . . . . 0.0 110.822 178.263 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 1.1 pt20 -62.72 175.17 0.86 Allowed 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 124.993 1.317 . . . . 0.0 110.523 170.581 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 -75.61 158.29 83.3 Favored Pre-proline 0 C--O 1.239 0.53 0 O-C-N 121.815 -0.553 . . . . 0.0 110.96 -175.361 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_endo -75.79 -178.07 4.07 Favored 'Trans proline' 0 N--CA 1.455 -0.757 0 C-N-CA 123.571 2.847 . . . . 0.0 110.288 168.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 13.8 t -109.81 87.64 5.83 Favored Pre-proline 0 CA--C 1.544 0.719 0 C-N-CA 126.95 2.1 . . . . 0.0 108.58 -170.38 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 25.1 Cg_endo -77.1 -178.25 4.44 Favored 'Trans proline' 0 CA--C 1.539 0.769 0 C-N-CA 124.552 3.501 . . . . 0.0 111.726 -173.76 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 22.7 t0 -152.5 142.48 22.19 Favored 'General case' 0 N--CA 1.468 0.437 0 O-C-N 121.473 -0.767 . . . . 0.0 110.102 166.417 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 12.5 p -62.65 -19.95 24.02 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.64 0 O-C-N 121.336 -0.853 . . . . 0.0 110.971 174.089 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 17.4 m -59.41 -10.55 3.3 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.804 1.242 . . . . 0.0 113.914 173.276 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.4 t -115.97 9.26 14.85 Favored 'General case' 0 CA--C 1.545 0.767 0 CA-C-N 120.159 1.345 . . . . 0.0 111.199 177.729 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 11.4 m-30 -89.01 167.68 12.97 Favored 'General case' 0 C--O 1.236 0.36 0 O-C-N 120.837 -1.165 . . . . 0.0 111.756 -178.224 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 43.9 mt-30 -98.54 129.69 45.1 Favored 'General case' 0 C--O 1.224 -0.268 0 N-CA-C 107.455 -1.313 . . . . 0.0 107.455 170.652 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 69.2 t80 -73.62 150.25 41.49 Favored 'General case' 0 C--O 1.24 0.577 0 CA-C-N 119.239 0.927 . . . . 0.0 108.742 161.281 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -126.25 93.83 3.92 Favored 'General case' 0 C--O 1.233 0.206 0 N-CA-C 107.513 -1.292 . . . . 0.0 107.513 175.541 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.82 -27.46 51.47 Favored 'General case' 0 N--CA 1.462 0.141 0 C-N-CA 124.864 1.265 . . . . 0.0 112.676 -179.677 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 13.5 t -50.95 -30.67 15.54 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 126.084 1.754 . . . . 0.0 112.385 173.43 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 31.0 m -139.18 -13.11 1.19 Allowed 'General case' 0 CA--C 1.532 0.255 0 N-CA-C 114.004 1.113 . . . . 0.0 114.004 -172.759 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 77.11 39.65 26.79 Favored Glycine 0 CA--C 1.527 0.841 0 CA-C-N 119.623 1.101 . . . . 0.0 111.651 174.181 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 4.8 m-85 -129.0 171.56 12.23 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 126.833 2.053 . . . . 0.0 107.317 170.691 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 84.2 m-85 -102.79 151.35 22.51 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 124.851 1.261 . . . . 0.0 107.717 163.92 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 37.4 t80 -117.59 139.98 50.24 Favored 'General case' 0 N--CA 1.45 -0.446 0 C-N-CA 126.801 2.04 . . . . 0.0 107.977 174.824 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -113.91 84.06 8.29 Favored Pre-proline 0 N--CA 1.439 -1.014 0 C-N-CA 125.705 1.602 . . . . 0.0 108.939 -162.184 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_endo -64.83 -14.42 44.88 Favored 'Trans proline' 0 C--N 1.349 0.587 0 C-N-CA 123.143 2.562 . . . . 0.0 113.176 -176.881 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 26.9 tt0 -69.38 -20.29 63.82 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 126.349 1.859 . . . . 0.0 111.495 -178.786 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -146.69 -33.63 0.3 Allowed 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 125.235 1.414 . . . . 0.0 112.391 -166.732 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 91.98 39.3 5.51 Favored Glycine 0 CA--C 1.527 0.831 0 C-N-CA 125.079 1.323 . . . . 0.0 111.648 -176.89 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 10.0 mt -122.66 -179.2 4.14 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 125.707 1.603 . . . . 0.0 108.012 177.546 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 47.2 m-85 -123.14 154.98 37.91 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 123.447 0.699 . . . . 0.0 109.369 166.61 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 39.7 t80 -124.41 158.38 32.87 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 127.376 2.27 . . . . 0.0 110.195 177.081 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 15.5 t0 -132.42 142.05 43.5 Favored Pre-proline 0 N--CA 1.468 0.461 0 C-N-CA 126.124 1.77 . . . . 0.0 108.253 -179.414 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo -81.1 -30.18 1.74 Allowed 'Trans proline' 0 C--O 1.239 0.572 0 C-N-CA 122.345 2.03 . . . . 0.0 114.18 -174.577 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -76.74 -30.4 56.58 Favored 'General case' 0 N--CA 1.453 -0.309 0 O-C-N 121.141 -0.974 . . . . 0.0 110.833 173.365 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' SER . . . . . 0.408 ' C ' ' H ' ' A' ' 42' ' ' TYR . 48.9 m -136.92 98.08 3.68 Favored 'General case' 0 C--O 1.219 -0.527 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 -168.82 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 26.9 mp0 -56.97 -6.68 0.37 Allowed 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 125.942 1.697 . . . . 0.0 113.782 -178.985 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . 0.408 ' H ' ' C ' ' A' ' 40' ' ' SER . 25.4 m-85 -66.26 103.51 1.01 Allowed 'General case' 0 N--CA 1.446 -0.643 0 C-N-CA 126.049 1.74 . . . . 0.0 107.803 173.549 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 50.2 m-85 -59.56 156.94 12.42 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 125.056 1.342 . . . . 0.0 109.771 178.235 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 66.7 t80 -111.57 112.76 24.71 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 125.169 1.388 . . . . 0.0 108.042 177.579 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 50.3 t30 -84.15 81.41 8.82 Favored 'General case' 0 N--CA 1.446 -0.651 0 C-N-CA 125.875 1.67 . . . . 0.0 109.098 178.096 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -50.21 -30.83 12.36 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 124.82 1.248 . . . . 0.0 112.354 178.425 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -53.65 -36.61 62.27 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 127.182 2.193 . . . . 0.0 113.68 -179.35 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 60.5 m -128.59 -1.0 5.52 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.656 1.182 . . . . 0.0 112.543 -179.505 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 20.6 mt-30 65.7 35.97 6.6 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.799 1.639 . . . . 0.0 110.166 -169.494 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -103.78 170.39 7.95 Favored 'General case' 0 N--CA 1.468 0.451 0 O-C-N 120.435 -1.416 . . . . 0.0 110.822 -175.331 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 4.2 m-85 -117.98 133.02 56.32 Favored 'General case' 0 C--O 1.234 0.245 0 C-N-CA 124.888 1.275 . . . . 0.0 107.898 177.771 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 41.9 mt -132.9 177.84 7.34 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 125.777 1.631 . . . . 0.0 109.135 -175.136 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 32.5 p90 -139.16 153.15 47.89 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 125.457 1.503 . . . . 0.0 108.697 168.611 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 57.2 t-105 -85.71 128.6 34.83 Favored 'General case' 0 C--O 1.233 0.227 0 N-CA-C 106.806 -1.554 . . . . 0.0 106.806 168.927 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 61.8 t0 -121.16 100.01 6.81 Favored 'General case' 0 N--CA 1.446 -0.657 0 N-CA-C 108.444 -0.946 . . . . 0.0 108.444 -174.743 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -71.23 -15.79 74.89 Favored Glycine 0 CA--C 1.526 0.732 0 CA-C-O 118.317 -1.268 . . . . 0.0 112.835 176.95 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -62.99 -43.96 97.35 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 119.615 1.708 . . . . 0.0 107.028 173.389 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 5.6 mtt180 -107.1 -6.44 17.39 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 125.097 1.359 . . . . 0.0 113.288 -170.494 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 86.1 mtt180 43.88 60.81 2.55 Favored 'General case' 0 CA--C 1.52 -0.205 0 C-N-CA 127.989 2.515 . . . . 0.0 109.753 -169.874 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 6.2 t -150.2 172.2 15.71 Favored 'General case' 0 N--CA 1.447 -0.594 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 -179.831 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 74.0 m-85 -104.43 129.16 52.41 Favored 'General case' 0 C--O 1.236 0.363 0 N-CA-C 108.701 -0.852 . . . . 0.0 108.701 166.223 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -126.16 154.98 74.32 Favored Pre-proline 0 C--N 1.327 -0.388 0 C-N-CA 127.272 2.229 . . . . 0.0 108.815 -177.142 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 68.5 Cg_endo -75.39 137.73 21.24 Favored 'Trans proline' 0 N--CA 1.456 -0.691 0 C-N-CA 122.104 1.869 . . . . 0.0 111.726 -176.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -107.65 29.11 7.51 Favored 'General case' 0 N--CA 1.461 0.113 0 C-N-CA 124.847 1.259 . . . . 0.0 111.703 -178.047 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 7.6 mp -56.72 -63.2 1.28 Allowed 'General case' 0 N--CA 1.448 -0.571 0 N-CA-C 107.553 -1.277 . . . . 0.0 107.553 161.239 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 17.7 tp10 -124.35 -52.65 1.72 Allowed 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 112.961 0.726 . . . . 0.0 112.961 -161.551 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . 0.265 17.0 pt20 47.69 18.63 0.13 Allowed 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 126.49 1.916 . . . . 0.0 116.148 -176.442 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 1.8 t -120.71 14.83 11.8 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 125.089 1.356 . . . . 0.0 113.524 -166.993 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 62.06 53.87 2.88 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 124.816 1.246 . . . . 0.0 111.671 179.372 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -82.36 -68.93 0.66 Allowed 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 115.831 -0.622 . . . . 0.0 109.998 174.158 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 173.53 -156.41 24.09 Favored Glycine 0 CA--C 1.528 0.899 0 C-N-CA 125.92 1.724 . . . . 0.0 109.542 -171.299 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 40.9 t-80 -123.75 19.77 9.4 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 126.407 1.883 . . . . 0.0 110.998 -179.185 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 89.4 mttt -68.5 100.69 1.13 Allowed 'General case' 0 C--O 1.225 -0.193 0 C-N-CA 124.885 1.274 . . . . 0.0 110.704 -165.523 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . 0.413 ' C ' ' H ' ' A' ' 76' ' ' GLY . 3.9 tt0 44.99 74.67 0.12 Allowed 'General case' 0 CA--C 1.517 -0.295 0 C-N-CA 124.857 1.263 . . . . 0.0 109.594 -165.885 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 1.8 m 75.48 -37.52 0.33 Allowed 'General case' 0 CA--C 1.537 0.454 0 O-C-N 121.492 -0.755 . . . . 0.0 111.268 167.135 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . 0.413 ' H ' ' C ' ' A' ' 74' ' ' GLU . . . 164.75 174.31 34.34 Favored Glycine 0 CA--C 1.527 0.791 0 C-N-CA 124.781 1.181 . . . . 0.0 110.931 -168.71 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -108.51 158.07 34.89 Favored Pre-proline 0 CA--C 1.537 0.446 0 C-N-CA 123.895 0.878 . . . . 0.0 110.63 -174.132 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_endo -73.19 125.03 9.95 Favored 'Trans proline' 0 N--CA 1.456 -0.735 0 C-N-CA 122.486 2.124 . . . . 0.0 109.363 171.16 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 1.7 m -136.06 84.53 2.09 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 107.874 -1.158 . . . . 0.0 107.874 171.901 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 7.9 tptm -155.49 -16.97 0.11 Allowed 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 125.448 1.499 . . . . 0.0 112.524 177.212 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 80.1 mt-10 -74.25 9.05 1.81 Allowed 'General case' 0 CA--C 1.547 0.845 0 O-C-N 120.233 -1.542 . . . . 0.0 112.628 -177.949 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 102.19 -24.73 30.16 Favored Glycine 0 C--N 1.335 0.497 0 C-N-CA 124.996 1.284 . . . . 0.0 112.208 170.508 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 5.1 mptt -84.28 12.11 7.19 Favored 'General case' 0 C--O 1.215 -0.726 0 CA-C-O 116.868 -1.539 . . . . 0.0 111.353 168.716 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 18.0 pt-20 -45.57 19.67 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.043 1 C-N-CA 134.779 5.232 . . . . 0.0 118.329 -176.534 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 1.8 tmtp? -178.83 -21.86 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 128.493 2.717 . . . . 0.0 111.288 -155.946 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -145.54 22.04 1.48 Allowed 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 127.357 2.263 . . . . 0.0 110.809 -160.949 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . 0.499 ' CD ' ' H ' ' A' ' 87' ' ' GLU . 0.2 OUTLIER -66.25 48.67 0.03 OUTLIER 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 128.972 2.909 . . . . 0.0 112.594 176.293 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 46.1 mttp -113.98 110.48 20.13 Favored 'General case' 0 N--CA 1.449 -0.517 0 N-CA-C 106.145 -1.798 . . . . 0.0 106.145 173.052 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 41.5 m80 -66.13 153.87 41.21 Favored 'General case' 0 C--O 1.238 0.49 0 N-CA-C 107.847 -1.168 . . . . 0.0 107.847 167.58 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 7.0 mmtp -78.01 96.07 4.99 Favored 'General case' 0 N--CA 1.462 0.144 0 N-CA-C 106.491 -1.67 . . . . 0.0 106.491 164.525 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -144.83 149.07 34.77 Favored 'General case' 0 C--O 1.237 0.402 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 176.953 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 3.3 ttpp . . . . . 0 C--O 1.247 0.969 0 CA-C-O 117.156 -1.402 . . . . 0.0 109.691 -162.67 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.733 0 N-CA-C 108.28 -1.928 . . . . 0.0 108.28 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 97.2 m-70 -130.69 146.52 52.19 Favored 'General case' 0 C--O 1.234 0.282 0 N-CA-C 108.277 -1.008 . . . . 0.0 108.277 -177.191 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 7.8 ptt? -161.33 -169.3 2.27 Favored 'General case' 0 N--CA 1.45 -0.444 0 C-N-CA 127.103 2.161 . . . . 0.0 107.335 168.179 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 46.6 mt-30 -59.7 165.16 3.18 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 123.892 0.877 . . . . 0.0 110.768 171.774 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 1.8 pt-20 -147.54 -86.74 0.09 Allowed 'General case' 0 C--O 1.233 0.194 0 O-C-N 121.628 -0.67 . . . . 0.0 109.348 -175.777 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -161.61 11.71 0.08 Allowed 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 123.26 0.624 . . . . 0.0 111.789 -174.256 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 38.3 p90 -73.61 -28.68 61.94 Favored 'General case' 0 C--O 1.232 0.17 0 O-C-N 121.155 -0.966 . . . . 0.0 110.726 -166.581 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER 60.42 150.95 0.02 OUTLIER 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 129.448 3.099 . . . . 0.0 113.386 178.212 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -153.54 -178.67 7.16 Favored 'General case' 0 N--CA 1.45 -0.473 0 O-C-N 121.248 -0.908 . . . . 0.0 110.344 -177.914 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 27.9 m-85 -82.93 164.33 46.99 Favored Pre-proline 0 CA--C 1.536 0.432 0 C-N-CA 124.643 1.177 . . . . 0.0 111.52 -167.842 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -65.67 170.09 11.83 Favored 'Trans proline' 0 CA--C 1.536 0.582 0 C-N-CA 123.819 3.012 . . . . 0.0 109.842 165.313 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 42.4 t -109.23 86.19 3.96 Favored Pre-proline 0 CA--C 1.536 0.428 0 C-N-CA 125.277 1.431 . . . . 0.0 108.539 -170.479 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 42.1 Cg_endo -75.93 166.78 27.44 Favored 'Trans proline' 0 N--CA 1.449 -1.103 0 C-N-CA 121.74 1.627 . . . . 0.0 110.34 -174.366 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 61.5 t0 -142.61 129.38 20.47 Favored 'General case' 0 C--O 1.237 0.412 0 N-CA-C 107.08 -1.452 . . . . 0.0 107.08 173.838 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 12.3 p -53.85 -24.55 10.57 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.352 0 C-N-CA 124.626 1.17 . . . . 0.0 111.995 176.039 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 38.7 t -45.54 -29.54 1.2 Allowed 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.74 1.616 . . . . 0.0 112.389 170.267 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 49.0 p -109.68 2.22 20.03 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 125.149 1.38 . . . . 0.0 112.879 -171.557 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 15.7 m-30 -77.37 175.49 9.72 Favored 'General case' 0 C--O 1.236 0.382 0 O-C-N 121.302 -0.873 . . . . 0.0 110.605 -178.973 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 80.9 mt-30 -116.85 106.59 13.62 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 125.263 1.425 . . . . 0.0 107.473 -176.313 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 49.4 t80 -66.34 147.11 53.78 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.826 -0.435 . . . . 0.0 109.826 176.371 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -135.08 86.0 2.22 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 125.319 1.448 . . . . 0.0 107.203 176.709 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -49.86 -32.22 13.86 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 126.946 2.098 . . . . 0.0 113.635 179.415 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 7.1 t -60.54 -18.65 53.61 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 125.035 1.334 . . . . 0.0 112.503 179.165 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 58.6 m -107.17 -50.3 3.11 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 118.965 0.802 . . . . 0.0 109.582 153.967 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 117.27 9.56 10.38 Favored Glycine 0 CA--C 1.522 0.499 0 C-N-CA 125.452 1.501 . . . . 0.0 112.05 -172.048 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -105.63 168.94 8.77 Favored 'General case' 0 CA--C 1.519 -0.236 0 CA-C-N 118.576 1.188 . . . . 0.0 109.011 -175.443 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 94.8 m-85 -93.33 147.37 22.99 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 107.602 -1.258 . . . . 0.0 107.602 167.884 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 14.9 t80 -111.96 136.11 51.72 Favored 'General case' 0 N--CA 1.442 -0.871 0 C-N-CA 126.35 1.86 . . . . 0.0 107.027 171.57 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -119.69 77.71 21.29 Favored Pre-proline 0 N--CA 1.437 -1.091 0 C-N-CA 125.407 1.483 . . . . 0.0 108.773 -162.874 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 22.6 Cg_endo -62.9 -12.13 27.82 Favored 'Trans proline' 0 C--N 1.348 0.518 0 C-N-CA 122.83 2.354 . . . . 0.0 113.445 -176.861 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 21.0 mm-40 -62.71 -19.92 64.38 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.68 0.792 . . . . 0.0 111.111 174.459 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 5.8 p -141.74 -23.58 0.71 Allowed 'General case' 0 C--O 1.234 0.286 0 N-CA-C 113.834 1.049 . . . . 0.0 113.834 178.569 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 79.03 43.2 11.08 Favored Glycine 0 CA--C 1.531 1.034 0 N-CA-C 109.905 -1.278 . . . . 0.0 109.905 -166.301 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 42.3 mt -111.84 178.55 4.28 Favored 'General case' 0 C--O 1.234 0.282 0 C-N-CA 124.712 1.205 . . . . 0.0 108.175 165.659 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 36.9 m-85 -123.65 154.63 39.09 Favored 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 124.883 1.273 . . . . 0.0 107.605 166.304 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 24.3 t80 -131.02 156.06 45.79 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 125.414 1.485 . . . . 0.0 109.358 -178.217 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -127.22 144.15 49.62 Favored Pre-proline 0 CA--C 1.536 0.436 0 C-N-CA 123.649 0.78 . . . . 0.0 110.359 175.529 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -74.28 -31.75 7.21 Favored 'Trans proline' 0 CA--C 1.535 0.54 0 C-N-CA 122.894 2.396 . . . . 0.0 113.849 -176.758 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 8.5 m-80 -75.38 -29.62 59.91 Favored 'General case' 0 N--CA 1.462 0.144 0 CA-C-N 119.346 0.976 . . . . 0.0 109.925 170.395 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' SER . . . . . 0.416 ' C ' ' H ' ' A' ' 42' ' ' TYR . 0.7 OUTLIER -129.64 89.73 2.88 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 123.881 0.873 . . . . 0.0 109.841 -158.267 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -68.15 9.94 0.27 Allowed 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 124.49 1.116 . . . . 0.0 112.913 -177.627 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . 0.416 ' H ' ' C ' ' A' ' 40' ' ' SER . 56.6 m-85 -81.78 112.77 19.24 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 126.589 1.956 . . . . 0.0 106.947 170.314 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 23.1 m-85 -77.96 124.49 28.07 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 124.255 1.022 . . . . 0.0 111.036 -177.681 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 92.1 t80 -77.2 118.85 20.12 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 125.153 1.381 . . . . 0.0 108.983 178.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 26.4 t30 -90.41 83.96 5.96 Favored 'General case' 0 CA--C 1.512 -0.489 0 C-N-CA 125.432 1.493 . . . . 0.0 109.565 -178.558 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -53.26 -26.03 16.64 Favored 'General case' 0 CA--C 1.538 0.504 0 N-CA-C 114.37 1.248 . . . . 0.0 114.37 -173.734 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -52.67 -66.01 0.46 Allowed 'General case' 0 C--O 1.236 0.343 0 C-N-CA 125.898 1.679 . . . . 0.0 109.084 178.178 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 19.2 m -112.69 22.67 14.3 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 124.922 1.289 . . . . 0.0 111.258 -171.272 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . 0.337 5.3 pt20 44.65 34.14 1.08 Allowed 'General case' 0 CA--C 1.554 1.11 0 C-N-CA 126.72 2.008 . . . . 0.0 113.312 -178.525 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 7.0 mm-40 -97.47 152.69 18.73 Favored 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 126.483 1.913 . . . . 0.0 112.26 178.844 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 3.4 m-30 -95.57 139.72 31.42 Favored 'General case' 0 N--CA 1.47 0.566 0 O-C-N 120.833 -1.167 . . . . 0.0 108.762 172.862 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 41.4 mt -131.33 174.29 10.21 Favored 'General case' 0 N--CA 1.465 0.279 0 C-N-CA 126.749 2.02 . . . . 0.0 110.267 -176.478 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 31.2 p90 -143.53 149.14 37.03 Favored 'General case' 0 C--O 1.238 0.493 0 C-N-CA 124.107 0.963 . . . . 0.0 110.361 168.077 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 50.1 t-105 -93.16 92.6 7.84 Favored 'General case' 0 CA--C 1.516 -0.36 0 N-CA-C 105.075 -2.195 . . . . 0.0 105.075 -176.53 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 43.8 t0 -87.52 96.45 10.4 Favored 'General case' 0 N--CA 1.446 -0.669 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 -177.691 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -59.44 -15.37 31.55 Favored Glycine 0 CA--C 1.53 0.971 0 CA-C-O 118.414 -1.215 . . . . 0.0 112.694 178.754 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 22.7 mt-10 -66.92 -34.84 78.65 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 119.987 1.894 . . . . 0.0 110.1 175.4 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 21.1 mtt180 -109.58 -4.97 15.86 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 125.541 1.536 . . . . 0.0 111.453 -177.05 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 76.1 mtm180 44.21 49.16 7.77 Favored 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 126.374 1.87 . . . . 0.0 110.169 -174.697 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 3.2 t -147.13 178.81 8.09 Favored 'General case' 0 N--CA 1.443 -0.798 0 N-CA-C 108.909 -0.775 . . . . 0.0 108.909 -177.451 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 89.3 m-85 -109.76 131.72 54.8 Favored 'General case' 0 C--O 1.24 0.572 0 N-CA-C 108.146 -1.057 . . . . 0.0 108.146 178.1 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -125.88 154.43 73.56 Favored Pre-proline 0 C--N 1.325 -0.484 0 C-N-CA 125.788 1.635 . . . . 0.0 108.907 176.092 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -75.43 124.03 8.06 Favored 'Trans proline' 0 N--CA 1.453 -0.871 0 C-N-CA 122.562 2.174 . . . . 0.0 111.105 179.497 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -85.97 56.9 4.18 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-O 122.531 1.158 . . . . 0.0 109.379 166.674 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -63.8 176.97 0.81 Allowed 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 115.106 -0.952 . . . . 0.0 110.553 153.885 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -52.81 -33.26 48.34 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 124.064 0.946 . . . . 0.0 112.683 -175.982 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 8.5 pt20 50.32 11.03 0.06 Allowed 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 129.251 3.02 . . . . 0.0 115.151 175.252 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 13.3 t -140.24 17.5 2.42 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 125.782 1.633 . . . . 0.0 110.452 -178.668 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -149.51 164.24 35.61 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 119.266 0.939 . . . . 0.0 111.35 177.179 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 56.0 t0 65.67 -83.65 0.03 OUTLIER 'General case' 0 C--O 1.236 0.39 0 C-N-CA 130.754 3.622 . . . . 0.0 109.69 172.576 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 173.61 -162.6 33.59 Favored Glycine 0 N--CA 1.437 -1.263 0 N-CA-C 108.829 -1.708 . . . . 0.0 108.829 171.062 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 12.4 m80 -65.48 83.53 0.06 Allowed 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 118.408 1.104 . . . . 0.0 108.687 165.242 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 37.8 mttm -150.3 -167.35 2.8 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 125.205 1.402 . . . . 0.0 109.77 -173.085 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -64.56 -43.88 92.52 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 124.425 1.09 . . . . 0.0 111.087 179.39 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER 53.61 -10.45 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 127.867 2.467 . . . . 0.0 116.995 -164.925 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -85.55 92.53 1.78 Allowed Glycine 0 N--CA 1.434 -1.446 0 N-CA-C 107.823 -2.111 . . . . 0.0 107.823 -160.515 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -137.73 82.35 26.88 Favored Pre-proline 0 C--O 1.24 0.603 0 N-CA-C 107.388 -1.338 . . . . 0.0 107.388 170.97 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -84.46 64.16 6.71 Favored 'Trans proline' 0 N--CA 1.457 -0.622 0 C-N-CA 124.079 3.186 . . . . 0.0 110.182 -168.762 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 1.8 p -128.41 57.06 1.6 Allowed 'General case' 0 C--N 1.328 -0.352 0 O-C-N 121.06 -1.025 . . . . 0.0 111.06 -165.202 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 4.1 tmtt? -81.25 53.62 2.08 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 120.828 -1.17 . . . . 0.0 111.172 176.424 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . 0.302 0.1 OUTLIER 51.9 6.08 0.04 OUTLIER 'General case' 0 N--CA 1.47 0.558 1 C-N-CA 132.389 4.276 . . . . 0.0 118.403 158.064 . . . . . . . . 4 3 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -179.52 -20.61 0.03 OUTLIER Glycine 0 CA--C 1.526 0.751 0 C-N-CA 127.971 2.7 . . . . 0.0 110.412 178.866 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 37.6 tttt -79.54 -16.24 56.3 Favored 'General case' 0 C--N 1.349 0.567 0 CA-C-N 119.544 1.672 . . . . 0.0 110.701 168.095 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.501 ' HG3' ' H ' ' A' ' 85' ' ' LYS . 2.2 pt-20 -42.01 -71.68 0.08 Allowed 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 125.998 1.719 . . . . 0.0 110.358 -135.938 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . 0.501 ' H ' ' HG3' ' A' ' 84' ' ' GLU . 2.3 ptmt -117.29 10.26 13.67 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 127.821 2.448 . . . . 0.0 110.751 174.78 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 84.2 tttt -80.37 -36.71 33.62 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 124.033 0.933 . . . . 0.0 112.062 -162.451 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 21.2 tp10 51.5 40.14 26.21 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 124.812 1.245 . . . . 0.0 112.617 173.059 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 36.4 mtpt 56.15 -65.29 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 129.858 3.263 . . . . 0.0 116.36 176.997 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 57.7 m80 49.48 70.29 0.5 Allowed 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 126.54 1.936 . . . . 0.0 112.326 -174.364 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 1.6 pptp? -93.11 118.15 30.89 Favored 'General case' 0 CA--C 1.529 0.144 0 C-N-CA 124.187 0.995 . . . . 0.0 109.457 -177.864 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 9.1 m -81.77 71.38 8.79 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-O 121.578 0.704 . . . . 0.0 109.406 175.607 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 1.3 mptm? . . . . . 0 C--O 1.249 1.053 0 N-CA-C 101.093 -3.669 . . . . 0.0 101.093 161.73 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.553 0 N-CA-C 109.873 -1.291 . . . . 0.0 109.873 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . 0.409 ' CD2' ' H ' ' A' ' 3' ' ' MET . 3.1 t-160 61.79 -178.15 0.12 Allowed 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 125.333 1.453 . . . . 0.0 109.873 -168.521 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' MET . . . . . 0.409 ' H ' ' CD2' ' A' ' 2' ' ' HIS . 44.8 ttm -69.4 -33.88 73.67 Favored 'General case' 0 N--CA 1.463 0.198 0 O-C-N 121.209 -0.932 . . . . 0.0 110.176 -179.944 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 10.7 pt20 -139.97 158.0 44.78 Favored 'General case' 0 N--CA 1.449 -0.503 0 C-N-CA 123.421 0.688 . . . . 0.0 110.237 -154.697 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.432 ' HG3' ' H ' ' A' ' 6' ' ' SER . 1.0 OUTLIER -84.84 -82.75 0.17 Allowed 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 106.99 -1.485 . . . . 0.0 106.99 167.508 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' SER . . . . . 0.432 ' H ' ' HG3' ' A' ' 5' ' ' GLU . 5.4 p -171.74 15.73 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 124.498 1.119 . . . . 0.0 111.152 -165.164 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 22.5 t80 -85.37 120.24 26.62 Favored 'General case' 0 N--CA 1.434 -1.242 0 N-CA-C 107.901 -1.148 . . . . 0.0 107.901 -164.756 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 25.8 p -157.87 -62.66 0.09 Allowed 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 108.456 -0.942 . . . . 0.0 108.456 -178.601 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 11.8 mm100 -130.54 -85.07 0.53 Allowed 'General case' 0 N--CA 1.437 -1.088 0 C-N-CA 126.951 2.101 . . . . 0.0 109.507 176.898 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 68.6 m-85 -97.19 159.1 32.09 Favored Pre-proline 0 CA--C 1.537 0.457 0 CA-C-N 118.757 0.708 . . . . 0.0 111.208 -179.763 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -71.7 178.47 5.71 Favored 'Trans proline' 0 N--CA 1.459 -0.514 0 C-N-CA 123.964 3.109 . . . . 0.0 110.848 167.498 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 37.1 t -104.6 85.85 1.26 Allowed Pre-proline 0 CA--C 1.541 0.609 0 C-N-CA 127.009 2.123 . . . . 0.0 108.987 -171.494 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_endo -69.91 171.71 14.14 Favored 'Trans proline' 0 C--O 1.237 0.462 0 C-N-CA 123.142 2.561 . . . . 0.0 111.045 179.845 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 14.0 t0 -144.61 139.94 28.41 Favored 'General case' 0 C--O 1.224 -0.238 0 N-CA-C 107.412 -1.329 . . . . 0.0 107.412 178.401 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 6.5 p -65.61 -19.89 26.46 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.599 0 CA-C-N 119.291 0.951 . . . . 0.0 111.22 175.382 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 10.6 t -60.42 -17.83 46.87 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-O 117.334 -1.317 . . . . 0.0 112.092 173.079 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 29.7 p -100.15 -6.13 26.7 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 121.577 1.989 . . . . 0.0 113.028 176.005 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 13.3 m-30 -70.74 173.67 6.96 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 119.531 1.06 . . . . 0.0 112.472 -174.322 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 77.0 mt-30 -114.79 109.28 17.94 Favored 'General case' 0 CA--C 1.528 0.122 0 C-N-CA 126.142 1.777 . . . . 0.0 108.949 176.745 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 81.8 t80 -68.64 142.08 55.2 Favored 'General case' 0 C--O 1.238 0.491 0 CA-C-N 119.343 0.974 . . . . 0.0 110.674 169.708 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 3.6 t0 -119.71 111.42 18.0 Favored 'General case' 0 CA--C 1.504 -0.822 0 N-CA-C 106.686 -1.598 . . . . 0.0 106.686 170.817 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -64.2 -21.94 66.75 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 118.155 -0.926 . . . . 0.0 112.927 178.082 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 1.3 t -61.34 -38.76 88.1 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 118.327 0.512 . . . . 0.0 110.555 -171.82 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 7.8 m -113.36 -19.34 11.77 Favored 'General case' 0 C--O 1.233 0.219 0 C-N-CA 124.703 1.201 . . . . 0.0 111.018 173.87 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 81.46 34.49 25.51 Favored Glycine 0 C--N 1.337 0.599 0 N-CA-C 110.74 -0.944 . . . . 0.0 110.74 174.692 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 4.4 m-85 -119.69 171.05 8.66 Favored 'General case' 0 N--CA 1.463 0.213 0 C-N-CA 126.482 1.913 . . . . 0.0 108.352 178.475 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 67.5 m-85 -103.76 141.01 36.83 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 107.701 -1.222 . . . . 0.0 107.701 171.929 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 52.3 t80 -102.2 136.91 41.21 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 125.868 1.667 . . . . 0.0 106.574 169.91 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 16.7 t0 -97.82 87.45 0.53 Allowed Pre-proline 0 C--N 1.327 -0.387 0 C-N-CA 126.458 1.903 . . . . 0.0 110.332 179.826 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -61.51 -10.54 16.63 Favored 'Trans proline' 0 CA--C 1.537 0.647 0 C-N-CA 121.618 1.546 . . . . 0.0 113.236 176.22 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -80.88 -13.52 58.85 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 124.643 1.177 . . . . 0.0 112.219 -177.784 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 69.8 p -146.48 -23.81 0.43 Allowed 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 113.98 1.104 . . . . 0.0 113.98 168.2 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 108.14 3.27 33.7 Favored Glycine 0 CA--C 1.53 1.009 0 C-N-CA 124.881 1.229 . . . . 0.0 113.936 -179.272 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 39.4 mt -71.38 178.19 3.55 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 125.562 1.545 . . . . 0.0 110.587 173.983 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 54.3 m-85 -116.7 167.19 11.31 Favored 'General case' 0 C--O 1.237 0.424 0 C-N-CA 124.682 1.193 . . . . 0.0 108.333 158.295 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 80.3 t80 -141.4 163.06 33.97 Favored 'General case' 0 C--O 1.237 0.431 0 C-N-CA 126.376 1.87 . . . . 0.0 108.916 176.808 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -133.11 143.9 50.39 Favored Pre-proline 0 CA--C 1.536 0.406 0 C-N-CA 124.189 0.996 . . . . 0.0 110.503 177.971 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -73.71 -38.65 2.27 Favored 'Trans proline' 0 N--CA 1.454 -0.84 0 C-N-CA 123.236 2.624 . . . . 0.0 112.656 -176.017 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 27.0 m-80 -78.13 -35.97 48.38 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-N 119.091 0.86 . . . . 0.0 110.414 -178.272 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 48.8 p -130.86 91.95 3.14 Favored 'General case' 0 C--O 1.223 -0.301 0 N-CA-C 108.379 -0.971 . . . . 0.0 108.379 -159.886 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -60.79 0.17 0.23 Allowed 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 126.311 1.844 . . . . 0.0 115.549 -163.828 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 38.2 m-85 -68.53 123.98 22.33 Favored 'General case' 0 N--CA 1.448 -0.575 0 C-N-CA 125.134 1.374 . . . . 0.0 108.927 174.271 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 25.6 m-85 -75.92 141.64 42.25 Favored 'General case' 0 N--CA 1.448 -0.54 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 175.789 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 56.9 t80 -102.51 115.32 30.34 Favored 'General case' 0 C--N 1.33 -0.242 0 C-N-CA 123.949 0.899 . . . . 0.0 109.288 176.318 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 26.4 t30 -88.29 87.16 7.21 Favored 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 106.992 -1.484 . . . . 0.0 106.992 172.43 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -48.62 -39.6 24.59 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 124.618 1.167 . . . . 0.0 110.112 175.858 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -55.95 -11.34 1.02 Allowed 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 127.673 2.389 . . . . 0.0 116.409 -177.807 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -145.02 6.56 1.16 Allowed 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 119.728 1.149 . . . . 0.0 111.268 160.847 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 50.4 mt-30 64.94 15.78 10.14 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 129.345 3.058 . . . . 0.0 113.273 -168.045 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.92 148.64 49.89 Favored 'General case' 0 N--CA 1.466 0.334 0 O-C-N 121.096 -1.003 . . . . 0.0 111.19 -179.399 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 8.8 m-85 -106.34 132.31 52.53 Favored 'General case' 0 C--O 1.234 0.262 0 N-CA-C 108.165 -1.05 . . . . 0.0 108.165 168.037 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 78.5 mt -135.17 -176.03 4.12 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 127.136 2.174 . . . . 0.0 107.511 -172.741 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 19.6 p90 -146.7 160.24 42.47 Favored 'General case' 0 C--O 1.235 0.316 0 O-C-N 120.758 -1.213 . . . . 0.0 109.527 163.871 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 45.9 t-105 -82.39 105.07 13.15 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 125.15 1.38 . . . . 0.0 108.068 173.104 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 23.1 t0 -89.94 96.86 10.87 Favored 'General case' 0 C--O 1.235 0.339 0 N-CA-C 105.986 -1.857 . . . . 0.0 105.986 170.858 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -76.49 -7.38 85.35 Favored Glycine 0 CA--C 1.531 1.075 0 CA-C-O 118.235 -1.314 . . . . 0.0 112.804 -179.989 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 25.3 mt-10 -73.58 -48.6 31.55 Favored 'General case' 0 C--N 1.341 0.236 0 CA-C-N 119.853 1.827 . . . . 0.0 108.808 172.158 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -81.02 -14.62 57.74 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.631 1.172 . . . . 0.0 112.449 174.01 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.9 mpt_? 46.91 61.42 2.85 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 125.436 1.495 . . . . 0.0 109.913 -164.339 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 5.6 t -150.38 174.85 12.42 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-O 121.543 0.687 . . . . 0.0 109.978 174.059 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 93.6 m-85 -108.63 121.25 44.63 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 125.158 1.383 . . . . 0.0 108.106 179.028 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -125.21 154.31 71.82 Favored Pre-proline 0 C--N 1.324 -0.514 0 C-N-CA 125.403 1.481 . . . . 0.0 110.25 -170.263 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_endo -70.0 126.57 13.3 Favored 'Trans proline' 0 N--CA 1.454 -0.843 0 C-N-CA 122.479 2.119 . . . . 0.0 110.527 178.937 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -86.62 12.74 9.88 Favored 'General case' 0 C--N 1.332 -0.158 0 N-CA-C 114.235 1.198 . . . . 0.0 114.235 -173.621 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 5.1 mp -144.37 -85.13 0.14 Allowed 'General case' 0 N--CA 1.444 -0.73 0 C-N-CA 126.995 2.118 . . . . 0.0 108.011 -166.91 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -155.29 -63.84 0.12 Allowed 'General case' 0 N--CA 1.446 -0.664 0 C-N-CA 128.943 2.897 . . . . 0.0 104.911 176.188 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 48.31 173.79 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 130.231 3.412 . . . . 0.0 115.224 170.595 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 1.8 t 67.09 145.89 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 126.324 1.849 . . . . 0.0 110.559 -168.791 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 54.11 49.46 18.72 Favored 'General case' 0 C--O 1.239 0.523 0 C-N-CA 125.917 1.687 . . . . 0.0 112.704 179.443 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -60.36 137.0 58.21 Favored 'General case' 0 N--CA 1.447 -0.591 0 N-CA-C 106.764 -1.569 . . . . 0.0 106.764 168.45 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -154.75 -108.09 0.3 Allowed Glycine 0 N--CA 1.444 -0.775 0 N-CA-C 110.299 -1.12 . . . . 0.0 110.299 -163.643 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 1.4 m80 -134.02 56.22 1.86 Allowed 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 128.497 2.719 . . . . 0.0 106.369 170.691 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 48.5 mttt -142.59 -176.72 4.97 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 126.544 1.938 . . . . 0.0 107.881 -166.336 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -67.85 -75.24 0.1 Allowed 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 119.202 0.91 . . . . 0.0 109.364 177.844 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -125.75 -49.43 1.62 Allowed 'General case' 0 CA--C 1.516 -0.344 0 C-N-CA 124.873 1.269 . . . . 0.0 111.083 -179.015 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -142.63 162.18 27.37 Favored Glycine 0 N--CA 1.446 -0.684 0 N-CA-C 108.374 -1.89 . . . . 0.0 108.374 179.448 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . 174.02 160.99 0.33 Allowed Pre-proline 0 CA--C 1.537 0.463 0 C-N-CA 126.576 1.951 . . . . 0.0 109.922 164.351 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_endo -71.83 -176.59 2.12 Favored 'Trans proline' 0 CA--C 1.536 0.576 0 C-N-CA 124.535 3.49 . . . . 0.0 112.528 177.586 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 38.0 m -45.37 114.35 0.73 Allowed 'General case' 0 C--O 1.242 0.677 0 C-N-CA 125.114 1.365 . . . . 0.0 109.133 162.874 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 9.0 tmtt? -134.47 28.13 3.69 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 126.377 1.871 . . . . 0.0 107.664 -174.614 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 23.5 tt0 67.59 134.55 0.03 OUTLIER 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 127.821 2.448 . . . . 0.0 110.078 -168.943 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 95.24 -0.72 64.08 Favored Glycine 0 N--CA 1.466 0.68 0 O-C-N 120.91 -1.119 . . . . 0.0 112.485 159.344 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -149.84 16.61 0.87 Allowed 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 126.655 1.982 . . . . 0.0 108.994 172.108 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -59.88 132.76 54.94 Favored 'General case' 0 C--O 1.232 0.144 0 O-C-N 120.954 -1.091 . . . . 0.0 108.948 -172.004 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 50.39 18.66 0.46 Allowed 'General case' 0 CA--C 1.545 0.757 0 N-CA-C 114.386 1.254 . . . . 0.0 114.386 -177.262 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 72.0 mmtt 47.66 56.38 7.18 Favored 'General case' 0 N--CA 1.461 0.099 0 C-N-CA 124.734 1.214 . . . . 0.0 110.526 -171.264 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.23 97.91 0.1 Allowed 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 108.326 -0.99 . . . . 0.0 108.326 154.709 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 25.6 ttmt -114.51 129.01 56.63 Favored 'General case' 0 N--CA 1.464 0.271 0 N-CA-C 107.064 -1.458 . . . . 0.0 107.064 -178.037 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 27.4 m170 -131.61 162.37 30.5 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 123.236 0.614 . . . . 0.0 110.469 178.411 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 8.0 ttpp -97.09 119.49 35.67 Favored 'General case' 0 CA--C 1.515 -0.368 0 N-CA-C 106.803 -1.554 . . . . 0.0 106.803 175.296 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 3.3 p -130.51 152.86 49.43 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 108.049 -1.093 . . . . 0.0 108.049 168.982 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 27.6 mttm . . . . . 0 C--O 1.248 0.989 0 N-CA-C 105.524 -2.028 . . . . 0.0 105.524 -151.921 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.268 0 N-CA-C 110.485 -1.046 . . . . 0.0 110.485 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 77.8 m80 -143.58 105.52 4.36 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 118.41 1.105 . . . . 0.0 109.758 -178.913 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 78.7 mtm -141.72 144.1 33.87 Favored 'General case' 0 C--N 1.333 -0.123 0 C-N-CA 124.085 0.954 . . . . 0.0 108.674 165.876 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 8.3 mt-30 44.68 74.38 0.13 Allowed 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 128.092 2.557 . . . . 0.0 112.672 179.193 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 27.1 tt0 -64.64 -12.41 45.68 Favored 'General case' 0 CA--C 1.55 0.955 0 O-C-N 121.565 -0.709 . . . . 0.0 112.819 179.131 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 18.9 m 48.67 81.89 0.05 OUTLIER 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 126.732 2.013 . . . . 0.0 112.8 162.733 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 32.3 p90 -122.29 115.08 21.71 Favored 'General case' 0 N--CA 1.45 -0.443 0 O-C-N 121.347 -0.846 . . . . 0.0 110.755 -157.363 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 89.5 p -152.49 -31.01 0.14 Allowed 'General case' 0 C--N 1.326 -0.43 0 C-N-CA 124.407 1.083 . . . . 0.0 111.302 174.474 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -66.0 -172.76 0.15 Allowed 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.767 1.627 . . . . 0.0 111.473 173.79 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 49.9 m-85 -95.0 161.11 29.38 Favored Pre-proline 0 CA--C 1.547 0.837 0 O-C-N 121.267 -0.895 . . . . 0.0 112.579 -170.532 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -69.08 -176.51 1.32 Allowed 'Trans proline' 0 CA--C 1.539 0.742 0 C-N-CA 124.672 3.582 . . . . 0.0 110.699 164.336 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 45.9 t -107.89 86.79 3.26 Favored Pre-proline 0 CA--C 1.541 0.625 0 C-N-CA 125.612 1.565 . . . . 0.0 109.351 -178.881 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 94.3 Cg_endo -67.76 154.81 72.17 Favored 'Trans proline' 0 C--N 1.348 0.523 0 C-N-CA 123.276 2.651 . . . . 0.0 111.772 175.513 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -127.13 129.17 47.41 Favored 'General case' 0 N--CA 1.433 -1.277 0 C-N-CA 126.003 1.721 . . . . 0.0 109.723 -175.254 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 11.8 p -60.03 -24.44 30.02 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 O-C-N 121.776 -0.577 . . . . 0.0 111.41 173.452 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -49.84 -53.73 23.74 Favored 'General case' 0 N--CA 1.438 -1.044 0 C-N-CA 125.818 1.647 . . . . 0.0 112.213 173.507 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 4.4 t -77.91 -4.22 45.71 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-O 117.897 -1.049 . . . . 0.0 112.716 -178.985 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 11.9 m-30 -64.6 156.51 29.75 Favored 'General case' 0 C--O 1.238 0.479 0 CA-C-N 121.412 1.915 . . . . 0.0 111.018 178.888 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 63.0 mt-30 -92.74 121.67 34.37 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 124.332 1.053 . . . . 0.0 108.219 169.148 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 33.8 t80 -63.28 158.67 19.64 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 118.653 0.661 . . . . 0.0 110.639 163.085 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -135.32 108.05 7.49 Favored 'General case' 0 CA--C 1.513 -0.465 0 C-N-CA 123.992 0.917 . . . . 0.0 109.375 160.158 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 1.9 pt-20 -61.34 -25.24 67.01 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 124.636 1.174 . . . . 0.0 112.675 177.912 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 1.4 t -62.73 -50.46 71.0 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 119.388 0.995 . . . . 0.0 109.587 -177.245 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 74.2 m -78.03 -47.76 17.69 Favored 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 124.651 1.18 . . . . 0.0 109.315 173.671 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 102.43 13.51 30.36 Favored Glycine 0 CA--C 1.53 1.027 0 C-N-CA 125.153 1.359 . . . . 0.0 111.004 -168.834 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 3.8 m-85 -111.53 178.28 4.38 Favored 'General case' 0 C--O 1.227 -0.129 0 C-N-CA 126.713 2.005 . . . . 0.0 109.347 -168.635 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 72.1 m-85 -117.13 156.28 27.89 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 108.521 -0.918 . . . . 0.0 108.521 170.889 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 42.3 t80 -114.33 134.95 54.6 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 127.213 2.205 . . . . 0.0 108.78 175.866 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 56.3 t0 -98.56 87.13 0.54 Allowed Pre-proline 0 C--O 1.237 0.404 0 C-N-CA 127.366 2.266 . . . . 0.0 110.381 -178.593 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 61.7 Cg_endo -62.28 -8.55 12.7 Favored 'Trans proline' 0 N--CA 1.457 -0.671 0 C-N-CA 122.085 1.857 . . . . 0.0 114.254 -178.565 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -74.14 -28.2 61.21 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 119.473 1.033 . . . . 0.0 110.703 178.907 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' THR . . . . . 0.446 ' HB ' ' CD2' ' A' ' 34' ' ' LEU . 0.1 OUTLIER -142.35 -22.78 0.68 Allowed 'General case' 0 C--O 1.238 0.48 0 C-N-CA 124.238 1.015 . . . . 0.0 113.317 -164.901 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 103.0 -3.41 48.32 Favored Glycine 0 N--CA 1.444 -0.784 0 C-N-CA 125.091 1.329 . . . . 0.0 112.841 169.593 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.446 ' CD2' ' HB ' ' A' ' 32' ' ' THR . 0.0 OUTLIER -74.86 173.86 10.02 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 118.807 1.304 . . . . 0.0 108.298 -178.721 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 37.2 m-85 -107.14 165.05 11.65 Favored 'General case' 0 C--N 1.321 -0.639 0 C-N-CA 124.389 1.075 . . . . 0.0 108.609 162.509 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 71.2 t80 -144.0 144.69 31.78 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 126.618 1.967 . . . . 0.0 108.092 -172.672 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -113.26 143.08 28.57 Favored Pre-proline 0 C--O 1.236 0.378 0 C-N-CA 124.952 1.301 . . . . 0.0 108.513 175.706 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 91.2 Cg_endo -77.64 -29.33 4.66 Favored 'Trans proline' 0 N--CA 1.456 -0.729 0 C-N-CA 121.917 1.744 . . . . 0.0 112.423 -178.519 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -73.97 -34.6 64.32 Favored 'General case' 0 C--O 1.234 0.279 0 C-N-CA 123.983 0.913 . . . . 0.0 110.734 174.488 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 1.1 m -131.64 93.5 3.34 Favored 'General case' 0 C--O 1.222 -0.381 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 -157.471 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 8.2 mp0 -64.88 6.68 0.21 Allowed 'General case' 0 CA--C 1.549 0.922 0 O-C-N 121.083 -1.011 . . . . 0.0 113.487 -178.013 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 24.3 m-85 -77.13 104.42 7.62 Favored 'General case' 0 C--O 1.235 0.333 0 O-C-N 120.626 -1.296 . . . . 0.0 108.668 166.893 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 29.0 m-85 -64.3 162.89 13.94 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 126.955 2.102 . . . . 0.0 110.784 179.727 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 64.2 t80 -120.25 110.25 16.36 Favored 'General case' 0 CA--C 1.521 -0.143 0 C-N-CA 125.934 1.694 . . . . 0.0 109.038 179.19 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 41.9 t30 -85.29 86.6 7.36 Favored 'General case' 0 C--N 1.32 -0.716 0 C-N-CA 125.082 1.353 . . . . 0.0 109.142 175.985 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -58.37 -15.55 11.07 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 125.401 1.48 . . . . 0.0 114.049 -176.356 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -54.63 -76.5 0.03 OUTLIER 'General case' 0 CA--C 1.528 0.111 0 C-N-CA 125.027 1.331 . . . . 0.0 108.923 170.475 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 10.3 m -94.59 13.69 23.35 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.243 0.617 . . . . 0.0 110.624 -174.342 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 49.4 mt-30 56.28 24.61 8.41 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 127.3 2.24 . . . . 0.0 112.802 -173.049 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -92.75 166.84 12.25 Favored 'General case' 0 CA--C 1.532 0.285 0 O-C-N 121.269 -0.894 . . . . 0.0 111.629 -167.103 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 4.8 m-85 -109.79 138.64 45.87 Favored 'General case' 0 N--CA 1.467 0.401 0 O-C-N 121.4 -0.812 . . . . 0.0 109.117 -179.996 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 32.8 mt -134.48 179.69 6.13 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 124.82 1.248 . . . . 0.0 110.294 -177.172 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 14.1 p90 -145.75 154.35 41.95 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 124.545 1.138 . . . . 0.0 109.113 161.019 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 53.7 t-105 -80.43 120.26 24.21 Favored 'General case' 0 C--O 1.24 0.558 0 N-CA-C 107.181 -1.415 . . . . 0.0 107.181 167.714 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 42.3 t0 -114.76 95.36 5.19 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 123.926 0.89 . . . . 0.0 108.975 174.552 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -66.67 -15.94 64.96 Favored Glycine 0 N--CA 1.444 -0.796 0 CA-C-O 117.492 -1.727 . . . . 0.0 112.564 174.244 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -64.54 -23.83 67.4 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 120.681 2.24 . . . . 0.0 109.551 171.324 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 4.5 mtt-85 -120.11 -2.3 10.22 Favored 'General case' 0 C--O 1.233 0.208 0 C-N-CA 126.062 1.745 . . . . 0.0 112.677 -177.537 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 81.3 mtp180 44.07 50.28 7.38 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 125.643 1.577 . . . . 0.0 110.607 -171.919 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 4.9 t -151.31 174.85 12.81 Favored 'General case' 0 N--CA 1.45 -0.437 0 O-C-N 121.691 -0.631 . . . . 0.0 110.49 179.399 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . 0.406 ' CE2' HG21 ' A' ' 32' ' ' THR . 97.4 m-85 -100.11 135.23 41.84 Favored 'General case' 0 C--O 1.238 0.467 0 N-CA-C 108.547 -0.909 . . . . 0.0 108.547 171.181 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -126.06 153.81 74.02 Favored Pre-proline 0 C--N 1.321 -0.645 0 C-N-CA 125.081 1.353 . . . . 0.0 107.431 -178.86 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 88.2 Cg_endo -84.43 131.28 4.76 Favored 'Trans proline' 0 N--CA 1.457 -0.672 0 C-N-CA 122.257 1.971 . . . . 0.0 109.99 -177.591 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -92.48 16.74 11.23 Favored 'General case' 0 N--CA 1.469 0.497 0 N-CA-C 115.87 1.804 . . . . 0.0 115.87 -167.08 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.412 ' CD2' ' H ' ' A' ' 65' ' ' LEU . 1.2 pt? -72.33 161.14 31.25 Favored 'General case' 0 C--O 1.238 0.488 0 N-CA-C 112.21 0.448 . . . . 0.0 112.21 175.766 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . 0.28 41.5 mt-10 68.04 -57.41 0.47 Allowed 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 129.714 3.206 . . . . 0.0 112.767 163.997 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? 65.59 -163.12 0.25 Allowed 'General case' 0 CA--C 1.545 0.761 0 N-CA-C 108.165 -1.05 . . . . 0.0 108.165 177.445 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 63.9 m 64.88 4.13 2.33 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 117.944 2.572 . . . . 0.0 117.944 162.97 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 54.01 44.6 29.09 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 126.576 1.951 . . . . 0.0 111.938 179.477 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 14.0 p30 -103.04 -32.53 9.66 Favored 'General case' 0 C--O 1.237 0.429 0 C-N-CA 127.604 2.361 . . . . 0.0 113.715 -171.585 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 79.74 -61.72 4.24 Favored Glycine 0 N--CA 1.443 -0.852 0 C-N-CA 126.06 1.79 . . . . 0.0 113.889 178.099 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 30.4 m170 -154.03 34.55 0.43 Allowed 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 125.909 1.684 . . . . 0.0 109.112 -170.034 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 33.4 mtmm -140.96 122.68 15.26 Favored 'General case' 0 CA--C 1.52 -0.179 0 O-C-N 120.973 -1.08 . . . . 0.0 108.225 -165.564 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . 0.428 ' C ' ' H ' ' A' ' 76' ' ' GLY . 4.7 tp10 75.55 -39.82 0.4 Allowed 'General case' 0 CA--C 1.486 -1.502 0 C-N-CA 130.428 3.491 . . . . 0.0 113.108 -177.642 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 65.71 -1.33 1.07 Allowed 'General case' 0 N--CA 1.428 -1.547 0 O-C-N 124.6 1.187 . . . . 0.0 112.775 -176.54 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . 0.428 ' H ' ' C ' ' A' ' 74' ' ' GLU . . . 161.72 78.86 0.03 OUTLIER Glycine 0 N--CA 1.445 -0.717 0 C-N-CA 120.344 -0.931 . . . . 0.0 112.89 -164.375 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -109.43 161.66 23.14 Favored Pre-proline 0 CA--C 1.537 0.444 0 CA-C-N 117.977 0.888 . . . . 0.0 109.6 157.659 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_endo -62.2 111.43 1.26 Allowed 'Trans proline' 0 N--CA 1.455 -0.741 0 C-N-CA 123.363 2.708 . . . . 0.0 110.281 172.892 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 36.1 t -156.5 124.17 5.49 Favored 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 127.642 2.377 . . . . 0.0 104.675 168.621 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -153.02 43.08 0.62 Allowed 'General case' 0 C--O 1.231 0.127 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 171.437 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 50.6 tt0 49.07 94.88 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 128.524 2.73 . . . . 0.0 111.978 -174.189 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 98.38 36.53 4.59 Favored Glycine 0 CA--C 1.528 0.883 0 O-C-N 120.86 -1.15 . . . . 0.0 112.648 -171.173 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 176.51 50.35 0.0 OUTLIER 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 129.8 3.24 . . . . 0.0 108.309 173.941 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 1.6 pt-20 -126.71 -179.89 5.02 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.305 1.042 . . . . 0.0 111.395 178.892 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 27.2 mmmt -73.51 34.1 0.08 Allowed 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 126.337 1.855 . . . . 0.0 112.999 169.945 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 4.4 ptpt 47.38 27.5 0.92 Allowed 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 128.316 2.646 . . . . 0.0 115.102 -178.008 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 17.7 tt0 -91.9 37.28 0.97 Allowed 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 126.605 1.962 . . . . 0.0 113.169 -158.14 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 5.6 ptmt -111.57 8.64 21.02 Favored 'General case' 0 N--CA 1.47 0.551 0 O-C-N 120.192 -1.567 . . . . 0.0 113.511 -174.61 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 66.8 m80 -91.73 88.16 6.58 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 119.381 0.991 . . . . 0.0 110.587 -168.364 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 62.0 pttt -157.14 148.1 21.7 Favored 'General case' 0 C--O 1.232 0.145 0 C-N-CA 123.581 0.752 . . . . 0.0 110.445 167.664 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -152.35 -169.48 3.36 Favored 'General case' 0 C--O 1.238 0.498 0 C-N-CA 125.634 1.573 . . . . 0.0 107.584 179.022 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 11.1 tmtt? . . . . . 0 C--O 1.242 0.658 0 N-CA-C 105.11 -2.182 . . . . 0.0 105.11 165.951 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.609 0 N-CA-C 109.536 -1.426 . . . . 0.0 109.536 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 25.7 m-70 44.66 45.74 8.15 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 126.702 2.001 . . . . 0.0 112.722 177.748 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 39.5 mtm -94.49 -170.74 2.32 Favored 'General case' 0 CA--C 1.536 0.438 0 N-CA-C 107.773 -1.195 . . . . 0.0 107.773 166.211 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 87.7 mm-40 -80.2 111.78 16.9 Favored 'General case' 0 C--N 1.331 -0.235 0 O-C-N 120.985 -1.072 . . . . 0.0 108.451 166.104 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -115.32 -26.44 7.6 Favored 'General case' 0 N--CA 1.469 0.486 0 N-CA-C 114.1 1.148 . . . . 0.0 114.1 179.231 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 75.5 m 49.01 76.65 0.12 Allowed 'General case' 0 CA--C 1.541 0.597 0 CA-C-N 119.574 1.079 . . . . 0.0 111.511 -167.673 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -135.43 166.88 22.15 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 126.098 1.759 . . . . 0.0 108.017 173.922 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 13.7 m 58.13 60.24 2.76 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 125.377 1.471 . . . . 0.0 112.091 -178.876 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 1.1 mm100 -67.2 -24.73 65.88 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 126.385 1.874 . . . . 0.0 114.455 178.55 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 27.6 m-85 -133.3 164.84 41.14 Favored Pre-proline 0 CA--C 1.54 0.586 0 C-N-CA 126.027 1.731 . . . . 0.0 110.163 -179.166 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -72.19 -173.12 1.01 Allowed 'Trans proline' 0 CA--C 1.534 0.482 0 C-N-CA 124.4 3.4 . . . . 0.0 110.415 166.82 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 61.1 t -113.56 85.66 9.38 Favored Pre-proline 0 CA--C 1.539 0.55 0 N-CA-C 106.204 -1.776 . . . . 0.0 106.204 172.739 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 69.7 Cg_endo -72.86 161.85 42.62 Favored 'Trans proline' 0 CA--C 1.539 0.751 0 C-N-CA 122.399 2.066 . . . . 0.0 110.572 -177.816 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -136.13 137.14 40.69 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 123.773 0.829 . . . . 0.0 110.627 -175.161 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.459 ' HA ' ' CD2' ' A' ' 18' ' ' TYR . 11.9 p -61.2 -22.01 26.21 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.664 0 N-CA-C 112.992 0.738 . . . . 0.0 112.992 179.479 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 3.0 t -68.98 8.35 0.55 Allowed 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 125.145 1.378 . . . . 0.0 112.586 171.748 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.3 t -126.3 4.85 7.02 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 120.598 1.545 . . . . 0.0 111.358 169.174 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . 0.459 ' CD2' ' HA ' ' A' ' 15' ' ' VAL . 16.0 m-30 -82.78 150.49 26.61 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 118.921 0.782 . . . . 0.0 109.719 179.768 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 71.8 mt-30 -95.42 103.92 15.8 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 127.17 2.188 . . . . 0.0 111.035 177.477 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 88.0 t80 -58.12 151.48 18.85 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 120.271 1.396 . . . . 0.0 110.376 -179.991 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -129.61 93.58 3.57 Favored 'General case' 0 CA--C 1.516 -0.354 0 N-CA-C 106.091 -1.818 . . . . 0.0 106.091 177.345 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 1.9 pt-20 -51.99 -33.09 36.52 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-O 118.528 -0.748 . . . . 0.0 112.291 176.487 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 1.3 t -68.82 -5.68 22.32 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 123.297 0.639 . . . . 0.0 111.645 -174.408 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 50.7 m -137.1 -12.91 1.64 Allowed 'General case' 0 CA--C 1.53 0.204 0 O-C-N 120.185 -1.572 . . . . 0.0 112.463 167.874 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 88.39 18.77 54.59 Favored Glycine 0 C--N 1.338 0.64 0 CA-C-N 118.983 0.81 . . . . 0.0 112.124 169.936 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 7.1 m-85 -125.04 175.16 7.53 Favored 'General case' 0 C--N 1.332 -0.195 0 C-N-CA 126.88 2.072 . . . . 0.0 108.122 -171.725 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 58.8 m-85 -99.26 135.35 40.8 Favored 'General case' 0 N--CA 1.448 -0.529 0 N-CA-C 106.892 -1.522 . . . . 0.0 106.892 176.114 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 25.3 t80 -99.41 141.24 32.46 Favored 'General case' 0 C--O 1.238 0.472 0 N-CA-C 107.047 -1.464 . . . . 0.0 107.047 168.026 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 29.5 m-20 -118.45 76.44 12.96 Favored Pre-proline 0 CA--C 1.535 0.389 0 N-CA-C 108.935 -0.765 . . . . 0.0 108.935 -159.088 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -65.05 -10.64 26.36 Favored 'Trans proline' 0 CA--C 1.534 0.486 0 C-N-CA 124.326 3.35 . . . . 0.0 114.722 -167.644 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 33.7 tt0 -76.58 -25.73 54.29 Favored 'General case' 0 CA--C 1.537 0.474 0 O-C-N 121.504 -0.747 . . . . 0.0 110.979 175.985 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -136.34 -26.32 1.13 Allowed 'General case' 0 C--O 1.234 0.278 0 C-N-CA 124.215 1.006 . . . . 0.0 112.495 -165.642 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 108.12 -3.77 33.5 Favored Glycine 0 CA--C 1.527 0.811 0 C-N-CA 124.069 0.843 . . . . 0.0 115.074 169.924 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -84.36 -177.11 6.54 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 126.591 1.957 . . . . 0.0 109.975 -172.739 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 25.0 m-85 -115.95 139.04 50.63 Favored 'General case' 0 C--O 1.238 0.459 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 155.569 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 62.4 t80 -104.25 154.43 19.79 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 125.426 1.49 . . . . 0.0 108.246 178.911 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 37.0 t70 -127.4 143.57 47.76 Favored Pre-proline 0 N--CA 1.467 0.388 0 N-CA-C 112.157 0.428 . . . . 0.0 112.157 167.184 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -67.61 -31.01 34.16 Favored 'Trans proline' 0 N--CA 1.455 -0.771 0 C-N-CA 122.953 2.435 . . . . 0.0 114.205 -179.555 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 4.2 m-80 -87.19 -17.57 32.36 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 119.58 1.082 . . . . 0.0 111.626 172.692 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' SER . . . . . 0.452 ' C ' ' H ' ' A' ' 42' ' ' TYR . 0.7 OUTLIER -138.85 81.57 1.85 Allowed 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 -162.52 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -60.5 5.91 0.04 OUTLIER 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.146 1.378 . . . . 0.0 113.709 177.171 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . 0.452 ' H ' ' C ' ' A' ' 40' ' ' SER . 24.3 m-85 -75.64 93.56 3.08 Favored 'General case' 0 N--CA 1.444 -0.74 0 C-N-CA 125.302 1.441 . . . . 0.0 107.766 171.598 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 43.8 m-85 -58.54 123.97 18.07 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 124.378 1.071 . . . . 0.0 108.675 -179.74 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 8.0 t80 -86.22 108.22 18.27 Favored 'General case' 0 N--CA 1.447 -0.609 0 C-N-CA 125.243 1.417 . . . . 0.0 107.219 -176.65 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 33.6 t30 -82.62 79.42 9.04 Favored 'General case' 0 N--CA 1.446 -0.655 0 N-CA-C 107.997 -1.112 . . . . 0.0 107.997 171.326 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -53.28 -33.12 51.92 Favored 'General case' 0 C--N 1.341 0.213 0 C-N-CA 123.553 0.741 . . . . 0.0 112.129 -178.783 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -44.3 -62.23 1.24 Allowed 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 128.261 2.625 . . . . 0.0 109.904 177.379 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.1 t -106.97 11.22 30.05 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.634 1.173 . . . . 0.0 110.578 -175.233 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 34.0 mt-30 46.98 40.81 9.98 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 127.011 2.125 . . . . 0.0 110.67 -176.433 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 17.4 mm-40 -103.95 159.73 15.41 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 126.238 1.815 . . . . 0.0 109.017 174.66 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -112.09 129.42 56.23 Favored 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 106.679 -1.6 . . . . 0.0 106.679 170.987 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 50.8 mt -118.4 177.51 4.79 Favored 'General case' 0 N--CA 1.442 -0.875 0 C-N-CA 126.124 1.769 . . . . 0.0 107.352 -179.748 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 14.0 p90 -141.71 154.2 45.15 Favored 'General case' 0 N--CA 1.441 -0.889 0 N-CA-C 106.786 -1.561 . . . . 0.0 106.786 158.751 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 20.3 t-105 -76.22 136.78 39.71 Favored 'General case' 0 N--CA 1.445 -0.687 0 N-CA-C 106.195 -1.78 . . . . 0.0 106.195 169.453 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 6.6 t0 -131.92 99.43 4.75 Favored 'General case' 0 CA--C 1.507 -0.695 0 CA-C-O 122.442 1.115 . . . . 0.0 109.719 175.102 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -65.89 -8.26 40.6 Favored Glycine 0 N--CA 1.442 -0.913 0 CA-C-O 117.256 -1.858 . . . . 0.0 113.221 -174.449 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . 0.507 ' HG3' ' H ' ' A' ' 58' ' ' ARG . 1.8 pt-20 -72.67 -64.82 0.88 Allowed 'General case' 0 C--N 1.338 0.108 0 CA-C-N 120.363 2.082 . . . . 0.0 107.47 177.342 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . 0.507 ' H ' ' HG3' ' A' ' 57' ' ' GLU . 82.3 mtt180 -74.85 -7.12 52.5 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 125.181 1.392 . . . . 0.0 111.817 179.059 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 90.5 mtt180 44.79 56.25 5.39 Favored 'General case' 0 C--O 1.231 0.128 0 C-N-CA 126.51 1.924 . . . . 0.0 110.55 -172.595 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 7.4 t -146.62 164.0 34.05 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 109.217 -0.66 . . . . 0.0 109.217 167.781 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 27.4 m-85 -81.66 135.93 35.52 Favored 'General case' 0 C--O 1.237 0.426 0 N-CA-C 107.216 -1.402 . . . . 0.0 107.216 166.877 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -126.01 154.77 73.93 Favored Pre-proline 0 C--N 1.323 -0.587 0 C-N-CA 125.806 1.642 . . . . 0.0 108.863 176.585 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -67.98 135.67 35.75 Favored 'Trans proline' 0 N--CA 1.451 -1.012 0 C-N-CA 121.949 1.766 . . . . 0.0 109.715 171.791 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -97.57 23.14 8.05 Favored 'General case' 0 N--CA 1.463 0.187 0 C-N-CA 124.154 0.982 . . . . 0.0 112.698 -178.316 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -54.02 -9.04 0.22 Allowed 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 127.164 2.186 . . . . 0.0 116.403 -174.602 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -145.77 -77.74 0.19 Allowed 'General case' 0 N--CA 1.441 -0.906 0 N-CA-C 104.865 -2.272 . . . . 0.0 104.865 -174.892 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 5.3 tm0? 56.95 12.65 1.25 Allowed 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 125.658 1.583 . . . . 0.0 113.381 178.439 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 22.0 m -153.89 99.87 2.31 Favored 'General case' 0 C--O 1.239 0.522 0 O-C-N 119.939 -1.726 . . . . 0.0 106.936 172.092 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -87.83 71.92 9.46 Favored 'General case' 0 N--CA 1.464 0.241 0 N-CA-C 108.498 -0.927 . . . . 0.0 108.498 179.96 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 75.7 m-20 -123.49 18.8 9.67 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 125.478 1.511 . . . . 0.0 109.706 -175.935 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -117.28 -17.67 5.66 Favored Glycine 0 CA--C 1.528 0.866 0 CA-C-O 117.192 -1.893 . . . . 0.0 114.759 -164.826 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 63.1 m80 48.83 40.01 15.41 Favored 'General case' 0 CA--C 1.545 0.773 0 CA-C-N 119.682 1.741 . . . . 0.0 114.58 175.053 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 37.0 mttt -143.18 -166.74 2.38 Favored 'General case' 0 N--CA 1.472 0.63 0 O-C-N 120.724 -1.235 . . . . 0.0 109.424 -178.297 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 14.9 mm-40 -70.64 164.99 23.82 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 123.68 0.792 . . . . 0.0 110.368 164.94 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -49.08 -44.87 42.41 Favored 'General case' 0 N--CA 1.451 -0.425 0 C-N-CA 126.371 1.868 . . . . 0.0 109.891 168.509 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -138.35 -107.08 0.76 Allowed Glycine 0 N--CA 1.446 -0.642 0 N-CA-C 109.438 -1.465 . . . . 0.0 109.438 179.029 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . 55.34 159.98 0.06 OUTLIER Pre-proline 0 CA--C 1.548 0.873 0 C-N-CA 127.131 2.172 . . . . 0.0 112.907 -167.197 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 64.8 Cg_endo -69.43 173.6 10.44 Favored 'Trans proline' 0 CA--C 1.54 0.818 0 C-N-CA 122.705 2.27 . . . . 0.0 111.164 169.285 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 52.9 p -161.19 -177.82 6.31 Favored 'General case' 0 CA--C 1.535 0.375 0 O-C-N 121.07 -1.019 . . . . 0.0 112.626 174.398 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 56.1 mttt 58.15 18.41 5.27 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 127.251 2.22 . . . . 0.0 113.925 161.677 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -145.32 21.62 1.53 Allowed 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.087 1.755 . . . . 0.0 109.543 -167.809 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 74.67 20.2 79.61 Favored Glycine 0 CA--C 1.534 1.248 0 O-C-N 120.451 -1.405 . . . . 0.0 111.321 -168.116 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 29.9 mmtp -122.51 -9.42 8.49 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 126.932 2.093 . . . . 0.0 110.971 -168.237 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -77.21 174.81 10.31 Favored 'General case' 0 N--CA 1.446 -0.63 0 C-N-CA 124.849 1.26 . . . . 0.0 109.859 -178.207 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 6.6 ptmt -65.4 30.12 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 125.564 1.546 . . . . 0.0 114.609 171.666 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 27.3 pttt 44.95 42.9 6.71 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 125.534 1.534 . . . . 0.0 111.686 -171.55 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 70.5 tt0 -69.73 -40.84 75.97 Favored 'General case' 0 C--O 1.235 0.305 0 O-C-N 121.378 -0.826 . . . . 0.0 109.1 176.763 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 1.4 ptpm? -139.83 176.54 8.66 Favored 'General case' 0 CA--C 1.528 0.122 0 C-N-CA 124.695 1.198 . . . . 0.0 110.09 176.099 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 22.1 t-80 -127.15 114.89 18.3 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 104.962 -2.236 . . . . 0.0 104.962 170.62 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 77.6 tttt -154.15 53.17 0.69 Allowed 'General case' 0 N--CA 1.462 0.168 0 N-CA-C 108.132 -1.062 . . . . 0.0 108.132 -178.727 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 2.2 p -147.8 91.15 1.91 Allowed 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 106.496 -1.668 . . . . 0.0 106.496 -166.647 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 2.5 tmtt? . . . . . 0 C--O 1.252 1.212 0 N-CA-C 102.803 -3.036 . . . . 0.0 102.803 166.842 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.462 0.374 0 N-CA-C 110.96 -0.856 . . . . 0.0 110.96 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 54.6 m-70 63.01 70.17 0.56 Allowed 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 127.631 2.372 . . . . 0.0 109.813 -167.272 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 53.2 mtt -132.1 156.72 45.84 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 124.973 1.309 . . . . 0.0 107.579 166.943 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 7.7 tp-100 -166.56 124.7 1.4 Allowed 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 104.415 -2.439 . . . . 0.0 104.415 172.24 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.448 ' HG3' ' H ' ' A' ' 6' ' ' SER . 3.7 pt-20 -150.67 -86.28 0.08 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 118.816 0.735 . . . . 0.0 109.117 -176.162 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' SER . . . . . 0.448 ' H ' ' HG3' ' A' ' 5' ' ' GLU . 72.3 m -161.56 12.97 0.09 Allowed 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 125.02 1.328 . . . . 0.0 113.004 178.07 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 34.4 t80 -96.45 106.51 18.76 Favored 'General case' 0 C--O 1.234 0.255 0 C-N-CA 124.303 1.041 . . . . 0.0 108.51 -173.818 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 26.7 t -161.09 79.21 0.6 Allowed 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 115.134 -0.939 . . . . 0.0 109.25 -172.094 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 18.5 pm0 -70.78 -12.51 61.59 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 125.026 1.33 . . . . 0.0 113.662 178.661 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 51.7 m-85 -125.62 163.1 40.91 Favored Pre-proline 0 C--O 1.239 0.514 0 C-N-CA 124.131 0.972 . . . . 0.0 109.43 162.156 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -70.62 -175.12 1.25 Allowed 'Trans proline' 0 CA--C 1.537 0.646 0 C-N-CA 124.489 3.459 . . . . 0.0 111.239 167.277 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 38.8 t -104.97 88.12 2.21 Favored Pre-proline 0 CA--C 1.543 0.709 0 C-N-CA 125.991 1.717 . . . . 0.0 109.478 -178.744 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 19.8 Cg_endo -70.55 173.66 11.35 Favored 'Trans proline' 0 CA--C 1.546 1.079 0 C-N-CA 123.087 2.525 . . . . 0.0 110.856 173.549 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -156.62 133.61 10.4 Favored 'General case' 0 N--CA 1.468 0.439 0 O-C-N 121.272 -0.893 . . . . 0.0 110.053 171.932 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.439 ' HA ' ' CD2' ' A' ' 18' ' ' TYR . 12.5 p -54.24 -25.14 12.97 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.42 0 N-CA-C 113.604 0.964 . . . . 0.0 113.604 177.928 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 14.0 m -62.02 -14.07 32.08 Favored 'General case' 0 C--O 1.237 0.406 0 O-C-N 120.943 -1.098 . . . . 0.0 112.96 179.987 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 5.5 t -120.55 9.94 10.98 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 124.012 0.925 . . . . 0.0 111.85 176.187 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . 0.439 ' CD2' ' HA ' ' A' ' 15' ' ' VAL . 17.0 m-30 -73.4 152.6 40.76 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-N 119.708 1.14 . . . . 0.0 109.719 168.858 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 51.6 mt-30 -87.38 115.58 24.9 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 108.529 -0.915 . . . . 0.0 108.529 174.236 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 85.4 t80 -66.32 147.89 52.65 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 118.224 0.465 . . . . 0.0 110.233 168.693 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -119.13 112.58 19.7 Favored 'General case' 0 N--CA 1.442 -0.871 0 C-N-CA 127.681 2.393 . . . . 0.0 106.517 177.829 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -81.6 -15.85 53.39 Favored 'General case' 0 CA--C 1.533 0.314 0 O-C-N 121.396 -0.815 . . . . 0.0 113.087 178.178 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 5.2 t -67.09 -31.77 72.49 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.533 1.133 . . . . 0.0 111.335 179.619 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 69.2 m -128.26 -26.16 2.86 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 119.883 1.22 . . . . 0.0 112.889 171.386 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 104.24 25.3 7.12 Favored Glycine 0 CA--C 1.527 0.806 0 CA-C-O 117.889 -1.506 . . . . 0.0 113.674 172.651 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 2.7 m-85 -110.91 -179.58 3.78 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 120.206 2.003 . . . . 0.0 108.821 -179.84 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 68.2 m-85 -120.88 123.35 42.33 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 124.636 1.174 . . . . 0.0 108.239 178.055 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 23.5 t80 -91.14 134.77 34.26 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 125.571 1.548 . . . . 0.0 110.76 -179.642 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 12.6 t0 -101.11 88.06 0.99 Allowed Pre-proline 0 CA--C 1.533 0.319 0 C-N-CA 128.034 2.534 . . . . 0.0 112.429 178.543 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -64.81 -6.84 13.33 Favored 'Trans proline' 0 CA--C 1.533 0.47 0 C-N-CA 121.656 1.571 . . . . 0.0 115.332 172.002 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 3.3 tm0? -64.92 -52.03 58.66 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 119.852 1.206 . . . . 0.0 108.297 176.032 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 77.7 p -99.97 -51.96 3.56 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-N 118.295 0.498 . . . . 0.0 111.081 174.461 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 125.98 5.82 6.13 Favored Glycine 0 CA--C 1.535 1.341 0 C-N-CA 126.818 2.151 . . . . 0.0 112.135 -166.257 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 84.5 mt -74.21 174.36 8.86 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 119.126 1.463 . . . . 0.0 110.935 176.476 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 27.0 m-85 -120.38 169.77 9.99 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 125.902 1.681 . . . . 0.0 108.294 161.604 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 28.3 t80 -145.52 153.57 41.26 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 128.913 2.885 . . . . 0.0 107.67 -174.935 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 8.9 t0 -121.32 142.51 35.42 Favored Pre-proline 0 CA--C 1.532 0.267 0 C-N-CA 124.968 1.307 . . . . 0.0 107.89 179.419 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -74.74 -32.95 5.37 Favored 'Trans proline' 0 N--CA 1.453 -0.887 0 C-N-CA 121.635 1.557 . . . . 0.0 115.279 -174.101 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -73.32 -35.6 66.08 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 120.508 1.503 . . . . 0.0 108.45 172.072 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' SER . . . . . 0.446 ' C ' ' H ' ' A' ' 42' ' ' TYR . 69.4 m -126.43 93.52 3.82 Favored 'General case' 0 N--CA 1.449 -0.494 0 C-N-CA 123.493 0.717 . . . . 0.0 110.246 -157.349 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 25.6 mp0 -55.72 -0.92 0.04 OUTLIER 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 127.34 2.256 . . . . 0.0 114.597 179.531 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . 0.446 ' H ' ' C ' ' A' ' 40' ' ' SER . 49.3 m-85 -70.9 106.19 3.53 Favored 'General case' 0 N--CA 1.442 -0.839 0 C-N-CA 125.595 1.558 . . . . 0.0 108.194 170.351 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 40.7 m-85 -65.75 153.82 40.72 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 125.613 1.565 . . . . 0.0 109.972 179.01 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 74.9 t80 -108.58 133.95 52.01 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 125.668 1.587 . . . . 0.0 107.983 175.41 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 43.1 t30 -110.8 73.9 0.85 Allowed 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 128.944 2.898 . . . . 0.0 109.619 -173.305 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -49.53 -26.4 3.44 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 125.651 1.58 . . . . 0.0 114.036 -172.014 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 3.1 tt0 -53.95 -31.18 49.62 Favored 'General case' 0 N--CA 1.446 -0.656 0 C-N-CA 128.989 2.915 . . . . 0.0 113.315 174.858 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 4.1 m -143.9 9.6 1.52 Allowed 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 124.894 1.277 . . . . 0.0 111.479 -168.537 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 52.0 mt-30 47.39 30.43 1.57 Allowed 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 126.415 1.886 . . . . 0.0 113.623 -173.907 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -104.22 161.48 14.0 Favored 'General case' 0 C--O 1.233 0.213 0 C-N-CA 125.083 1.353 . . . . 0.0 112.653 -175.995 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -103.26 134.86 45.95 Favored 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 124.7 1.2 . . . . 0.0 110.783 178.336 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 53.8 mt -133.34 179.8 5.98 Favored 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 125.943 1.697 . . . . 0.0 109.193 -177.091 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 14.1 p90 -148.52 155.21 40.85 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 125.103 1.361 . . . . 0.0 108.684 164.518 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 68.9 t-105 -77.42 119.29 20.83 Favored 'General case' 0 C--O 1.233 0.232 0 N-CA-C 107.333 -1.358 . . . . 0.0 107.333 167.878 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 39.7 t0 -98.68 94.44 6.64 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 107.88 -1.155 . . . . 0.0 107.88 167.505 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -62.7 -14.98 53.27 Favored Glycine 0 CA--C 1.531 1.091 0 CA-C-O 119.081 -0.844 . . . . 0.0 113.394 178.13 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -74.6 -17.29 60.74 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 119.228 1.514 . . . . 0.0 110.667 174.941 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 83.9 mtt85 -123.34 -4.49 8.35 Favored 'General case' 0 C--O 1.223 -0.299 0 C-N-CA 125.342 1.457 . . . . 0.0 111.799 178.711 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 97.2 mtt180 44.34 59.36 3.31 Favored 'General case' 0 C--O 1.233 0.209 0 C-N-CA 125.389 1.476 . . . . 0.0 110.335 -173.096 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 5.8 t -152.95 173.67 15.1 Favored 'General case' 0 N--CA 1.448 -0.551 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 177.681 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 82.2 m-85 -104.96 134.34 48.23 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 107.624 -1.25 . . . . 0.0 107.624 173.185 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -126.12 154.6 74.21 Favored Pre-proline 0 C--N 1.324 -0.527 0 C-N-CA 125.327 1.451 . . . . 0.0 109.492 -178.223 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -74.16 125.68 9.95 Favored 'Trans proline' 0 N--CA 1.458 -0.581 0 C-N-CA 123.413 2.742 . . . . 0.0 111.08 -178.916 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -85.43 14.61 5.26 Favored 'General case' 0 N--CA 1.463 0.187 0 N-CA-C 114.607 1.336 . . . . 0.0 114.607 -173.25 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -61.37 -33.91 74.44 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 125.068 1.347 . . . . 0.0 112.037 -167.514 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 31.0 mt-10 -101.58 -30.16 11.54 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-O 118.548 -0.739 . . . . 0.0 112.43 175.16 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . 0.269 1.7 pt20 44.02 30.22 0.4 Allowed 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 126.701 2.0 . . . . 0.0 115.173 -179.085 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 1.5 t 63.0 136.94 0.02 OUTLIER 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 127.465 2.306 . . . . 0.0 112.155 -176.753 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 54.54 -167.34 0.08 Allowed 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 124.943 1.297 . . . . 0.0 110.979 -165.902 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 15.9 t0 -147.28 169.07 20.18 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 107.471 -1.307 . . . . 0.0 107.471 -175.698 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 73.91 -68.74 1.6 Allowed Glycine 0 C--O 1.22 -0.764 0 C-N-CA 124.562 1.077 . . . . 0.0 111.869 179.021 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . 0.447 ' CE1' ' HE2' ' A' ' 83' ' ' LYS . 4.5 m-70 -65.06 -5.01 5.41 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 125.017 1.327 . . . . 0.0 113.936 179.702 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 34.2 pttt -58.22 123.1 14.88 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 107.181 -1.415 . . . . 0.0 107.181 164.469 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . 0.492 ' C ' ' H ' ' A' ' 76' ' ' GLY . 87.3 mt-10 -72.06 -47.34 52.29 Favored 'General case' 0 CA--C 1.511 -0.542 0 N-CA-C 107.522 -1.288 . . . . 0.0 107.522 173.563 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER 57.53 -24.59 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 127.541 2.337 . . . . 0.0 114.306 -169.883 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . 0.492 ' H ' ' C ' ' A' ' 74' ' ' GLU . . . 173.83 67.46 0.05 OUTLIER Glycine 0 CA--C 1.524 0.642 0 N-CA-C 106.64 -2.584 . . . . 0.0 106.64 -160.724 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -160.2 155.3 21.29 Favored Pre-proline 0 CA--C 1.538 0.51 0 C-N-CA 127.335 2.254 . . . . 0.0 107.27 170.604 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 12.2 Cg_endo -65.87 134.43 37.42 Favored 'Trans proline' 0 C--O 1.237 0.445 0 C-N-CA 122.509 2.14 . . . . 0.0 110.673 171.446 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 14.6 m -78.23 74.13 4.77 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 125.125 1.37 . . . . 0.0 110.888 179.242 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -143.77 -13.48 0.65 Allowed 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 125.447 1.499 . . . . 0.0 112.187 177.441 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 6.6 pt-20 -76.63 17.53 0.39 Allowed 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 125.731 1.612 . . . . 0.0 113.427 -171.609 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 76.67 4.97 82.63 Favored Glycine 0 CA--C 1.534 1.247 0 CA-C-O 122.328 0.96 . . . . 0.0 112.833 -178.039 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.447 ' HE2' ' CE1' ' A' ' 72' ' ' HIS . 92.7 mttt -110.46 9.34 23.31 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 125.015 1.326 . . . . 0.0 109.256 170.401 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -46.01 -51.98 12.62 Favored 'General case' 0 CA--C 1.517 -0.301 0 C-N-CA 129.214 3.005 . . . . 0.0 110.574 -166.932 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -141.7 41.29 1.71 Allowed 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 125.496 1.519 . . . . 0.0 108.331 179.103 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 19.6 mttt 45.33 73.39 0.16 Allowed 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 126.975 2.11 . . . . 0.0 113.257 167.31 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -62.63 5.88 0.11 Allowed 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 127.626 2.371 . . . . 0.0 115.516 176.647 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 24.6 mttt 56.86 88.15 0.05 Allowed 'General case' 0 N--CA 1.467 0.381 0 C-N-CA 126.363 1.865 . . . . 0.0 109.77 -171.133 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 35.2 t-80 -61.92 -31.21 71.51 Favored 'General case' 0 CA--C 1.535 0.372 0 O-C-N 121.792 -0.567 . . . . 0.0 111.478 178.713 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 43.7 pttt -136.35 162.56 32.68 Favored 'General case' 0 C--O 1.238 0.457 0 C-N-CA 124.721 1.209 . . . . 0.0 109.884 176.103 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 1.7 p -96.37 179.69 4.94 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 125.886 1.675 . . . . 0.0 110.377 172.569 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 6.4 ttpm? . . . . . 0 C--O 1.246 0.883 0 N-CA-C 105.507 -2.034 . . . . 0.0 105.507 157.213 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.564 0 N-CA-C 108.639 -1.784 . . . . 0.0 108.639 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 6.2 m170 56.73 -164.36 0.16 Allowed 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 124.333 1.053 . . . . 0.0 110.32 -174.509 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 2.5 mpt? -124.9 -65.42 1.03 Allowed 'General case' 0 N--CA 1.453 -0.317 0 N-CA-C 108.181 -1.044 . . . . 0.0 108.181 178.689 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 10.9 pt20 -150.05 137.4 19.73 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 124.203 1.001 . . . . 0.0 109.491 -172.709 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -65.01 -38.97 92.7 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 174.837 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 37.5 m 52.75 37.49 23.95 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 124.233 1.013 . . . . 0.0 111.189 -162.03 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER 58.16 -60.36 0.03 OUTLIER 'General case' 0 C--N 1.342 0.262 1 C-N-CA 133.984 4.914 . . . . 0.0 113.583 170.432 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 7.2 t 60.49 -0.11 0.29 Allowed 'General case' 0 N--CA 1.445 -0.724 0 C-N-CA 128.919 2.888 . . . . 0.0 114.232 177.861 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 15.7 mm100 -140.54 -169.8 2.86 Favored 'General case' 0 N--CA 1.445 -0.689 0 C-N-CA 126.72 2.008 . . . . 0.0 111.539 -163.058 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 82.0 m-85 -67.48 163.35 48.27 Favored Pre-proline 0 CA--C 1.543 0.706 0 C-N-CA 126.04 1.736 . . . . 0.0 110.865 178.39 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_endo -72.71 -167.44 0.34 Allowed 'Trans proline' 0 CA--C 1.536 0.578 0 C-N-CA 123.991 3.128 . . . . 0.0 109.891 166.255 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 43.2 t -106.99 86.5 2.43 Favored Pre-proline 0 CA--C 1.541 0.634 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 174.016 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 91.8 Cg_endo -65.08 164.6 24.51 Favored 'Trans proline' 0 CA--C 1.536 0.604 0 C-N-CA 123.577 2.852 . . . . 0.0 110.252 178.205 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -152.94 142.97 22.28 Favored 'General case' 0 N--CA 1.475 0.776 0 O-C-N 120.608 -1.307 . . . . 0.0 113.236 -179.64 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 14.4 p -60.13 -19.82 18.75 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.287 0 C-N-CA 124.906 1.282 . . . . 0.0 112.885 171.494 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.4 t -57.59 -5.59 0.38 Allowed 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 124.632 1.173 . . . . 0.0 113.079 170.267 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.4 t -137.11 12.67 3.07 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-N 119.617 1.099 . . . . 0.0 113.74 176.468 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 16.4 m-30 -72.42 164.18 26.78 Favored 'General case' 0 C--O 1.236 0.363 0 O-C-N 120.476 -1.39 . . . . 0.0 111.295 175.028 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 19.2 mt-30 -108.08 129.22 55.16 Favored 'General case' 0 CA--C 1.519 -0.217 0 C-N-CA 125.179 1.392 . . . . 0.0 108.794 169.726 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 49.8 t80 -77.94 150.71 33.97 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 118.357 0.526 . . . . 0.0 110.073 170.017 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -128.58 88.08 2.68 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 107.504 -1.295 . . . . 0.0 107.504 173.846 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.7 pt-20 -52.77 -19.89 2.8 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 127.831 2.452 . . . . 0.0 113.589 175.057 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 6.7 t -51.33 -36.72 44.15 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 124.137 0.975 . . . . 0.0 111.413 168.344 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 54.3 m -138.61 -8.07 1.46 Allowed 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 124.7 1.2 . . . . 0.0 113.834 -178.05 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 88.47 19.96 50.2 Favored Glycine 0 CA--C 1.528 0.859 0 O-C-N 120.198 -1.564 . . . . 0.0 113.723 167.798 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 32.7 m-85 -110.37 174.88 5.65 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 125.673 1.589 . . . . 0.0 109.381 -179.025 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 83.8 m-85 -120.56 151.45 39.4 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 124.675 1.19 . . . . 0.0 109.098 177.117 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 55.3 t80 -125.6 137.08 53.88 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 125.412 1.485 . . . . 0.0 110.715 -175.511 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -97.75 88.74 0.65 Allowed Pre-proline 0 N--CA 1.463 0.182 0 C-N-CA 128.088 2.555 . . . . 0.0 112.418 -179.817 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo -58.09 -10.51 8.2 Favored 'Trans proline' 0 CA--C 1.536 0.614 0 CA-C-N 121.19 1.461 . . . . 0.0 115.012 175.265 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -66.81 -41.55 87.38 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 120.058 1.299 . . . . 0.0 109.786 176.295 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 22.4 p -137.34 -11.09 1.66 Allowed 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 116.156 1.909 . . . . 0.0 116.156 -173.819 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 95.14 6.68 60.04 Favored Glycine 0 CA--C 1.528 0.904 0 O-C-N 121.21 -0.931 . . . . 0.0 113.329 171.921 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 15.2 mt -82.1 163.15 22.21 Favored 'General case' 0 C--O 1.237 0.426 0 CA-C-N 118.169 0.985 . . . . 0.0 109.196 174.901 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 57.6 m-85 -108.9 157.44 18.62 Favored 'General case' 0 C--O 1.234 0.274 0 C-N-CA 123.141 0.576 . . . . 0.0 109.954 171.07 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 56.0 t80 -127.93 151.37 49.19 Favored 'General case' 0 C--O 1.238 0.448 0 C-N-CA 128.918 2.887 . . . . 0.0 107.865 -178.995 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -130.14 144.02 51.47 Favored Pre-proline 0 C--N 1.331 -0.213 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 173.345 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -64.99 -24.43 60.28 Favored 'Trans proline' 0 N--CA 1.455 -0.769 0 C-N-CA 122.539 2.159 . . . . 0.0 114.038 -175.427 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 17.7 m-80 -104.07 -19.04 14.31 Favored 'General case' 0 C--O 1.237 0.417 0 C-N-CA 123.721 0.808 . . . . 0.0 112.002 176.527 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 33.6 t -120.77 84.52 2.24 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 125.278 1.431 . . . . 0.0 109.163 177.63 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 24.9 mp0 -58.61 -8.16 1.18 Allowed 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 124.459 1.104 . . . . 0.0 111.657 162.443 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 26.8 m-85 -70.3 99.56 1.57 Allowed 'General case' 0 N--CA 1.45 -0.452 0 N-CA-C 107.357 -1.349 . . . . 0.0 107.357 164.732 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 54.3 m-85 -59.92 146.4 42.43 Favored 'General case' 0 C--O 1.237 0.432 0 C-N-CA 125.877 1.671 . . . . 0.0 109.974 -174.722 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 73.9 t80 -96.81 118.77 33.97 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-O 122.417 1.103 . . . . 0.0 109.748 173.634 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . 0.598 HD21 ' HG2' ' A' ' 50' ' ' GLN . 17.2 t30 -88.07 79.57 7.92 Favored 'General case' 0 N--CA 1.443 -0.806 0 C-N-CA 127.108 2.163 . . . . 0.0 107.557 -179.273 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -53.64 -32.65 52.29 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 123.684 0.794 . . . . 0.0 111.034 177.652 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.7 tt0 -51.01 -28.09 9.26 Favored 'General case' 0 N--CA 1.449 -0.496 0 C-N-CA 127.454 2.302 . . . . 0.0 114.365 -176.8 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -144.95 4.75 1.12 Allowed 'General case' 0 CA--C 1.535 0.39 0 N-CA-C 112.697 0.629 . . . . 0.0 112.697 174.692 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 26.8 mt-30 68.16 60.68 0.41 Allowed 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 125.968 1.707 . . . . 0.0 109.997 -177.461 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.598 ' HG2' HD21 ' A' ' 45' ' ' ASN . 0.0 OUTLIER -124.89 168.18 13.64 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 125.929 1.692 . . . . 0.0 114.871 174.715 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 4.4 m-85 -107.14 149.82 27.25 Favored 'General case' 0 C--O 1.233 0.202 0 N-CA-C 107.898 -1.149 . . . . 0.0 107.898 162.246 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 90.9 mt -145.99 -176.78 5.28 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 127.279 2.232 . . . . 0.0 107.025 -178.607 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 4.4 p90 -127.68 179.81 5.33 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 125.165 1.386 . . . . 0.0 108.278 162.726 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 27.5 t-105 -105.08 135.71 45.91 Favored 'General case' 0 C--O 1.238 0.499 0 N-CA-C 105.055 -2.202 . . . . 0.0 105.055 160.685 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -124.01 115.97 22.08 Favored 'General case' 0 N--CA 1.446 -0.628 0 C-N-CA 124.742 1.217 . . . . 0.0 108.013 177.886 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -77.27 -15.93 81.04 Favored Glycine 0 N--CA 1.445 -0.758 0 CA-C-O 117.407 -1.774 . . . . 0.0 112.361 177.316 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -65.7 -47.85 74.0 Favored 'General case' 0 C--N 1.345 0.388 0 CA-C-N 121.308 2.554 . . . . 0.0 108.241 -177.167 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 5.4 mtt85 -102.19 5.0 39.98 Favored 'General case' 0 CA--C 1.529 0.149 0 C-N-CA 125.805 1.642 . . . . 0.0 111.293 -179.051 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 3.2 mtt180 44.78 60.34 2.97 Favored 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 126.601 1.96 . . . . 0.0 109.798 -178.174 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 5.5 t -149.85 173.05 14.19 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-O 121.763 0.792 . . . . 0.0 110.193 -168.551 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 82.2 m-85 -113.74 116.39 29.33 Favored 'General case' 0 C--O 1.234 0.283 0 C-N-CA 124.906 1.283 . . . . 0.0 108.246 172.802 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -125.58 158.98 62.86 Favored Pre-proline 0 C--N 1.327 -0.382 0 C-N-CA 126.831 2.052 . . . . 0.0 110.409 -168.941 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -72.89 124.14 9.44 Favored 'Trans proline' 0 N--CA 1.458 -0.602 0 C-N-CA 122.931 2.421 . . . . 0.0 111.924 -175.986 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -89.96 22.72 3.06 Favored 'General case' 0 N--CA 1.464 0.245 0 C-N-CA 123.737 0.815 . . . . 0.0 112.713 179.855 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 5.8 mp -79.08 -85.0 0.08 Allowed 'General case' 0 N--CA 1.45 -0.438 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 -172.257 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 64.0 mt-10 -75.9 -23.66 55.55 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 118.438 0.563 . . . . 0.0 110.166 167.775 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER 52.52 30.81 8.93 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 126.152 1.781 . . . . 0.0 112.614 -168.126 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 58.4 p -143.47 123.55 13.64 Favored 'General case' 0 C--O 1.24 0.562 0 O-C-N 121.063 -1.023 . . . . 0.0 109.943 165.582 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 55.36 -179.16 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 128.42 2.688 . . . . 0.0 114.625 176.125 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -93.87 75.37 4.21 Favored 'General case' 0 C--O 1.236 0.354 0 C-N-CA 125.474 1.51 . . . . 0.0 108.131 -172.232 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -78.61 -29.76 51.23 Favored Glycine 0 CA--C 1.525 0.661 0 CA-C-O 118.949 -0.917 . . . . 0.0 111.57 171.621 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 7.4 t-80 74.7 1.04 3.72 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 127.807 2.443 . . . . 0.0 113.481 170.728 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 39.6 mttm -110.28 175.74 5.32 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 126.664 1.986 . . . . 0.0 111.312 -165.362 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 14.9 mt-10 -99.88 178.81 4.71 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 124.702 1.201 . . . . 0.0 110.029 174.113 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -58.79 -44.53 90.76 Favored 'General case' 0 N--CA 1.463 0.191 0 C-N-CA 124.704 1.201 . . . . 0.0 111.317 178.116 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -143.23 151.44 23.23 Favored Glycine 0 N--CA 1.44 -1.042 0 N-CA-C 106.943 -2.463 . . . . 0.0 106.943 179.372 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -162.61 157.9 19.1 Favored Pre-proline 0 C--O 1.241 0.649 0 C-N-CA 125.333 1.453 . . . . 0.0 108.305 -164.814 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -75.31 168.46 24.57 Favored 'Trans proline' 0 N--CA 1.45 -1.085 0 C-N-CA 122.178 1.919 . . . . 0.0 109.636 173.691 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' SER . . . . . 0.414 ' C ' ' H ' ' A' ' 81' ' ' GLU . 22.0 m 69.14 -66.42 0.25 Allowed 'General case' 0 C--N 1.333 -0.117 0 CA-C-O 116.045 -1.931 . . . . 0.0 111.262 176.101 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 19.6 tttm -63.16 29.61 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 127.227 2.211 . . . . 0.0 113.808 178.984 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . 0.414 ' H ' ' C ' ' A' ' 79' ' ' SER . 6.9 tt0 -144.65 -4.13 0.78 Allowed 'General case' 0 CA--C 1.539 0.535 0 O-C-N 119.663 -1.898 . . . . 0.0 112.572 170.834 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 164.55 -46.05 0.3 Allowed Glycine 0 C--N 1.345 1.079 0 C-N-CA 118.781 -1.676 . . . . 0.0 116.45 -176.001 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 7.5 mtpm? -76.39 6.05 6.24 Favored 'General case' 0 C--O 1.219 -0.548 0 O-C-N 120.849 -1.383 . . . . 0.0 109.83 175.824 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 12.0 tt0 -44.82 -60.56 1.97 Allowed 'General case' 0 N--CA 1.443 -0.794 0 C-N-CA 130.535 3.534 . . . . 0.0 112.527 -167.98 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.26 -5.49 58.92 Favored 'General case' 0 C--N 1.331 -0.201 0 C-N-CA 124.086 0.954 . . . . 0.0 110.858 -174.55 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 8.2 ptpt -128.78 22.06 5.87 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 124.453 1.101 . . . . 0.0 110.222 -167.603 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 22.8 tt0 -62.78 -63.62 1.16 Allowed 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 125.57 1.548 . . . . 0.0 109.888 -168.803 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . 0.428 ' HA ' ' HE2' ' A' ' 88' ' ' LYS . 0.2 OUTLIER 61.58 103.1 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 126.94 2.096 . . . . 0.0 111.088 178.828 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -52.9 161.07 0.83 Allowed 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 124.443 1.097 . . . . 0.0 111.932 170.328 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 10.2 mptt -122.13 160.74 24.46 Favored 'General case' 0 C--O 1.238 0.499 0 N-CA-C 104.892 -2.262 . . . . 0.0 104.892 168.617 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 1.3 t -93.9 5.78 50.58 Favored 'General case' 0 CA--C 1.546 0.817 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 175.954 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 72.8 mmtt . . . . . 0 C--O 1.248 0.979 0 CA-C-O 114.456 -2.688 . . . . 0.0 104.681 -137.344 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 17.7 m-85 . . . . . 0 CA--C 1.54 0.59 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 96.2 Cg_endo -65.36 -176.06 0.48 Allowed 'Trans proline' 0 CA--C 1.537 0.644 0 C-N-CA 123.623 2.882 . . . . 0.0 111.594 169.404 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 48.8 t -113.95 85.82 10.4 Favored Pre-proline 0 CA--C 1.541 0.609 0 N-CA-C 106.987 -1.486 . . . . 0.0 106.987 178.09 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -67.0 175.53 5.47 Favored 'Trans proline' 0 C--N 1.35 0.614 0 C-N-CA 123.39 2.726 . . . . 0.0 112.121 -176.881 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 63.3 t0 -142.46 125.23 15.99 Favored 'General case' 0 C--O 1.237 0.445 0 N-CA-C 105.154 -2.165 . . . . 0.0 105.154 166.429 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 5.3 p -55.33 -23.05 13.0 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.433 0 C-N-CA 123.816 0.846 . . . . 0.0 111.499 175.531 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 31.6 t -67.65 2.29 1.96 Allowed 'General case' 0 CA--C 1.54 0.573 0 O-C-N 120.895 -1.128 . . . . 0.0 112.248 175.565 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 47.3 p -114.65 3.22 14.72 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 125.272 1.429 . . . . 0.0 110.878 174.608 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 14.7 m-30 -85.57 175.79 8.58 Favored 'General case' 0 C--O 1.236 0.391 0 O-C-N 121.03 -1.044 . . . . 0.0 109.579 -179.362 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 15.7 mt-30 -120.14 114.27 21.7 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 124.271 1.029 . . . . 0.0 110.119 -178.348 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 69.0 t80 -72.79 135.74 45.31 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 123.344 0.658 . . . . 0.0 110.407 175.116 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -118.98 75.81 1.06 Allowed 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 125.421 1.488 . . . . 0.0 108.649 -173.543 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -56.52 -19.49 15.82 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 125.343 1.457 . . . . 0.0 114.662 -167.528 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 1.3 t -54.67 -30.76 56.32 Favored 'General case' 0 CA--C 1.554 1.111 0 C-N-CA 124.705 1.202 . . . . 0.0 110.234 170.427 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 47.1 m -132.12 -16.94 2.77 Favored 'General case' 0 C--N 1.346 0.439 0 N-CA-C 115.61 1.707 . . . . 0.0 115.61 -178.854 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 99.78 2.39 56.25 Favored Glycine 0 CA--C 1.535 1.326 0 CA-C-N 120.865 1.666 . . . . 0.0 114.297 172.223 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 80.4 m-85 -95.32 169.3 10.17 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 125.106 1.363 . . . . 0.0 110.657 178.083 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 71.3 m-85 -102.09 151.91 21.6 Favored 'General case' 0 N--CA 1.453 -0.319 0 N-CA-C 106.335 -1.728 . . . . 0.0 106.335 160.411 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 40.6 t80 -115.68 140.4 49.23 Favored 'General case' 0 C--O 1.241 0.625 0 C-N-CA 125.926 1.69 . . . . 0.0 107.457 175.525 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -121.96 76.34 39.65 Favored Pre-proline 0 N--CA 1.444 -0.763 0 N-CA-C 106.636 -1.616 . . . . 0.0 106.636 -158.561 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 27.2 Cg_endo -60.9 -19.49 62.53 Favored 'Trans proline' 0 CA--C 1.537 0.665 0 C-N-CA 122.415 2.077 . . . . 0.0 114.353 -168.536 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 14.8 tt0 -68.09 -22.79 64.9 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.539 1.135 . . . . 0.0 111.33 178.956 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.492 ' CB ' HD22 ' A' ' 34' ' ' LEU . 0.5 OUTLIER -116.13 -58.21 2.12 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 127.725 2.41 . . . . 0.0 107.091 -178.309 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 113.88 -7.59 23.71 Favored Glycine 0 CA--C 1.53 1.005 0 C-N-CA 127.443 2.449 . . . . 0.0 110.861 -169.992 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.492 HD22 ' CB ' ' A' ' 32' ' ' THR . 0.0 OUTLIER -59.5 168.71 1.49 Allowed 'General case' 0 N--CA 1.434 -1.237 0 C-N-CA 129.118 2.967 . . . . 0.0 111.086 170.95 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 63.4 m-85 -116.1 140.46 49.26 Favored 'General case' 0 C--O 1.238 0.478 0 CA-C-N 114.45 -1.25 . . . . 0.0 108.658 158.934 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 58.6 t80 -105.41 153.9 21.04 Favored 'General case' 0 C--N 1.325 -0.493 0 C-N-CA 125.387 1.475 . . . . 0.0 108.093 171.345 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 6.9 t0 -119.76 142.77 33.64 Favored Pre-proline 0 C--N 1.329 -0.31 0 N-CA-C 105.898 -1.89 . . . . 0.0 105.898 171.255 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -73.48 -28.68 11.84 Favored 'Trans proline' 0 N--CA 1.455 -0.779 0 C-N-CA 121.369 1.38 . . . . 0.0 113.01 -174.35 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 52.3 m-80 -95.24 -25.41 16.37 Favored 'General case' 0 N--CA 1.448 -0.528 0 C-N-CA 125.986 1.714 . . . . 0.0 110.467 -177.603 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 4.1 m -121.03 95.65 4.78 Favored 'General case' 0 C--O 1.223 -0.317 0 C-N-CA 124.536 1.135 . . . . 0.0 108.733 -178.654 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 20.7 mp0 -64.06 1.15 0.74 Allowed 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 125.665 1.586 . . . . 0.0 114.121 179.417 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 26.4 m-85 -77.29 109.04 10.86 Favored 'General case' 0 C--O 1.234 0.26 0 C-N-CA 126.024 1.73 . . . . 0.0 108.97 169.657 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 18.8 m-85 -67.23 157.38 33.97 Favored 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 125.472 1.509 . . . . 0.0 109.442 179.872 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' TYR . . . . . 0.425 ' CZ ' ' HA ' ' A' ' 46' ' ' ALA . 7.8 t80 -118.86 105.17 11.24 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 125.443 1.497 . . . . 0.0 107.885 178.875 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 30.1 t30 -79.25 92.18 5.09 Favored 'General case' 0 N--CA 1.445 -0.7 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 168.152 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.425 ' HA ' ' CZ ' ' A' ' 44' ' ' TYR . . . -56.54 -35.18 67.81 Favored 'General case' 0 N--CA 1.456 -0.144 0 C-N-CA 124.046 0.938 . . . . 0.0 112.482 179.743 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -45.76 -55.78 6.11 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 126.157 1.783 . . . . 0.0 111.606 -176.941 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.9 m -109.99 -1.84 17.42 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 123.736 0.814 . . . . 0.0 111.36 -172.827 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 40.9 mt-30 50.46 60.59 3.74 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 126.302 1.841 . . . . 0.0 109.442 -163.741 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -106.85 149.29 27.57 Favored 'General case' 0 C--O 1.233 0.198 0 N-CA-C 107.992 -1.114 . . . . 0.0 107.992 167.237 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 3.8 m-85 -104.79 131.03 52.75 Favored 'General case' 0 CA--C 1.515 -0.397 0 N-CA-C 105.475 -2.046 . . . . 0.0 105.475 168.498 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.403 HD23 ' HA ' ' A' ' 63' ' ' PRO . 49.9 mt -127.08 177.89 6.36 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 125.521 1.528 . . . . 0.0 108.164 -171.709 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 26.1 p90 -142.94 156.3 44.86 Favored 'General case' 0 N--CA 1.447 -0.618 0 N-CA-C 108.845 -0.798 . . . . 0.0 108.845 160.89 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 26.6 t-105 -82.52 118.95 23.63 Favored 'General case' 0 N--CA 1.448 -0.562 0 N-CA-C 106.937 -1.505 . . . . 0.0 106.937 171.288 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 20.9 t0 -109.39 93.58 4.58 Favored 'General case' 0 CA--C 1.516 -0.365 0 N-CA-C 107.918 -1.141 . . . . 0.0 107.918 171.966 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -62.89 -12.4 42.29 Favored Glycine 0 CA--C 1.53 1.029 0 CA-C-O 117.947 -1.474 . . . . 0.0 113.641 179.846 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 11.7 mt-10 -75.77 -32.95 60.14 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 121.228 2.514 . . . . 0.0 109.363 173.911 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 51.0 mtt85 -104.43 -5.06 22.02 Favored 'General case' 0 CA--C 1.529 0.137 0 C-N-CA 125.201 1.4 . . . . 0.0 111.727 -177.807 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 38.9 mtp180 44.28 43.75 6.16 Favored 'General case' 0 CA--C 1.514 -0.436 0 C-N-CA 128.604 2.762 . . . . 0.0 110.836 178.978 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 4.9 t -145.43 172.18 13.57 Favored 'General case' 0 N--CA 1.444 -0.737 0 N-CA-C 106.573 -1.639 . . . . 0.0 106.573 177.874 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 71.0 m-85 -94.58 140.42 29.88 Favored 'General case' 0 C--O 1.242 0.71 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 170.992 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -125.79 154.45 73.35 Favored Pre-proline 0 C--N 1.321 -0.661 0 C-N-CA 126.161 1.784 . . . . 0.0 107.182 173.124 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 63' ' ' PRO . . . . . 0.403 ' HA ' HD23 ' A' ' 52' ' ' LEU . 39.9 Cg_endo -68.33 145.52 65.96 Favored 'Trans proline' 0 N--CA 1.45 -1.081 0 C-N-CA 122.132 1.888 . . . . 0.0 109.62 172.974 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 0.322 0 C-N-CA 124.207 1.003 . . . . 0.0 111.411 173.872 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 28.5 m-85 . . . . . 0 C--O 1.239 0.544 0 CA-C-O 119.346 -0.359 . . . . 0.0 111.49 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 68.5 Cg_endo -74.51 -178.98 4.38 Favored 'Trans proline' 0 C--N 1.349 0.586 0 C-N-CA 122.957 2.438 . . . . 0.0 110.207 171.896 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 25.0 t -104.73 86.46 1.46 Allowed Pre-proline 0 CA--C 1.538 0.506 0 N-CA-C 106.05 -1.833 . . . . 0.0 106.05 176.422 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -68.67 170.62 14.81 Favored 'Trans proline' 0 N--CA 1.457 -0.639 0 C-N-CA 123.125 2.55 . . . . 0.0 109.134 -176.616 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 12.0 t0 -144.53 138.28 27.43 Favored 'General case' 0 CA--C 1.511 -0.532 0 N-CA-C 107.342 -1.355 . . . . 0.0 107.342 176.011 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.539 ' HA ' ' CD2' ' A' ' 18' ' ' TYR . 1.5 t -69.1 -19.27 23.6 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 N-CA-C 107.902 -1.147 . . . . 0.0 107.902 178.399 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 86.7 p -61.66 -15.66 41.87 Favored 'General case' 0 N--CA 1.43 -1.446 0 N-CA-C 113.606 0.965 . . . . 0.0 113.606 -179.384 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 14.0 t -124.08 9.92 8.73 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 126.308 1.843 . . . . 0.0 112.807 177.836 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' TYR . . . . . 0.539 ' CD2' ' HA ' ' A' ' 15' ' ' VAL . 18.3 m-30 -68.86 170.59 9.35 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-N 120.393 1.451 . . . . 0.0 108.488 166.577 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 14.3 mt-30 -118.1 106.25 12.67 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 124.521 1.128 . . . . 0.0 110.028 177.962 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 84.8 t80 -56.03 141.76 38.78 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 124.599 1.16 . . . . 0.0 111.456 170.879 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -126.04 95.09 4.28 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 124.158 0.983 . . . . 0.0 109.312 179.727 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -57.35 -23.21 47.51 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 125.176 1.39 . . . . 0.0 113.285 -177.637 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 5.2 t -48.59 -35.58 13.82 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 127.128 2.171 . . . . 0.0 109.659 172.983 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -120.68 -55.76 1.99 Allowed 'General case' 0 N--CA 1.445 -0.719 0 C-N-CA 124.167 0.987 . . . . 0.0 108.538 -177.768 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 117.0 28.71 2.36 Favored Glycine 0 CA--C 1.527 0.833 0 C-N-CA 123.965 0.793 . . . . 0.0 114.424 -174.904 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 39.4 m-85 -130.82 165.33 23.24 Favored 'General case' 0 C--O 1.239 0.504 0 C-N-CA 126.244 1.817 . . . . 0.0 106.804 -176.261 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 79.6 m-85 -90.41 140.17 29.97 Favored 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 124.554 1.141 . . . . 0.0 108.037 173.265 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 31.3 t80 -102.34 134.86 44.95 Favored 'General case' 0 C--O 1.237 0.433 0 N-CA-C 107.459 -1.311 . . . . 0.0 107.459 170.039 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -112.69 77.0 2.28 Favored Pre-proline 0 N--CA 1.447 -0.587 0 C-N-CA 125.89 1.676 . . . . 0.0 109.429 -166.347 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -67.22 -6.27 15.81 Favored 'Trans proline' 0 N--CA 1.46 -0.465 0 C-N-CA 122.929 2.42 . . . . 0.0 114.145 -170.82 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 3.9 tt0 -63.29 -26.11 68.62 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 118.516 0.598 . . . . 0.0 110.408 174.314 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 7.3 p -139.98 -21.15 0.88 Allowed 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 124.78 1.232 . . . . 0.0 113.474 179.453 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 97.45 14.81 39.95 Favored Glycine 0 CA--C 1.529 0.963 0 CA-C-N 119.054 0.843 . . . . 0.0 112.764 -178.463 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 24.3 mt -86.51 -178.33 6.39 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 118.634 1.217 . . . . 0.0 109.18 175.664 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 39.0 m-85 -126.63 146.42 50.18 Favored 'General case' 0 C--O 1.238 0.461 0 C-N-CA 124.507 1.123 . . . . 0.0 109.825 166.374 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 85.9 t80 -117.83 154.79 31.21 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.932 1.693 . . . . 0.0 109.348 177.878 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -124.95 143.81 45.11 Favored Pre-proline 0 CA--C 1.535 0.383 0 C-N-CA 126.248 1.819 . . . . 0.0 109.151 171.927 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 70.7 Cg_endo -79.33 -31.92 1.93 Allowed 'Trans proline' 0 N--CA 1.459 -0.516 0 C-N-CA 123.691 2.927 . . . . 0.0 113.853 -176.238 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 8.2 m-80 -81.98 -22.04 36.82 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 124.049 0.939 . . . . 0.0 109.592 176.656 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 38.4 m -137.6 98.1 3.61 Favored 'General case' 0 CA--C 1.513 -0.477 0 C-N-CA 125.501 1.521 . . . . 0.0 108.94 -170.554 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 19.7 mp0 -67.35 24.33 0.02 OUTLIER 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 127.733 2.413 . . . . 0.0 113.203 -179.278 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 33.2 m-85 -99.25 101.44 12.76 Favored 'General case' 0 CA--C 1.536 0.42 0 O-C-N 120.202 -1.561 . . . . 0.0 108.261 177.501 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 29.6 m-85 -65.69 111.83 3.38 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 128.554 2.741 . . . . 0.0 110.604 -179.747 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 63.8 t80 -75.33 127.29 32.81 Favored 'General case' 0 C--N 1.326 -0.452 0 C-N-CA 125.618 1.567 . . . . 0.0 110.448 -176.495 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 45.0 t30 -99.3 81.33 2.53 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 126.886 2.074 . . . . 0.0 109.54 175.364 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -46.08 -36.79 6.08 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 124.749 1.22 . . . . 0.0 111.992 176.936 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.7 tt0 -49.78 -31.07 10.75 Favored 'General case' 0 N--CA 1.447 -0.611 0 C-N-CA 127.573 2.349 . . . . 0.0 114.121 -178.425 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 40.2 m -134.04 17.13 3.81 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 123.52 0.728 . . . . 0.0 111.223 172.146 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 40.8 mt-30 44.99 32.31 0.83 Allowed 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 125.519 1.528 . . . . 0.0 112.006 -163.376 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -93.6 168.33 11.1 Favored 'General case' 0 N--CA 1.452 -0.345 0 O-C-N 120.9 -1.125 . . . . 0.0 109.848 -176.167 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 5.7 m-85 -116.57 128.07 55.08 Favored 'General case' 0 N--CA 1.446 -0.633 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 -174.985 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.436 HD23 ' HA ' ' A' ' 63' ' ' PRO . 22.6 mt -124.02 178.24 5.39 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 127.326 2.25 . . . . 0.0 109.885 179.686 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 5.1 p90 -145.69 152.44 39.62 Favored 'General case' 0 C--O 1.235 0.318 0 C-N-CA 127.788 2.435 . . . . 0.0 106.943 168.441 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 69.2 t-105 -77.1 142.98 39.53 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 107.316 -1.364 . . . . 0.0 107.316 164.569 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 63.9 t0 -131.85 104.53 6.93 Favored 'General case' 0 C--O 1.234 0.272 0 N-CA-C 108.876 -0.786 . . . . 0.0 108.876 169.708 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -75.81 -7.63 83.82 Favored Glycine 0 CA--C 1.533 1.163 0 C-N-CA 124.362 0.982 . . . . 0.0 113.345 -178.935 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 73.7 mt-10 -75.04 -31.57 61.34 Favored 'General case' 0 CA--C 1.531 0.222 0 O-C-N 121.066 -1.255 . . . . 0.0 109.933 170.342 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 63.9 mtt180 -110.04 -7.31 14.95 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 125.502 1.521 . . . . 0.0 112.668 -177.115 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 61.3 mtt85 44.98 55.66 5.97 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 128.294 2.638 . . . . 0.0 110.752 -174.02 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 11.3 t -150.72 169.46 21.56 Favored 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 123.268 0.627 . . . . 0.0 109.833 174.051 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 93.4 m-85 -92.43 134.88 34.52 Favored 'General case' 0 C--O 1.238 0.458 0 N-CA-C 107.23 -1.396 . . . . 0.0 107.23 164.071 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -126.95 157.7 71.02 Favored Pre-proline 0 C--N 1.322 -0.608 0 C-N-CA 127.026 2.13 . . . . 0.0 111.113 178.362 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 63' ' ' PRO . . . . . 0.436 ' HA ' HD23 ' A' ' 52' ' ' LEU . 42.8 Cg_endo -75.23 123.41 7.74 Favored 'Trans proline' 0 CA--C 1.533 0.471 0 C-N-CA 123.925 3.083 . . . . 0.0 112.568 -177.939 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.298 0 N-CA-C 115.831 1.789 . . . . 0.0 115.831 -169.091 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 61.4 m-85 . . . . . 0 C--O 1.242 0.708 0 N-CA-C 112.013 0.375 . . . . 0.0 112.013 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 92.3 Cg_endo -68.62 179.28 3.2 Favored 'Trans proline' 0 N--CA 1.456 -0.713 0 C-N-CA 123.541 2.827 . . . . 0.0 109.976 167.639 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 10.7 t -105.1 88.39 2.41 Favored Pre-proline 0 N--CA 1.45 -0.445 0 N-CA-C 106.748 -1.575 . . . . 0.0 106.748 176.403 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_endo -58.67 170.89 2.26 Favored 'Trans proline' 0 CA--C 1.545 1.048 0 CA-C-N 120.248 1.124 . . . . 0.0 110.397 171.703 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 15.3 t0 -132.84 129.25 38.22 Favored 'General case' 0 N--CA 1.447 -0.621 0 N-CA-C 106.139 -1.8 . . . . 0.0 106.139 164.524 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.671 HG11 ' CE2' ' A' ' 36' ' ' TYR . 1.7 t -59.0 -26.6 33.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 114.515 -1.221 . . . . 0.0 108.149 173.545 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 36.4 p -60.34 -38.22 83.1 Favored 'General case' 0 N--CA 1.437 -1.114 0 C-N-CA 118.033 -1.467 . . . . 0.0 109.047 -172.42 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 16.4 p -87.68 18.33 4.09 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 126.436 1.894 . . . . 0.0 111.778 179.374 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' TYR . . . . . 0.586 ' CE2' HG13 ' A' ' 15' ' ' VAL . 13.3 m-30 -79.96 160.6 25.88 Favored 'General case' 0 C--O 1.234 0.258 0 O-C-N 119.903 -1.748 . . . . 0.0 110.049 170.518 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 25.6 mt-30 -100.56 109.6 21.71 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 107.975 -1.12 . . . . 0.0 107.975 -178.429 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 66.9 t80 -63.45 152.68 37.68 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 124.081 0.953 . . . . 0.0 110.421 176.042 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -128.73 105.3 8.16 Favored 'General case' 0 CA--C 1.512 -0.505 0 C-N-CA 125.139 1.376 . . . . 0.0 108.498 168.135 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -61.09 -27.47 68.39 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 119.172 -0.442 . . . . 0.0 112.109 169.917 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 15.1 t -66.08 -4.98 8.36 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.347 1.059 . . . . 0.0 113.184 -178.132 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 12.5 t -140.75 -47.8 0.42 Allowed 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 123.301 0.641 . . . . 0.0 109.555 172.619 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 112.0 43.66 0.92 Allowed Glycine 0 CA--C 1.526 0.743 0 C-N-CA 124.921 1.248 . . . . 0.0 111.929 -177.75 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 68.8 m-85 -136.13 170.28 16.27 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 119.401 1.601 . . . . 0.0 111.161 -177.785 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 79.4 m-85 -110.91 125.96 54.22 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 124.76 1.224 . . . . 0.0 107.707 173.685 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 34.8 t80 -88.56 139.48 30.43 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 124.368 1.067 . . . . 0.0 108.396 177.962 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 27.7 t0 -97.4 86.54 0.42 Allowed Pre-proline 0 CA--C 1.529 0.145 0 C-N-CA 126.946 2.098 . . . . 0.0 109.247 177.796 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -70.37 -5.08 15.77 Favored 'Trans proline' 0 N--CA 1.456 -0.702 0 C-N-CA 122.592 2.195 . . . . 0.0 113.685 175.798 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 2.4 mm-40 -73.77 -28.26 61.57 Favored 'General case' 0 CA--C 1.533 0.309 0 O-C-N 121.328 -0.858 . . . . 0.0 109.368 175.284 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 23.7 p -140.31 -24.11 0.81 Allowed 'General case' 0 C--O 1.238 0.453 0 N-CA-C 115.079 1.511 . . . . 0.0 115.079 -169.404 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 104.13 9.95 35.49 Favored Glycine 0 CA--C 1.53 1.021 0 C-N-CA 124.135 0.874 . . . . 0.0 112.986 177.426 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 19.8 mt -89.84 179.99 5.86 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 125.544 1.538 . . . . 0.0 109.07 178.253 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 57.4 m-85 -124.3 171.37 9.94 Favored 'General case' 0 C--O 1.234 0.282 0 C-N-CA 124.474 1.11 . . . . 0.0 108.843 162.368 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.671 ' CE2' HG11 ' A' ' 15' ' ' VAL . 68.1 t80 -143.21 159.36 42.46 Favored 'General case' 0 C--O 1.238 0.467 0 C-N-CA 128.224 2.609 . . . . 0.0 108.337 179.24 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -127.66 144.35 50.82 Favored Pre-proline 0 C--O 1.235 0.321 0 C-N-CA 124.576 1.15 . . . . 0.0 108.373 174.229 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 61.9 Cg_endo -75.07 -35.07 3.3 Favored 'Trans proline' 0 N--CA 1.45 -1.057 0 C-N-CA 121.944 1.763 . . . . 0.0 113.324 -173.036 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 3.6 m-80 -83.08 -21.72 33.64 Favored 'General case' 0 CA--C 1.524 -0.056 0 CA-C-N 119.152 0.887 . . . . 0.0 110.91 175.807 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 42.7 t -130.89 89.36 2.74 Favored 'General case' 0 N--CA 1.45 -0.472 0 N-CA-C 107.449 -1.315 . . . . 0.0 107.449 -166.85 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -55.92 -9.25 0.55 Allowed 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.873 1.269 . . . . 0.0 113.255 -177.792 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 11.5 m-85 -62.95 107.04 0.91 Allowed 'General case' 0 N--CA 1.449 -0.486 0 C-N-CA 124.951 1.3 . . . . 0.0 108.807 170.566 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 28.2 m-85 -59.89 156.75 13.76 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 124.756 1.222 . . . . 0.0 109.28 170.915 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 83.0 t80 -117.35 124.45 48.96 Favored 'General case' 0 N--CA 1.447 -0.602 0 C-N-CA 124.508 1.123 . . . . 0.0 108.116 177.74 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 27.1 t30 -98.15 84.65 3.3 Favored 'General case' 0 N--CA 1.446 -0.654 0 C-N-CA 126.754 2.022 . . . . 0.0 107.824 176.084 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -53.85 -26.52 24.89 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 124.324 1.049 . . . . 0.0 112.181 175.639 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -52.49 -41.64 63.58 Favored 'General case' 0 N--CA 1.446 -0.637 0 C-N-CA 124.496 1.118 . . . . 0.0 112.113 176.861 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 14.6 m -128.43 15.91 6.57 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 125.15 1.38 . . . . 0.0 111.726 -179.766 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 40.2 mt-30 50.62 19.01 0.53 Allowed 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 127.091 2.156 . . . . 0.0 114.35 -171.803 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -91.31 159.14 16.17 Favored 'General case' 0 N--CA 1.454 -0.239 0 C-N-CA 124.02 0.928 . . . . 0.0 109.798 -171.071 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -98.49 146.75 25.45 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 108.548 -0.908 . . . . 0.0 108.548 174.849 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.48 HD23 ' HA ' ' A' ' 63' ' ' PRO . 82.7 mt -140.01 -178.03 5.26 Favored 'General case' 0 C--N 1.326 -0.413 0 C-N-CA 125.564 1.546 . . . . 0.0 107.915 -179.386 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 26.5 p90 -143.32 149.69 38.13 Favored 'General case' 0 C--N 1.327 -0.378 0 C-N-CA 125.188 1.395 . . . . 0.0 108.191 168.073 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 42.0 t-105 -85.71 139.38 31.4 Favored 'General case' 0 C--O 1.235 0.337 0 N-CA-C 106.57 -1.641 . . . . 0.0 106.57 168.399 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 7.6 t0 -134.85 113.8 11.95 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 122.899 0.48 . . . . 0.0 110.057 -175.833 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -74.37 -12.01 82.18 Favored Glycine 0 CA--C 1.533 1.183 0 CA-C-O 119.117 -0.824 . . . . 0.0 113.498 176.179 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -67.15 -35.23 79.26 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 119.67 1.735 . . . . 0.0 108.937 176.388 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 43.0 mtt85 -120.21 -4.29 10.0 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 124.556 1.142 . . . . 0.0 112.75 -177.558 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 9.7 mtp85 49.19 51.53 16.08 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 126.695 1.998 . . . . 0.0 110.475 -173.247 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 1.4 t -146.36 173.86 11.89 Favored 'General case' 0 CA--C 1.536 0.424 0 O-C-N 121.345 -0.847 . . . . 0.0 108.793 -179.888 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 99.1 m-85 -111.03 119.66 39.78 Favored 'General case' 0 C--O 1.234 0.276 0 C-N-CA 125.044 1.337 . . . . 0.0 108.547 -179.445 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -126.4 156.84 72.12 Favored Pre-proline 0 N--CA 1.469 0.503 0 C-N-CA 125.946 1.698 . . . . 0.0 111.871 -169.805 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 63' ' ' PRO . . . . . 0.48 ' HA ' HD23 ' A' ' 52' ' ' LEU . 60.9 Cg_endo -74.43 118.46 5.36 Favored 'Trans proline' 0 N--CA 1.459 -0.553 0 C-N-CA 122.439 2.092 . . . . 0.0 111.947 -175.505 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.347 0 O-C-N 121.479 -0.763 . . . . 0.0 112.069 178.159 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 12.9 m-85 . . . . . 0 CA--C 1.539 0.553 0 CA-C-O 118.784 -0.627 . . . . 0.0 110.055 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -59.23 -164.88 0.03 OUTLIER 'Trans proline' 0 CA--C 1.542 0.916 1 C-N-CA 125.769 4.312 . . . . 0.0 113.881 162.268 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 47.0 t -126.2 88.06 55.01 Favored Pre-proline 0 CA--C 1.541 0.613 0 C-N-CA 127.083 2.153 . . . . 0.0 108.804 -176.473 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_endo -65.24 160.0 44.33 Favored 'Trans proline' 0 CA--C 1.539 0.745 0 C-N-CA 123.657 2.905 . . . . 0.0 112.451 -173.468 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 42.5 t0 -148.73 127.64 12.67 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 106.709 -1.589 . . . . 0.0 106.709 175.797 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 11.3 p -60.4 -21.44 22.9 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.534 0 C-N-CA 123.956 0.902 . . . . 0.0 112.123 177.92 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 42.6 t -62.77 -7.49 5.06 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 125.489 1.516 . . . . 0.0 113.381 -178.882 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 14.5 t -124.29 12.35 8.82 Favored 'General case' 0 CA--C 1.533 0.296 0 O-C-N 120.549 -1.344 . . . . 0.0 111.34 177.142 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 10.9 m-30 -73.88 169.28 17.74 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-O 122.101 0.953 . . . . 0.0 110.8 175.423 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 87.4 mt-30 -113.55 101.72 9.61 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 125.936 1.694 . . . . 0.0 107.49 177.763 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 74.9 t80 -67.17 147.02 53.62 Favored 'General case' 0 C--N 1.328 -0.348 0 O-C-N 121.82 -0.55 . . . . 0.0 110.215 169.828 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -129.17 87.99 2.64 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 123.351 0.661 . . . . 0.0 110.793 179.789 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -58.72 -21.94 56.27 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 114.075 1.139 . . . . 0.0 114.075 -168.967 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 3.2 t -58.61 -19.12 35.85 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.577 1.151 . . . . 0.0 112.41 174.405 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 48.8 m -137.54 -23.51 1.08 Allowed 'General case' 0 CA--C 1.539 0.519 0 N-CA-C 114.563 1.32 . . . . 0.0 114.563 177.43 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 98.6 19.98 20.98 Favored Glycine 0 CA--C 1.536 1.364 0 CA-C-N 120.361 1.437 . . . . 0.0 115.535 170.413 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 7.7 m-85 -122.62 169.55 10.92 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 119.595 1.698 . . . . 0.0 110.395 175.72 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 88.3 m-85 -102.49 153.43 20.06 Favored 'General case' 0 N--CA 1.448 -0.531 0 C-N-CA 125.186 1.395 . . . . 0.0 109.617 173.656 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 55.2 t80 -118.86 143.75 46.78 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 126.107 1.763 . . . . 0.0 108.699 172.147 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 65.7 t0 -106.15 87.29 2.43 Favored Pre-proline 0 C--N 1.33 -0.272 0 C-N-CA 126.749 2.02 . . . . 0.0 111.941 -175.738 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -61.16 -6.74 6.92 Favored 'Trans proline' 0 CA--C 1.535 0.551 0 C-N-CA 123.038 2.492 . . . . 0.0 114.747 176.145 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 25.7 mt-30 -74.98 -19.97 59.87 Favored 'General case' 0 CA--C 1.535 0.366 0 O-C-N 120.731 -1.23 . . . . 0.0 111.057 173.772 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 27.5 p -143.19 -40.75 0.31 Allowed 'General case' 0 C--O 1.235 0.339 0 C-N-CA 123.687 0.795 . . . . 0.0 112.791 -166.364 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 96.03 40.25 4.09 Favored Glycine 0 CA--C 1.525 0.663 0 C-N-CA 124.606 1.098 . . . . 0.0 111.744 -176.046 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 10.8 mt -115.56 167.01 11.27 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 124.961 1.305 . . . . 0.0 108.997 172.853 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 37.2 m-85 -106.88 160.57 15.41 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 118.801 0.728 . . . . 0.0 110.359 166.37 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 38.3 t80 -141.95 152.02 43.12 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 126.593 1.957 . . . . 0.0 109.23 -174.78 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -124.63 143.71 44.23 Favored Pre-proline 0 CA--C 1.535 0.402 0 C-N-CA 125.762 1.625 . . . . 0.0 108.797 174.863 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 95.5 Cg_endo -77.46 -21.27 11.74 Favored 'Trans proline' 0 CA--C 1.535 0.535 0 C-N-CA 123.089 2.526 . . . . 0.0 115.159 -172.553 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 81.9 m-20 -92.31 -33.94 14.41 Favored 'General case' 0 N--CA 1.447 -0.622 0 C-N-CA 125.513 1.525 . . . . 0.0 110.018 174.731 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 41.5 p -125.19 84.1 2.24 Favored 'General case' 0 N--CA 1.451 -0.375 0 C-N-CA 123.861 0.864 . . . . 0.0 108.806 -165.978 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 21.0 mp0 -57.87 -1.09 0.09 Allowed 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 127.149 2.18 . . . . 0.0 114.726 -175.666 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 45.3 m-85 -65.4 107.48 1.67 Allowed 'General case' 0 C--O 1.236 0.35 0 C-N-CA 125.529 1.532 . . . . 0.0 107.807 169.764 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 68.9 m-85 -65.72 140.83 58.48 Favored 'General case' 0 C--O 1.235 0.312 0 C-N-CA 123.87 0.868 . . . . 0.0 108.846 -178.96 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 64.8 t80 -95.29 109.72 21.82 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-O 122.752 1.263 . . . . 0.0 108.2 175.246 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 35.9 t30 -83.29 80.32 9.11 Favored 'General case' 0 N--CA 1.44 -0.946 0 CA-C-N 114.171 -1.377 . . . . 0.0 108.509 173.966 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -46.25 -35.3 5.11 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 125.095 1.358 . . . . 0.0 112.225 178.444 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -44.41 -50.62 9.18 Favored 'General case' 0 N--CA 1.444 -0.756 0 C-N-CA 127.942 2.497 . . . . 0.0 111.908 177.624 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 13.9 m -126.09 19.4 7.67 Favored 'General case' 0 C--N 1.332 -0.169 0 C-N-CA 124.845 1.258 . . . . 0.0 111.065 -178.345 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 11.1 mp0 50.88 18.67 0.54 Allowed 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 127.75 2.42 . . . . 0.0 113.275 -174.975 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -84.82 164.07 18.68 Favored 'General case' 0 N--CA 1.447 -0.578 0 C-N-CA 125.145 1.378 . . . . 0.0 111.303 -170.463 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 4.9 m-85 -118.57 121.57 40.54 Favored 'General case' 0 N--CA 1.449 -0.516 0 N-CA-C 105.62 -1.993 . . . . 0.0 105.62 -177.119 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 63.7 mt -124.4 176.56 6.4 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 125.076 1.35 . . . . 0.0 108.223 -170.895 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 13.5 p90 -135.4 148.21 49.28 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 108.121 -1.066 . . . . 0.0 108.121 168.604 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 57.8 t-105 -74.89 135.44 41.5 Favored 'General case' 0 C--O 1.236 0.359 0 N-CA-C 106.395 -1.706 . . . . 0.0 106.395 165.898 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 35.3 t0 -129.05 95.05 3.97 Favored 'General case' 0 N--CA 1.448 -0.564 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 177.567 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -66.09 -17.98 66.35 Favored Glycine 0 CA--C 1.526 0.744 0 CA-C-O 119.232 -0.76 . . . . 0.0 112.381 176.647 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 -68.33 -30.29 69.23 Favored 'General case' 0 C--N 1.34 0.166 0 CA-C-N 119.206 1.503 . . . . 0.0 109.366 174.559 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 47.6 mtt180 -102.86 -9.9 19.52 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.67 1.188 . . . . 0.0 112.106 178.327 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 11.8 mtm-85 44.68 54.94 6.23 Favored 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 127.539 2.335 . . . . 0.0 111.111 -167.297 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 7.5 t -154.94 178.15 10.5 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 124.092 0.957 . . . . 0.0 109.104 177.995 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 97.3 m-85 -109.36 128.28 54.99 Favored 'General case' 0 C--O 1.233 0.221 0 N-CA-C 107.571 -1.27 . . . . 0.0 107.571 168.349 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -126.73 158.34 68.4 Favored Pre-proline 0 C--N 1.324 -0.525 0 C-N-CA 126.494 1.918 . . . . 0.0 110.64 -173.692 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -72.61 136.93 26.74 Favored 'Trans proline' 0 N--CA 1.455 -0.778 0 C-N-CA 122.421 2.081 . . . . 0.0 110.135 -178.057 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 0.367 0 C-N-CA 123.521 0.728 . . . . 0.0 111.959 -176.824 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 37.8 m-85 . . . . . 0 C--O 1.241 0.614 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 29.5 Cg_endo -65.29 -178.25 0.81 Allowed 'Trans proline' 0 CA--C 1.54 0.824 0 C-N-CA 122.965 2.443 . . . . 0.0 111.422 160.202 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 59.1 t -111.34 87.99 8.31 Favored Pre-proline 0 CA--C 1.537 0.465 0 C-N-CA 127.653 2.381 . . . . 0.0 107.584 -173.242 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -68.82 164.92 31.57 Favored 'Trans proline' 0 CA--C 1.539 0.74 0 C-N-CA 123.467 2.778 . . . . 0.0 111.751 -179.109 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.9 t0 -143.25 130.58 20.96 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 108.003 -1.11 . . . . 0.0 108.003 167.653 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 14.0 p -58.68 -17.3 10.26 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.769 0 C-N-CA 124.25 1.02 . . . . 0.0 112.047 176.456 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 32.2 t -53.55 -26.2 20.28 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 125.708 1.603 . . . . 0.0 113.061 173.535 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 5.9 t -119.77 17.68 12.68 Favored 'General case' 0 CA--C 1.545 0.774 0 CA-C-N 119.33 0.968 . . . . 0.0 111.738 -175.18 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 8.1 m-30 -73.64 -168.98 0.63 Allowed 'General case' 0 C--O 1.237 0.398 0 C-N-CA 125.305 1.442 . . . . 0.0 110.456 171.741 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 6.8 mt-30 -122.43 150.86 41.9 Favored 'General case' 0 N--CA 1.446 -0.637 0 N-CA-C 107.018 -1.475 . . . . 0.0 107.018 163.81 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 78.2 t80 -93.95 152.42 18.86 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 108.122 -1.066 . . . . 0.0 108.122 163.909 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -136.05 86.52 2.24 Favored 'General case' 0 CA--C 1.511 -0.539 0 N-CA-C 107.477 -1.305 . . . . 0.0 107.477 175.114 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -47.03 -30.89 2.91 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 126.773 2.029 . . . . 0.0 112.773 179.773 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 1.3 t -65.9 -26.78 67.77 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 123.844 0.858 . . . . 0.0 110.682 -176.78 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 30.2 m -109.15 -24.15 11.28 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.599 1.159 . . . . 0.0 111.641 167.544 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 79.93 27.62 52.77 Favored Glycine 0 CA--C 1.526 0.757 0 C-N-CA 124.558 1.075 . . . . 0.0 112.162 -178.384 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 31.4 m-85 -118.09 169.1 9.95 Favored 'General case' 0 CA--C 1.521 -0.169 0 C-N-CA 124.965 1.306 . . . . 0.0 108.426 179.51 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 73.6 m-85 -94.17 154.46 17.56 Favored 'General case' 0 N--CA 1.449 -0.499 0 N-CA-C 108.25 -1.018 . . . . 0.0 108.25 159.848 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 20.1 t80 -117.93 137.1 53.06 Favored 'General case' 0 N--CA 1.447 -0.624 0 C-N-CA 127.845 2.458 . . . . 0.0 106.472 174.636 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 47.9 t0 -100.62 86.72 0.69 Allowed Pre-proline 0 C--N 1.327 -0.384 0 C-N-CA 128.088 2.555 . . . . 0.0 108.359 -179.648 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_endo -66.0 -11.9 33.03 Favored 'Trans proline' 0 N--CA 1.458 -0.593 0 C-N-CA 122.162 1.908 . . . . 0.0 114.244 177.646 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 56.7 mm-40 -63.51 -52.99 58.86 Favored 'General case' 0 C--O 1.233 0.196 0 N-CA-C 107.164 -1.421 . . . . 0.0 107.164 173.276 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 45.4 p -110.35 -32.53 6.92 Favored 'General case' 0 CA--C 1.532 0.274 0 N-CA-C 114.112 1.153 . . . . 0.0 114.112 -169.564 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 106.74 12.16 25.06 Favored Glycine 0 CA--C 1.529 0.968 0 C-N-CA 124.994 1.283 . . . . 0.0 113.378 -175.816 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 50.7 mt -87.58 169.52 12.1 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 118.57 1.185 . . . . 0.0 109.701 178.453 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 42.7 m-85 -112.02 161.53 16.36 Favored 'General case' 0 C--O 1.234 0.284 0 O-C-N 121.454 -0.779 . . . . 0.0 109.062 163.076 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 93.3 t80 -142.63 152.67 42.72 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 126.077 1.751 . . . . 0.0 108.685 -176.384 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -124.15 144.18 44.68 Favored Pre-proline 0 N--CA 1.467 0.38 0 CA-C-N 118.777 0.717 . . . . 0.0 109.892 177.11 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -72.99 -34.25 6.65 Favored 'Trans proline' 0 N--CA 1.456 -0.727 0 C-N-CA 122.263 1.975 . . . . 0.0 114.271 -177.366 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -77.65 -27.59 51.04 Favored 'General case' 0 CA--C 1.517 -0.323 0 CA-C-N 120.043 1.292 . . . . 0.0 112.617 172.791 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -134.08 83.66 2.06 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 106.833 -1.543 . . . . 0.0 106.833 -153.522 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -60.23 -6.77 1.59 Allowed 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 126.167 1.787 . . . . 0.0 114.18 -165.754 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 39.1 m-85 -65.04 123.57 19.82 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 123.956 0.902 . . . . 0.0 110.048 171.766 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 38.8 m-85 -75.44 152.86 37.9 Favored 'General case' 0 N--CA 1.45 -0.451 0 N-CA-C 108.688 -0.856 . . . . 0.0 108.688 174.046 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 9.0 t80 -114.42 109.12 17.83 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 126.099 1.76 . . . . 0.0 106.641 -177.885 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 44.7 t30 -83.62 77.15 9.9 Favored 'General case' 0 N--CA 1.445 -0.688 0 C-N-CA 125.272 1.429 . . . . 0.0 107.357 171.129 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -52.18 -33.14 39.37 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 123.017 0.527 . . . . 0.0 110.32 178.667 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -47.78 -32.04 5.55 Favored 'General case' 0 N--CA 1.448 -0.548 0 C-N-CA 127.663 2.385 . . . . 0.0 114.74 178.069 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 19.9 m -138.36 25.96 2.64 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 123.851 0.86 . . . . 0.0 110.039 170.12 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 24.5 mt-30 52.35 18.44 0.92 Allowed 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 127.503 2.321 . . . . 0.0 114.893 -176.859 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -95.52 159.58 14.92 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 123.638 0.775 . . . . 0.0 110.535 -166.942 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 9.5 m-85 -114.12 127.15 55.78 Favored 'General case' 0 CA--C 1.516 -0.358 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 -169.947 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 53.2 mt -126.53 174.63 8.51 Favored 'General case' 0 C--N 1.324 -0.54 0 C-N-CA 124.415 1.086 . . . . 0.0 108.691 -170.066 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 13.5 p90 -134.59 153.49 51.94 Favored 'General case' 0 N--CA 1.447 -0.608 0 N-CA-C 106.881 -1.526 . . . . 0.0 106.881 162.072 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 46.9 t-105 -78.28 127.69 32.61 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 105.713 -1.958 . . . . 0.0 105.713 164.703 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 19.9 t0 -110.24 108.78 19.02 Favored 'General case' 0 CA--C 1.515 -0.378 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 166.475 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -72.57 -15.39 77.57 Favored Glycine 0 N--CA 1.441 -1.003 0 CA-C-O 116.84 -2.089 . . . . 0.0 112.831 176.266 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -69.87 -56.18 7.76 Favored 'General case' 0 C--N 1.346 0.442 0 CA-C-N 121.021 2.411 . . . . 0.0 107.596 176.667 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 62.3 mtt85 -80.96 -3.97 53.41 Favored 'General case' 0 N--CA 1.456 -0.136 0 C-N-CA 124.047 0.939 . . . . 0.0 113.148 178.937 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 42.0 mtt180 43.36 58.18 3.52 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 126.982 2.113 . . . . 0.0 109.7 -175.276 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 6.2 t -153.88 157.45 39.29 Favored 'General case' 0 N--CA 1.448 -0.563 0 N-CA-C 107.143 -1.428 . . . . 0.0 107.143 176.759 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 71.7 m-85 -86.88 132.07 33.92 Favored 'General case' 0 C--O 1.237 0.398 0 N-CA-C 106.202 -1.777 . . . . 0.0 106.202 169.662 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -125.8 154.48 73.38 Favored Pre-proline 0 C--N 1.322 -0.627 0 C-N-CA 125.124 1.37 . . . . 0.0 110.391 -176.682 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -72.22 130.3 16.21 Favored 'Trans proline' 0 N--CA 1.454 -0.834 0 C-N-CA 122.523 2.149 . . . . 0.0 110.253 -178.112 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.235 0.297 0 N-CA-C 112.992 0.738 . . . . 0.0 112.992 -178.539 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 36.6 m-85 . . . . . 0 CA--C 1.539 0.52 0 CA-C-O 119.119 -0.467 . . . . 0.0 110.0 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -66.09 169.55 13.37 Favored 'Trans proline' 0 C--N 1.349 0.57 0 C-N-CA 123.78 2.987 . . . . 0.0 109.828 172.803 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 38.8 t -111.94 85.4 6.42 Favored Pre-proline 0 CA--C 1.539 0.547 0 N-CA-C 107.659 -1.237 . . . . 0.0 107.659 177.668 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -72.92 178.38 6.52 Favored 'Trans proline' 0 N--CA 1.457 -0.643 0 C-N-CA 123.669 2.913 . . . . 0.0 111.035 177.285 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -159.3 32.21 0.2 Allowed 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 113.367 0.877 . . . . 0.0 113.367 -177.285 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . 0.373 11.9 p 42.88 23.25 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.553 1.08 0 C-N-CA 128.072 2.549 . . . . 0.0 113.085 -173.805 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 7.5 t -113.51 -12.73 12.88 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 127.795 2.438 . . . . 0.0 109.287 -174.746 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 2.8 p -112.7 1.57 15.73 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 124.516 1.127 . . . . 0.0 111.08 -179.945 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 11.5 m-30 -85.0 173.27 10.65 Favored 'General case' 0 C--N 1.341 0.235 0 C-N-CA 124.597 1.159 . . . . 0.0 111.344 -167.294 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 68.5 mt-30 -119.89 99.1 6.43 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 126.023 1.729 . . . . 0.0 108.541 -174.297 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 87.1 t80 -58.18 143.82 42.83 Favored 'General case' 0 C--N 1.326 -0.422 0 O-C-N 122.302 -0.249 . . . . 0.0 111.012 171.246 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 4.1 t0 -122.64 112.68 18.26 Favored 'General case' 0 CA--C 1.515 -0.379 0 C-N-CA 123.902 0.881 . . . . 0.0 109.802 172.716 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -63.46 -19.36 64.66 Favored 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 124.794 1.238 . . . . 0.0 112.974 176.875 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 3.2 t -59.48 -32.81 70.61 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 123.445 0.698 . . . . 0.0 111.643 176.62 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 66.6 m -132.6 -20.54 2.3 Favored 'General case' 0 N--CA 1.462 0.162 0 C-N-CA 123.953 0.901 . . . . 0.0 112.209 -173.781 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 86.83 10.9 71.6 Favored Glycine 0 CA--C 1.526 0.737 0 C-N-CA 124.084 0.849 . . . . 0.0 111.942 -179.684 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 5.0 m-85 -96.87 168.74 10.3 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-N 118.429 1.115 . . . . 0.0 108.438 -177.313 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 93.8 m-85 -100.94 141.18 34.2 Favored 'General case' 0 N--CA 1.45 -0.44 0 N-CA-C 107.404 -1.332 . . . . 0.0 107.404 171.205 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 39.0 t80 -107.6 139.79 41.59 Favored 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 125.532 1.533 . . . . 0.0 107.634 175.03 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 62.3 t0 -104.1 87.27 1.53 Allowed Pre-proline 0 C--N 1.328 -0.347 0 C-N-CA 126.108 1.763 . . . . 0.0 111.672 -178.734 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -61.5 -12.48 24.61 Favored 'Trans proline' 0 N--CA 1.457 -0.659 0 C-N-CA 122.505 2.137 . . . . 0.0 114.289 176.959 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 22.4 mm-40 -72.7 -30.12 63.95 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-N 119.205 0.911 . . . . 0.0 110.599 178.65 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 22.0 p -120.54 -50.28 2.21 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 124.657 1.183 . . . . 0.0 109.276 -166.947 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 101.12 46.11 1.77 Allowed Glycine 0 CA--C 1.525 0.709 0 N-CA-C 108.995 -1.642 . . . . 0.0 108.995 -168.68 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 20.9 mt -126.57 171.19 11.31 Favored 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 125.384 1.474 . . . . 0.0 109.295 176.682 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 51.0 m-85 -114.69 164.79 13.56 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 124.69 1.196 . . . . 0.0 108.672 166.18 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 50.3 t80 -145.64 152.11 39.13 Favored 'General case' 0 C--O 1.239 0.518 0 C-N-CA 126.873 2.069 . . . . 0.0 107.576 179.025 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -121.9 143.83 39.54 Favored Pre-proline 0 CA--C 1.535 0.39 0 C-N-CA 123.421 0.689 . . . . 0.0 109.636 175.219 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo -76.33 -25.68 9.62 Favored 'Trans proline' 0 N--CA 1.458 -0.593 0 C-N-CA 121.953 1.768 . . . . 0.0 113.236 -176.093 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 26.8 m-20 -90.9 -21.21 21.51 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 119.538 1.063 . . . . 0.0 112.676 175.262 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 86.4 p -129.26 91.12 3.13 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 123.861 0.864 . . . . 0.0 109.597 179.406 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -56.02 -5.96 0.21 Allowed 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 128.71 2.804 . . . . 0.0 115.63 -171.71 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 54.5 m-85 -68.95 158.47 34.6 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 123.861 0.864 . . . . 0.0 108.851 172.755 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 31.6 m-85 -105.26 133.16 50.48 Favored 'General case' 0 N--CA 1.449 -0.518 0 N-CA-C 108.286 -1.005 . . . . 0.0 108.286 179.788 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 74.6 t80 -90.28 118.18 29.59 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 107.982 -1.118 . . . . 0.0 107.982 175.517 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 20.9 t30 -96.49 86.2 4.09 Favored 'General case' 0 N--CA 1.442 -0.831 0 C-N-CA 126.328 1.851 . . . . 0.0 107.941 179.08 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -50.3 -36.27 31.03 Favored 'General case' 0 N--CA 1.463 0.223 0 C-N-CA 123.957 0.903 . . . . 0.0 111.544 179.584 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 3.8 tt0 -47.19 -37.97 11.15 Favored 'General case' 0 N--CA 1.446 -0.633 0 C-N-CA 127.284 2.234 . . . . 0.0 113.126 -176.764 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 13.6 m -135.79 24.3 3.36 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 124.588 1.155 . . . . 0.0 109.76 176.422 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . 0.364 4.6 pt20 44.65 23.72 0.08 Allowed 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 129.052 2.941 . . . . 0.0 114.403 -175.36 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -92.43 172.18 8.56 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 126.507 1.923 . . . . 0.0 111.361 -171.186 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 4.9 m-85 -118.28 131.55 56.34 Favored 'General case' 0 N--CA 1.45 -0.428 0 N-CA-C 106.965 -1.495 . . . . 0.0 106.965 -177.77 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 48.9 mt -125.92 176.69 6.8 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 126.156 1.782 . . . . 0.0 107.859 -177.063 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 13.9 p90 -139.83 149.35 43.36 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 107.706 -1.22 . . . . 0.0 107.706 168.274 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 39.7 t-105 -78.13 127.19 31.92 Favored 'General case' 0 C--O 1.239 0.506 0 N-CA-C 107.46 -1.311 . . . . 0.0 107.46 172.277 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -120.81 86.88 2.65 Favored 'General case' 0 CA--C 1.512 -0.496 0 CA-C-O 121.631 0.729 . . . . 0.0 109.516 -179.634 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -58.71 -19.33 42.33 Favored Glycine 0 CA--C 1.526 0.778 0 CA-C-O 118.648 -1.085 . . . . 0.0 111.996 175.891 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -59.6 -34.75 73.14 Favored 'General case' 0 C--N 1.342 0.28 0 CA-C-N 118.989 1.395 . . . . 0.0 109.368 176.553 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 21.6 mtt180 -121.77 -1.55 9.44 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 127.232 2.213 . . . . 0.0 111.509 -171.997 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 60.1 mtt180 44.26 54.39 6.16 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 127.715 2.406 . . . . 0.0 111.489 -171.17 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 10.2 t -148.68 175.56 11.1 Favored 'General case' 0 C--N 1.328 -0.357 0 O-C-N 122.047 -0.408 . . . . 0.0 109.947 175.473 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 87.9 m-85 -98.96 134.78 41.32 Favored 'General case' 0 C--O 1.237 0.405 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 168.149 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -126.44 154.81 75.05 Favored Pre-proline 0 C--N 1.322 -0.627 0 C-N-CA 125.667 1.587 . . . . 0.0 109.359 176.841 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_endo -76.65 122.46 6.43 Favored 'Trans proline' 0 N--CA 1.46 -0.499 0 C-N-CA 123.099 2.533 . . . . 0.0 112.26 -174.276 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 0.335 0 C-N-CA 124.691 1.196 . . . . 0.0 112.999 -178.219 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 32.6 m-85 . . . . . 0 CA--C 1.532 0.282 0 N-CA-C 109.979 -0.378 . . . . 0.0 109.979 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 95.5 Cg_endo -67.91 177.7 4.06 Favored 'Trans proline' 0 N--CA 1.454 -0.834 0 C-N-CA 121.782 1.654 . . . . 0.0 109.023 161.282 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 45.7 t -104.71 86.27 1.4 Allowed Pre-proline 0 CA--C 1.537 0.46 0 C-N-CA 124.27 1.028 . . . . 0.0 109.162 -173.093 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_endo -69.62 153.69 69.25 Favored 'Trans proline' 0 N--CA 1.456 -0.694 0 C-N-CA 122.015 1.81 . . . . 0.0 110.386 -178.302 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -136.3 133.17 36.63 Favored 'General case' 0 C--O 1.235 0.305 0 C-N-CA 123.193 0.597 . . . . 0.0 111.808 -176.231 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.401 ' HA ' ' CD2' ' A' ' 18' ' ' TYR . 10.8 p -56.62 -25.95 22.33 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.407 0 C-N-CA 125.382 1.473 . . . . 0.0 113.544 -178.968 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 2.0 t -61.8 -12.3 16.52 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.999 0.919 . . . . 0.0 112.039 174.576 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 37.0 p -113.41 1.06 14.96 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.633 1.173 . . . . 0.0 111.723 -179.648 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' TYR . . . . . 0.401 ' CD2' ' HA ' ' A' ' 15' ' ' VAL . 15.3 m-30 -79.77 166.56 21.62 Favored 'General case' 0 C--O 1.238 0.499 0 O-C-N 120.858 -1.151 . . . . 0.0 110.159 179.984 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 28.0 mt-30 -105.31 112.55 25.7 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 124.728 1.211 . . . . 0.0 108.573 175.356 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 61.5 t80 -61.34 137.66 58.24 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 108.558 -0.904 . . . . 0.0 108.558 169.86 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 22.2 t0 -117.74 70.44 0.79 Allowed 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 125.932 1.693 . . . . 0.0 109.436 -172.389 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.55 -3.79 1.63 Allowed 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 115.527 1.677 . . . . 0.0 115.527 -169.224 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 1.3 t -65.94 -27.17 67.97 Favored 'General case' 0 C--N 1.315 -0.897 0 C-N-CA 126.659 1.984 . . . . 0.0 111.795 164.979 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 25.0 p -127.78 -25.83 3.04 Favored 'General case' 0 C--O 1.237 0.419 0 CA-C-N 120.169 1.35 . . . . 0.0 112.464 174.914 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 96.64 9.5 56.39 Favored Glycine 0 CA--C 1.533 1.201 0 CA-C-N 118.737 0.698 . . . . 0.0 112.39 177.206 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 8.3 m-85 -100.58 177.29 5.05 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.774 1.63 . . . . 0.0 109.1 178.119 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 77.9 m-85 -101.59 139.55 37.1 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 106.997 -1.483 . . . . 0.0 106.997 166.698 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 17.4 t80 -101.97 135.62 43.21 Favored 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 125.827 1.651 . . . . 0.0 107.099 172.956 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -110.55 85.08 4.42 Favored Pre-proline 0 N--CA 1.442 -0.863 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 -171.004 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_endo -61.36 -13.5 29.25 Favored 'Trans proline' 0 C--N 1.348 0.511 0 C-N-CA 122.388 2.059 . . . . 0.0 113.362 -179.919 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 98.6 mm-40 -60.64 -28.96 68.95 Favored 'General case' 0 N--CA 1.448 -0.567 0 C-N-CA 124.877 1.271 . . . . 0.0 111.423 178.697 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 12.6 p -145.96 -18.17 0.45 Allowed 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 113.664 0.987 . . . . 0.0 113.664 -176.745 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 99.53 7.57 53.71 Favored Glycine 0 CA--C 1.531 1.059 0 CA-C-N 119.446 1.021 . . . . 0.0 114.065 179.23 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 40.0 mt -85.69 179.51 7.07 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 124.847 1.259 . . . . 0.0 109.612 175.249 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 25.0 m-85 -118.91 159.79 23.14 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 124.329 1.052 . . . . 0.0 109.35 162.815 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 71.1 t80 -127.19 165.68 19.15 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 128.402 2.681 . . . . 0.0 109.128 173.993 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 6.1 t0 -137.77 144.1 42.97 Favored Pre-proline 0 N--CA 1.465 0.283 0 O-C-N 120.735 -1.228 . . . . 0.0 108.294 177.829 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 68.9 Cg_endo -71.62 -30.49 14.69 Favored 'Trans proline' 0 N--CA 1.454 -0.808 0 C-N-CA 121.354 1.37 . . . . 0.0 113.422 -175.281 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 77.2 m-20 -87.77 -28.53 21.65 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 125.139 1.375 . . . . 0.0 110.483 175.411 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 1.6 m -117.76 95.47 4.94 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 123.775 0.83 . . . . 0.0 109.572 -176.084 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 20.4 mp0 -62.18 -2.79 1.05 Allowed 'General case' 0 CA--C 1.547 0.843 0 O-C-N 121.387 -0.821 . . . . 0.0 111.758 166.676 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 17.8 m-85 -70.57 98.87 1.55 Allowed 'General case' 0 N--CA 1.444 -0.736 0 C-N-CA 125.39 1.476 . . . . 0.0 107.538 162.736 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 34.3 m-85 -59.27 153.85 17.73 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 125.204 1.402 . . . . 0.0 110.072 175.418 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 76.8 t80 -110.19 113.45 26.14 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 125.011 1.324 . . . . 0.0 108.514 177.826 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 38.7 t30 -87.45 81.58 7.77 Favored 'General case' 0 N--CA 1.445 -0.695 0 C-N-CA 125.22 1.408 . . . . 0.0 108.888 177.553 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -44.9 -38.46 4.66 Favored 'General case' 0 C--N 1.341 0.202 0 C-N-CA 124.273 1.029 . . . . 0.0 111.723 176.07 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 4.4 tt0 -44.41 -38.85 4.29 Favored 'General case' 0 N--CA 1.446 -0.626 0 C-N-CA 127.843 2.457 . . . . 0.0 113.054 -177.376 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 70.8 m -136.61 16.17 3.13 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 124.305 1.042 . . . . 0.0 111.726 176.852 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 25.7 mt-30 58.77 14.89 3.44 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 126.855 2.062 . . . . 0.0 113.494 -173.297 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 41.2 mm-40 -77.31 167.06 22.34 Favored 'General case' 0 C--N 1.334 -0.07 0 O-C-N 121.139 -0.976 . . . . 0.0 111.459 -177.209 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 37.0 m-85 -114.27 132.8 56.02 Favored 'General case' 0 C--O 1.236 0.347 0 C-N-CA 124.145 0.978 . . . . 0.0 109.97 172.141 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 66.6 mt -129.81 179.91 5.57 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 126.55 1.94 . . . . 0.0 108.801 -173.609 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 23.6 p90 -144.64 157.98 43.97 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 124.012 0.925 . . . . 0.0 109.685 165.425 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 54.5 t-105 -89.18 125.49 35.08 Favored 'General case' 0 C--O 1.237 0.434 0 N-CA-C 107.121 -1.437 . . . . 0.0 107.121 170.276 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -120.99 108.69 14.18 Favored 'General case' 0 CA--C 1.516 -0.328 0 CA-C-O 121.304 0.573 . . . . 0.0 110.578 177.557 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -72.6 -1.75 53.84 Favored Glycine 0 CA--C 1.526 0.723 0 CA-C-O 117.99 -1.45 . . . . 0.0 114.294 -172.792 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 2.9 pt-20 -76.23 -54.49 6.72 Favored 'General case' 0 C--N 1.339 0.138 0 CA-C-N 120.072 1.936 . . . . 0.0 110.255 171.511 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 13.0 mtt180 -88.42 -8.11 55.51 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 124.17 0.988 . . . . 0.0 110.567 -177.856 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 3.3 mpt_? 44.88 59.46 3.41 Favored 'General case' 0 C--N 1.342 0.263 0 C-N-CA 125.988 1.715 . . . . 0.0 109.321 -174.326 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 8.4 t -148.88 179.49 7.81 Favored 'General case' 0 C--O 1.238 0.457 0 N-CA-C 108.766 -0.828 . . . . 0.0 108.766 175.917 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 72.0 m-85 -104.32 132.29 50.74 Favored 'General case' 0 C--O 1.241 0.641 0 C-N-CA 123.878 0.871 . . . . 0.0 109.656 172.853 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -127.57 154.96 77.62 Favored Pre-proline 0 C--N 1.326 -0.421 0 C-N-CA 126.638 1.975 . . . . 0.0 110.631 -178.671 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_endo -70.12 131.18 20.2 Favored 'Trans proline' 0 CA--C 1.534 0.5 0 C-N-CA 123.321 2.681 . . . . 0.0 111.732 174.483 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 0.281 0 C-N-CA 124.729 1.211 . . . . 0.0 108.981 178.693 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 18.4 m-85 . . . . . 0 CA--C 1.543 0.68 0 CA-C-O 119.124 -0.465 . . . . 0.0 110.161 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 79.0 Cg_endo -73.53 -174.31 1.61 Allowed 'Trans proline' 0 CA--C 1.539 0.726 0 C-N-CA 123.989 3.126 . . . . 0.0 111.619 176.396 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 21.2 t -106.93 86.54 2.43 Favored Pre-proline 0 CA--C 1.532 0.276 0 C-N-CA 125.56 1.544 . . . . 0.0 108.452 176.589 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 91.7 Cg_endo -66.66 159.06 52.81 Favored 'Trans proline' 0 N--CA 1.457 -0.67 0 C-N-CA 122.161 1.907 . . . . 0.0 109.335 173.754 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.2 t0 -131.02 134.3 46.56 Favored 'General case' 0 C--O 1.234 0.249 0 N-CA-C 108.333 -0.988 . . . . 0.0 108.333 171.133 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.497 ' HA ' ' CD2' ' A' ' 18' ' ' TYR . 2.9 p -57.02 -25.18 22.0 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.472 0 C-N-CA 123.999 0.92 . . . . 0.0 111.864 178.002 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 56.6 m -59.08 -20.04 49.74 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 119.305 0.957 . . . . 0.0 113.51 173.222 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 12.2 p -119.07 16.33 13.28 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 119.805 1.184 . . . . 0.0 111.914 -176.761 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' TYR . . . . . 0.497 ' CD2' ' HA ' ' A' ' 15' ' ' VAL . 20.2 m-30 -71.89 159.57 34.05 Favored 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 160.614 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 26.4 mt-30 -111.12 114.6 27.98 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 125.787 1.635 . . . . 0.0 111.788 177.479 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 49.5 t80 -67.08 156.76 35.27 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 120.618 1.554 . . . . 0.0 113.341 -177.654 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -129.47 102.98 6.63 Favored 'General case' 0 C--N 1.342 0.273 0 N-CA-C 107.561 -1.274 . . . . 0.0 107.561 166.075 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -52.75 -29.89 29.72 Favored 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 124.795 1.238 . . . . 0.0 112.063 171.368 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 1.4 t -67.1 -20.73 65.83 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-O 117.899 -1.048 . . . . 0.0 111.987 -174.461 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 72.9 m -136.0 -9.79 2.04 Favored 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 113.795 1.035 . . . . 0.0 113.795 177.505 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 81.54 6.3 89.27 Favored Glycine 0 CA--C 1.526 0.721 0 C-N-CA 124.469 1.033 . . . . 0.0 114.007 169.243 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 5.3 m-85 -97.97 169.26 9.76 Favored 'General case' 0 C--O 1.238 0.485 0 CA-C-N 118.328 1.064 . . . . 0.0 108.746 174.819 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 56.5 m-85 -104.04 140.26 38.0 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 125.799 1.639 . . . . 0.0 108.33 175.379 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 41.6 t80 -107.58 142.42 37.53 Favored 'General case' 0 CA--C 1.512 -0.497 0 N-CA-C 107.386 -1.339 . . . . 0.0 107.386 179.666 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 11.8 m-20 -117.4 78.02 10.64 Favored Pre-proline 0 N--CA 1.441 -0.913 0 N-CA-C 107.71 -1.219 . . . . 0.0 107.71 -160.753 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 22.3 Cg_endo -64.57 -4.69 8.74 Favored 'Trans proline' 0 C--N 1.348 0.513 0 C-N-CA 124.044 3.163 . . . . 0.0 113.989 -173.706 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 99.6 mm-40 -71.89 -24.37 61.64 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-O 118.823 -0.608 . . . . 0.0 111.008 172.421 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 1.1 p -143.57 -15.9 0.64 Allowed 'General case' 0 CA--C 1.532 0.274 0 N-CA-C 114.747 1.388 . . . . 0.0 114.747 -176.061 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 89.69 12.25 62.76 Favored Glycine 0 CA--C 1.531 1.043 0 CA-C-N 119.848 1.204 . . . . 0.0 113.563 -176.198 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 55.0 mt -88.83 178.83 6.34 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.574 1.149 . . . . 0.0 109.256 178.253 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 39.3 m-85 -124.19 149.74 46.0 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 123.577 0.751 . . . . 0.0 109.164 163.583 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 41.0 t80 -118.39 150.26 39.85 Favored 'General case' 0 C--O 1.24 0.56 0 C-N-CA 126.822 2.049 . . . . 0.0 109.628 178.0 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -116.85 143.54 31.69 Favored Pre-proline 0 CA--C 1.537 0.477 0 C-N-CA 123.444 0.698 . . . . 0.0 109.516 171.784 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_endo -81.51 -22.43 5.61 Favored 'Trans proline' 0 N--CA 1.458 -0.617 0 C-N-CA 122.509 2.139 . . . . 0.0 114.922 -174.098 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 56.5 m-80 -77.38 -40.66 42.99 Favored 'General case' 0 N--CA 1.445 -0.681 0 O-C-N 120.915 -1.116 . . . . 0.0 108.675 164.406 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 38.5 m -124.54 95.61 4.59 Favored 'General case' 0 N--CA 1.452 -0.375 0 CA-C-O 122.028 0.918 . . . . 0.0 110.536 -156.965 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 20.2 mp0 -62.55 3.62 0.2 Allowed 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 125.758 1.623 . . . . 0.0 113.871 -174.388 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 19.0 m-85 -79.41 98.63 6.84 Favored 'General case' 0 N--CA 1.438 -1.034 0 C-N-CA 125.333 1.453 . . . . 0.0 108.17 -179.604 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 48.6 m-85 -59.17 120.25 8.84 Favored 'General case' 0 N--CA 1.445 -0.7 0 C-N-CA 125.706 1.603 . . . . 0.0 109.014 177.949 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 79.5 t80 -78.65 138.52 38.35 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 124.242 1.017 . . . . 0.0 108.385 176.77 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 12.0 t-20 -116.65 85.79 2.38 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 127.033 2.133 . . . . 0.0 107.256 175.025 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -45.41 -40.26 7.93 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 127.65 2.38 . . . . 0.0 111.736 178.004 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 6.5 tt0 -44.63 -41.74 6.88 Favored 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 127.397 2.279 . . . . 0.0 112.704 179.823 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 4.0 m -129.87 14.21 5.82 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 125.495 1.518 . . . . 0.0 109.774 -176.723 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . 0.411 4.5 pt20 44.38 30.64 0.49 Allowed 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 128.732 2.813 . . . . 0.0 113.989 -172.745 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -90.77 162.83 14.69 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 127.402 2.281 . . . . 0.0 110.633 -169.435 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 3.4 m-85 -110.44 131.8 54.74 Favored 'General case' 0 C--O 1.233 0.234 0 C-N-CA 124.558 1.143 . . . . 0.0 108.991 174.019 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 60.7 mt -128.67 178.08 6.58 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 126.91 2.084 . . . . 0.0 108.218 -178.129 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 9.6 p90 -138.03 148.38 45.05 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 106.807 -1.553 . . . . 0.0 106.807 166.922 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 43.8 t-105 -71.96 136.92 46.97 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 105.42 -2.067 . . . . 0.0 105.42 162.412 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -131.07 95.85 3.9 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 178.403 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -71.25 -5.5 59.26 Favored Glycine 0 CA--C 1.528 0.851 0 CA-C-O 118.722 -1.043 . . . . 0.0 112.538 -178.373 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -71.9 -58.77 3.17 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 119.496 1.648 . . . . 0.0 107.096 173.182 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 75.6 mtt-85 -80.36 -18.54 48.74 Favored 'General case' 0 C--O 1.232 0.173 0 C-N-CA 125.381 1.472 . . . . 0.0 112.636 -179.804 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 97.6 mtt180 55.93 58.84 4.12 Favored 'General case' 0 C--O 1.234 0.239 0 C-N-CA 127.094 2.157 . . . . 0.0 109.457 -173.912 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 6.2 t -155.22 -177.69 6.72 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 125.195 1.398 . . . . 0.0 108.55 175.045 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 76.0 m-85 -112.61 129.9 56.22 Favored 'General case' 0 C--O 1.238 0.477 0 C-N-CA 124.321 1.048 . . . . 0.0 108.791 172.462 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -126.29 154.74 74.66 Favored Pre-proline 0 C--N 1.326 -0.441 0 C-N-CA 126.4 1.88 . . . . 0.0 110.499 -171.53 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_endo -75.28 124.84 8.74 Favored 'Trans proline' 0 C--N 1.348 0.506 0 C-N-CA 122.927 2.418 . . . . 0.0 111.204 -178.299 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.411 0 N-CA-C 115.896 1.813 . . . . 0.0 115.896 -167.18 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 33.7 m-85 . . . . . 0 CA--C 1.538 0.509 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_endo -65.68 -171.4 0.21 Allowed 'Trans proline' 0 CA--C 1.537 0.646 0 C-N-CA 122.695 2.263 . . . . 0.0 110.339 164.031 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 61.7 t -104.92 87.29 1.79 Allowed Pre-proline 0 C--N 1.329 -0.304 0 N-CA-C 106.646 -1.612 . . . . 0.0 106.646 171.961 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.408 ' HD2' ' CZ2' ' A' ' 54' ' ' TRP . 96.8 Cg_endo -64.15 156.23 60.41 Favored 'Trans proline' 0 N--CA 1.451 -1.005 0 C-N-CA 122.226 1.951 . . . . 0.0 110.05 -177.547 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -135.12 129.29 33.67 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 123.898 0.879 . . . . 0.0 109.064 177.926 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 9.1 p -63.94 -26.44 40.56 Favored 'Isoleucine or valine' 0 C--O 1.234 0.266 0 C-N-CA 124.586 1.154 . . . . 0.0 111.531 178.758 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 41.5 m -69.6 1.77 3.82 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 119.908 1.231 . . . . 0.0 112.726 -178.103 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 7.0 t -125.9 11.0 7.7 Favored 'General case' 0 CA--C 1.545 0.777 0 O-C-N 120.899 -1.125 . . . . 0.0 111.773 169.757 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 15.0 m-30 -70.02 159.48 33.73 Favored 'General case' 0 C--O 1.24 0.581 0 O-C-N 120.525 -1.359 . . . . 0.0 111.694 172.346 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 54.6 mt-30 -82.59 135.07 35.16 Favored 'General case' 0 C--O 1.225 -0.234 0 N-CA-C 107.1 -1.444 . . . . 0.0 107.1 167.292 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 45.7 t80 -75.81 164.57 26.1 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 118.796 0.726 . . . . 0.0 109.145 160.246 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -143.04 108.82 5.13 Favored 'General case' 0 CA--C 1.51 -0.596 0 N-CA-C 108.868 -0.79 . . . . 0.0 108.868 159.696 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -59.72 -19.81 52.4 Favored 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 113.154 0.798 . . . . 0.0 113.154 174.628 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 1.4 t -55.29 -35.61 65.25 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 123.59 0.756 . . . . 0.0 110.694 -179.964 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 15.8 m -114.21 -28.06 7.42 Favored 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 125.147 1.379 . . . . 0.0 110.663 173.993 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 87.19 25.09 34.89 Favored Glycine 0 CA--C 1.528 0.898 0 N-CA-C 110.318 -1.113 . . . . 0.0 110.318 -173.432 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 6.7 m-85 -117.97 175.25 5.76 Favored 'General case' 0 C--O 1.232 0.176 0 C-N-CA 126.103 1.761 . . . . 0.0 107.776 -170.807 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -110.4 151.19 27.78 Favored 'General case' 0 CA--C 1.521 -0.157 0 N-CA-C 109.084 -0.71 . . . . 0.0 109.084 172.77 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 44.7 t80 -118.81 137.84 53.11 Favored 'General case' 0 N--CA 1.446 -0.633 0 C-N-CA 127.612 2.365 . . . . 0.0 107.79 179.761 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 37.3 t0 -106.95 86.22 2.29 Favored Pre-proline 0 C--N 1.33 -0.268 0 C-N-CA 126.129 1.772 . . . . 0.0 111.28 -175.612 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 22.9 Cg_endo -60.81 -14.25 31.13 Favored 'Trans proline' 0 CA--C 1.537 0.664 0 C-N-CA 121.903 1.735 . . . . 0.0 113.798 177.918 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 4.7 tt0 -67.81 -16.33 64.06 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 119.399 0.999 . . . . 0.0 111.276 176.731 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 40.1 p -131.48 -63.12 0.85 Allowed 'General case' 0 N--CA 1.447 -0.612 0 C-N-CA 125.271 1.428 . . . . 0.0 107.896 177.351 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 124.5 12.61 4.12 Favored Glycine 0 CA--C 1.531 1.05 0 C-N-CA 127.041 2.258 . . . . 0.0 112.025 -167.65 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 32.0 mt -87.22 175.59 7.97 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 126.119 1.768 . . . . 0.0 109.85 176.964 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 42.7 m-85 -117.42 167.41 11.29 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 125.097 1.359 . . . . 0.0 109.617 166.775 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 31.3 t80 -144.66 156.27 44.02 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 128.158 2.583 . . . . 0.0 108.345 -179.565 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 42.6 t0 -126.17 142.33 42.34 Favored Pre-proline 0 N--CA 1.473 0.722 0 N-CA-C 107.716 -1.216 . . . . 0.0 107.716 175.287 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 41.5 Cg_endo -73.15 -38.9 2.45 Favored 'Trans proline' 0 C--N 1.345 0.391 0 CA-C-N 120.952 1.376 . . . . 0.0 112.826 -176.15 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 30.5 m-20 -75.69 -25.66 56.91 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-O 118.533 -0.746 . . . . 0.0 111.383 -178.416 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 67.2 m -131.73 94.38 3.5 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 125.809 1.643 . . . . 0.0 109.434 -174.715 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 12.1 mp0 -59.43 -3.12 0.39 Allowed 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.974 1.31 . . . . 0.0 114.163 -178.119 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 68.4 m-85 -61.25 111.07 1.59 Allowed 'General case' 0 N--CA 1.446 -0.632 0 CA-C-N 119.189 0.904 . . . . 0.0 108.887 171.934 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 30.4 m-85 -62.1 153.63 29.38 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 123.519 0.727 . . . . 0.0 109.45 174.744 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 68.8 t80 -119.69 117.55 28.56 Favored 'General case' 0 N--CA 1.443 -0.811 0 CA-C-O 122.476 1.131 . . . . 0.0 108.802 -179.325 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 21.2 t30 -95.95 89.7 5.32 Favored 'General case' 0 N--CA 1.442 -0.863 0 C-N-CA 125.715 1.606 . . . . 0.0 107.354 175.252 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -48.1 -42.24 28.4 Favored 'General case' 0 CA--C 1.529 0.157 0 C-N-CA 124.838 1.255 . . . . 0.0 112.169 174.819 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -44.49 -48.64 10.11 Favored 'General case' 0 N--CA 1.448 -0.572 0 C-N-CA 126.213 1.805 . . . . 0.0 112.232 -175.621 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -118.43 12.78 13.39 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 125.207 1.403 . . . . 0.0 110.507 -177.052 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 18.5 mt-30 44.24 45.72 7.23 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 128.646 2.778 . . . . 0.0 112.755 -175.925 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -117.24 143.65 45.66 Favored 'General case' 0 N--CA 1.448 -0.557 0 C-N-CA 125.483 1.513 . . . . 0.0 110.233 -171.504 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.647 ' C ' HD23 ' A' ' 52' ' ' LEU . 58.3 m-85 -101.73 132.29 47.53 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 123.441 0.696 . . . . 0.0 111.704 176.432 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.647 HD23 ' C ' ' A' ' 51' ' ' TYR . 1.1 mt -135.87 -177.89 4.89 Favored 'General case' 0 C--N 1.323 -0.555 0 C-N-CA 126.779 2.031 . . . . 0.0 108.739 -165.414 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 53' ' ' TYR . . . . . 0.474 ' CE2' HG23 ' A' ' 62' ' ' VAL . 25.7 p90 -135.02 164.76 26.91 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 124.179 0.992 . . . . 0.0 109.219 173.182 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 54' ' ' TRP . . . . . 0.408 ' CZ2' ' HD2' ' A' ' 13' ' ' PRO . 21.4 t-105 -109.23 137.82 46.53 Favored 'General case' 0 CA--C 1.504 -0.794 0 C-N-CA 125.955 1.702 . . . . 0.0 108.501 172.982 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 22.7 p-10 -133.56 77.29 1.71 Allowed 'General case' 0 N--CA 1.42 -1.958 0 C-N-CA 126.822 2.049 . . . . 0.0 107.208 -171.163 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -61.03 1.09 0.91 Allowed Glycine 0 CA--C 1.53 1.018 0 C-N-CA 125.025 1.298 . . . . 0.0 114.538 179.288 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 14.9 mt-10 -69.72 -63.32 1.1 Allowed 'General case' 0 N--CA 1.444 -0.754 0 N-CA-C 106.552 -1.647 . . . . 0.0 106.552 171.789 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 82.4 mtt180 -72.91 -23.15 60.67 Favored 'General case' 0 C--O 1.226 -0.146 0 C-N-CA 127.157 2.183 . . . . 0.0 111.323 173.929 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 52.9 mtt85 56.24 69.83 0.7 Allowed 'General case' 0 C--O 1.232 0.151 0 C-N-CA 126.295 1.838 . . . . 0.0 109.456 -162.861 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 6.8 t -144.24 -175.11 4.49 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 118.385 0.539 . . . . 0.0 110.194 170.165 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 91.3 m-85 -120.54 129.1 53.66 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 107.101 -1.444 . . . . 0.0 107.101 164.351 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.474 HG23 ' CE2' ' A' ' 53' ' ' TYR . 0.0 OUTLIER -126.22 154.92 74.49 Favored Pre-proline 0 C--N 1.325 -0.458 0 C-N-CA 125.95 1.7 . . . . 0.0 113.068 -175.763 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 63' ' ' PRO . . . . . 0.585 ' HA ' HD22 ' A' ' 52' ' ' LEU . 71.5 Cg_endo -80.42 132.15 8.91 Favored 'Trans proline' 0 N--CA 1.443 -1.467 0 C-N-CA 121.355 1.37 . . . . 0.0 112.36 -171.907 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.571 0 C-N-CA 123.832 0.853 . . . . 0.0 113.118 -172.704 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 61.2 m-85 . . . . . 0 C--O 1.241 0.637 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 68.2 Cg_endo -67.67 -175.33 0.71 Allowed 'Trans proline' 0 CA--C 1.538 0.687 0 C-N-CA 123.661 2.908 . . . . 0.0 109.874 161.134 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 18.6 t -116.55 86.09 17.8 Favored Pre-proline 0 CA--C 1.541 0.607 0 C-N-CA 125.222 1.409 . . . . 0.0 107.813 -173.994 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo -73.17 174.87 11.34 Favored 'Trans proline' 0 C--N 1.347 0.456 0 C-N-CA 124.72 3.613 . . . . 0.0 111.667 -177.723 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -142.79 131.95 23.22 Favored 'General case' 0 N--CA 1.445 -0.692 0 C-N-CA 125.935 1.694 . . . . 0.0 110.881 -175.194 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 7.1 p -63.81 -26.39 40.5 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.423 0 O-C-N 121.061 -1.025 . . . . 0.0 112.558 179.549 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 93.1 p -71.64 0.67 8.14 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 120.06 1.3 . . . . 0.0 113.568 178.846 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 32.1 p -111.32 1.79 17.29 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.475 1.11 . . . . 0.0 112.02 172.076 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 11.0 m-30 -69.46 172.46 7.19 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.647 1.179 . . . . 0.0 111.88 -178.808 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 2.8 mm100 -116.11 101.88 9.12 Favored 'General case' 0 N--CA 1.478 0.926 0 N-CA-C 114.663 1.357 . . . . 0.0 114.663 179.03 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 55.1 t80 -63.68 147.84 50.57 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 118.426 0.557 . . . . 0.0 111.621 -175.637 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 8.4 t0 -124.82 84.42 2.28 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 123.289 0.636 . . . . 0.0 109.769 176.809 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.75 -19.48 50.49 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 115.152 1.538 . . . . 0.0 115.152 -172.351 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 5.9 t -49.16 -46.93 46.0 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-O 118.346 -0.835 . . . . 0.0 110.313 166.264 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 64.8 m -130.07 -8.16 4.36 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 114.203 1.186 . . . . 0.0 114.203 -171.625 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 96.87 14.57 42.56 Favored Glycine 0 CA--C 1.526 0.771 0 CA-C-N 119.081 0.855 . . . . 0.0 114.221 155.707 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 16.9 m-85 -110.49 171.69 7.31 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 118.287 1.044 . . . . 0.0 109.027 -176.967 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 35.0 m-85 -113.03 121.81 45.72 Favored 'General case' 0 CA--C 1.529 0.142 0 C-N-CA 124.644 1.177 . . . . 0.0 108.624 -175.353 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 71.9 t80 -91.26 138.45 31.58 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 124.475 1.11 . . . . 0.0 110.694 -177.467 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 32.3 t0 -98.78 86.81 0.53 Allowed Pre-proline 0 N--CA 1.472 0.645 0 C-N-CA 126.233 1.813 . . . . 0.0 111.992 179.497 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_endo -60.9 -11.84 19.74 Favored 'Trans proline' 0 N--CA 1.459 -0.541 0 C-N-CA 122.415 2.077 . . . . 0.0 114.196 178.218 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -63.86 -29.52 70.7 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 119.743 1.156 . . . . 0.0 110.0 173.928 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 38.4 p -133.98 -42.42 0.82 Allowed 'General case' 0 C--O 1.235 0.301 0 CA-C-N 118.867 0.758 . . . . 0.0 112.833 -174.102 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 113.78 19.35 6.52 Favored Glycine 0 CA--C 1.534 1.228 0 C-N-CA 125.605 1.574 . . . . 0.0 112.322 -179.533 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 22.5 mt -93.11 176.21 6.5 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 126.466 1.906 . . . . 0.0 109.306 178.989 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 55.6 m-85 -121.96 165.36 16.09 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 124.678 1.191 . . . . 0.0 110.603 172.936 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 77.0 t80 -147.93 160.06 43.2 Favored 'General case' 0 C--O 1.239 0.534 0 C-N-CA 129.112 2.965 . . . . 0.0 108.475 -175.897 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.4 ' HB3' ' HB2' ' A' ' 40' ' ' SER . 8.8 t0 -129.35 143.74 50.07 Favored Pre-proline 0 CA--C 1.537 0.469 0 N-CA-C 107.358 -1.349 . . . . 0.0 107.358 178.712 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_endo -63.72 -42.68 19.35 Favored 'Trans proline' 0 CA--C 1.537 0.633 0 C-N-CA 122.457 2.105 . . . . 0.0 113.262 -179.842 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 88.4 m-20 -75.07 -43.06 55.35 Favored 'General case' 0 N--CA 1.446 -0.647 0 C-N-CA 124.565 1.146 . . . . 0.0 109.596 176.041 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' SER . . . . . 0.4 ' HB2' ' HB3' ' A' ' 37' ' ' ASP . 14.9 m -103.92 97.89 7.81 Favored 'General case' 0 N--CA 1.456 -0.132 0 C-N-CA 123.727 0.811 . . . . 0.0 109.11 -171.177 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 7.4 mp0 -58.83 -15.61 13.3 Favored 'General case' 0 CA--C 1.541 0.621 0 O-C-N 121.78 -0.575 . . . . 0.0 111.135 173.526 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 32.1 m-85 -61.5 105.44 0.52 Allowed 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 125.94 1.696 . . . . 0.0 109.7 170.163 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 27.1 m-85 -67.99 168.36 12.01 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 124.692 1.197 . . . . 0.0 110.52 175.078 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 75.7 t80 -123.48 121.22 35.13 Favored 'General case' 0 N--CA 1.446 -0.649 0 C-N-CA 125.422 1.489 . . . . 0.0 109.559 176.183 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 28.1 t30 -86.18 88.38 7.59 Favored 'General case' 0 N--CA 1.443 -0.784 0 C-N-CA 127.875 2.47 . . . . 0.0 108.744 173.147 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -52.09 -36.39 50.7 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.498 0.719 . . . . 0.0 111.825 175.524 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -48.01 -57.09 6.22 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 126.393 1.877 . . . . 0.0 112.172 -178.257 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -111.23 18.48 19.27 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 125.037 1.335 . . . . 0.0 111.603 179.317 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 3.0 mt-30 48.4 34.0 4.37 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 125.579 1.551 . . . . 0.0 112.606 -176.516 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -105.76 174.56 5.83 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 126.714 2.006 . . . . 0.0 110.975 -174.02 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 5.6 m-85 -114.44 146.47 40.59 Favored 'General case' 0 C--N 1.332 -0.153 0 N-CA-C 108.387 -0.968 . . . . 0.0 108.387 179.601 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.473 HD23 ' HA ' ' A' ' 63' ' ' PRO . 85.2 mt -137.82 174.76 10.24 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.966 1.306 . . . . 0.0 108.874 -175.503 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 8.7 p90 -139.46 142.96 37.35 Favored 'General case' 0 C--O 1.239 0.543 0 C-N-CA 125.687 1.595 . . . . 0.0 107.917 165.948 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 41.8 t-105 -85.12 100.86 12.0 Favored 'General case' 0 N--CA 1.449 -0.524 0 N-CA-C 105.543 -2.021 . . . . 0.0 105.543 176.907 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 51.4 t0 -88.53 87.08 7.15 Favored 'General case' 0 N--CA 1.447 -0.615 0 N-CA-C 107.61 -1.255 . . . . 0.0 107.61 -178.47 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -58.55 -17.3 32.89 Favored Glycine 0 CA--C 1.53 1.02 0 CA-C-O 118.299 -1.278 . . . . 0.0 112.345 177.599 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 17.6 mt-10 -69.7 -22.27 63.43 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 120.021 1.911 . . . . 0.0 111.282 174.47 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 8.8 mtt180 -120.16 -2.71 10.13 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 125.173 1.389 . . . . 0.0 111.359 -179.516 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 2.1 mpt_? 44.55 56.15 5.29 Favored 'General case' 0 C--O 1.234 0.252 0 C-N-CA 126.664 1.986 . . . . 0.0 110.278 -173.54 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 5.0 t -148.89 153.46 38.06 Favored 'General case' 0 N--CA 1.448 -0.53 0 N-CA-C 108.851 -0.796 . . . . 0.0 108.851 176.513 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 80.3 m-85 -93.08 115.74 28.39 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 106.186 -1.783 . . . . 0.0 106.186 175.641 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -125.26 154.92 71.99 Favored Pre-proline 0 C--N 1.326 -0.425 0 C-N-CA 125.667 1.587 . . . . 0.0 110.274 -171.462 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 63' ' ' PRO . . . . . 0.473 ' HA ' HD23 ' A' ' 52' ' ' LEU . 56.4 Cg_endo -68.32 130.32 20.96 Favored 'Trans proline' 0 N--CA 1.455 -0.782 0 C-N-CA 122.36 2.04 . . . . 0.0 110.464 -179.032 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.231 0 CA-C-O 121.993 0.901 . . . . 0.0 112.764 177.916 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 58.5 m-85 . . . . . 0 C--O 1.235 0.329 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -61.04 169.69 5.73 Favored 'Trans proline' 0 N--CA 1.453 -0.873 0 C-N-CA 121.823 1.682 . . . . 0.0 109.846 161.94 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 59.7 t -104.67 86.69 1.51 Allowed Pre-proline 0 C--O 1.241 0.615 0 N-CA-C 107.073 -1.454 . . . . 0.0 107.073 -173.028 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 69.0 Cg_endo -66.79 169.18 15.13 Favored 'Trans proline' 0 CA--C 1.534 0.48 0 C-N-CA 123.856 3.037 . . . . 0.0 111.525 -168.929 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -146.43 123.15 11.21 Favored 'General case' 0 C--O 1.232 0.164 0 O-C-N 121.535 -0.728 . . . . 0.0 111.057 -175.948 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 13.3 p -58.61 -20.84 17.24 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.671 0 C-N-CA 124.679 1.192 . . . . 0.0 112.695 -178.052 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 38.7 p -64.66 -13.7 55.13 Favored 'General case' 0 N--CA 1.434 -1.229 0 O-C-N 119.856 -1.777 . . . . 0.0 113.705 179.24 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 12.7 t -119.87 8.42 11.1 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 125.185 1.394 . . . . 0.0 110.75 176.669 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 12.9 m-30 -74.68 155.78 37.38 Favored 'General case' 0 C--O 1.238 0.467 0 O-C-N 120.977 -1.077 . . . . 0.0 110.524 170.68 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 25.5 mt-30 -93.47 150.79 20.17 Favored 'General case' 0 C--O 1.224 -0.26 0 CA-C-N 114.915 -1.039 . . . . 0.0 109.79 171.457 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.423 ' CZ ' ' HA2' ' A' ' 25' ' ' GLY . 70.2 t80 -96.46 152.81 18.26 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 124.567 1.147 . . . . 0.0 109.975 167.469 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -132.66 97.28 4.02 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 124.134 0.974 . . . . 0.0 109.415 173.872 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.418 ' HG2' ' H ' ' A' ' 22' ' ' GLU . 1.3 pt-20 -62.22 -20.2 63.95 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 125.307 1.443 . . . . 0.0 113.861 -172.403 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 15.1 t -56.74 -24.8 52.39 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 123.495 0.718 . . . . 0.0 111.617 171.38 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 66.2 m -133.14 -19.92 2.19 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.834 1.254 . . . . 0.0 112.775 179.522 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' GLY . . . . . 0.423 ' HA2' ' CZ ' ' A' ' 20' ' ' TYR . . . 62.77 25.37 67.49 Favored Glycine 0 CA--C 1.531 1.073 0 O-C-N 121.016 -1.052 . . . . 0.0 112.682 -175.516 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 17.8 m-85 -87.98 170.57 11.01 Favored 'General case' 0 C--O 1.238 0.482 0 N-CA-C 107.419 -1.326 . . . . 0.0 107.419 160.966 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 76.9 m-85 -107.04 152.45 23.99 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 124.316 1.046 . . . . 0.0 108.741 166.782 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 46.6 t80 -111.21 137.63 48.67 Favored 'General case' 0 N--CA 1.447 -0.623 0 C-N-CA 126.933 2.093 . . . . 0.0 108.315 179.162 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 6.2 t0 -96.02 86.7 0.37 Allowed Pre-proline 0 CA--C 1.532 0.267 0 C-N-CA 128.609 2.763 . . . . 0.0 107.048 177.335 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -66.91 -10.27 27.8 Favored 'Trans proline' 0 C--N 1.347 0.485 0 C-N-CA 122.424 2.083 . . . . 0.0 111.983 175.982 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 10.0 tt0 -70.1 -18.54 63.25 Favored 'General case' 0 N--CA 1.447 -0.599 0 C-N-CA 124.578 1.151 . . . . 0.0 110.523 -179.151 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 37.0 p -145.57 -53.29 0.27 Allowed 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 126.165 1.786 . . . . 0.0 111.106 178.438 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 135.1 12.23 1.3 Allowed Glycine 0 CA--C 1.531 1.08 0 C-N-CA 126.329 1.919 . . . . 0.0 113.851 178.727 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 10.7 mt -81.1 177.19 9.2 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 118.92 1.36 . . . . 0.0 110.339 178.332 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 59.5 m-85 -121.95 167.52 12.97 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.275 1.03 . . . . 0.0 110.196 168.915 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 33.9 t80 -149.65 139.73 22.08 Favored 'General case' 0 C--O 1.235 0.317 0 C-N-CA 127.518 2.327 . . . . 0.0 107.835 -172.63 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -99.29 143.25 26.06 Favored Pre-proline 0 CA--C 1.538 0.506 0 N-CA-C 106.951 -1.5 . . . . 0.0 106.951 -178.389 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -66.48 -38.43 19.6 Favored 'Trans proline' 0 C--O 1.236 0.417 0 C-N-CA 121.423 1.415 . . . . 0.0 113.735 -178.841 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 11.2 m-80 -99.78 -14.26 18.91 Favored 'General case' 0 CA--C 1.518 -0.264 0 N-CA-C 113.31 0.855 . . . . 0.0 113.31 -172.414 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 24.2 m -127.93 103.33 7.19 Favored 'General case' 0 C--N 1.32 -0.689 0 C-N-CA 125.954 1.702 . . . . 0.0 107.659 178.161 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -65.62 -1.51 2.75 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 123.56 0.744 . . . . 0.0 112.344 -176.832 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 42.1 m-85 -60.98 120.75 10.82 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 119.414 1.007 . . . . 0.0 108.435 164.769 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 32.5 m-85 -74.1 164.36 26.71 Favored 'General case' 0 N--CA 1.442 -0.838 0 C-N-CA 124.482 1.113 . . . . 0.0 109.355 173.611 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 94.4 t80 -119.44 139.52 51.91 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 125.474 1.509 . . . . 0.0 108.674 173.027 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 18.7 t30 -121.17 79.97 1.59 Allowed 'General case' 0 N--CA 1.444 -0.745 0 C-N-CA 128.169 2.588 . . . . 0.0 106.179 -171.986 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -52.15 -33.07 38.63 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 123.629 0.772 . . . . 0.0 111.621 179.97 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -46.19 -38.04 7.83 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 127.369 2.268 . . . . 0.0 113.012 177.097 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.3 m -129.05 13.12 6.22 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 125.141 1.376 . . . . 0.0 110.488 179.127 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 52.4 mt-30 44.02 35.25 1.11 Allowed 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 128.859 2.864 . . . . 0.0 113.7 -169.003 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -108.08 -179.83 4.01 Favored 'General case' 0 N--CA 1.448 -0.54 0 C-N-CA 124.839 1.256 . . . . 0.0 112.145 -176.227 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 55.4 m-85 -123.28 139.7 53.78 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 124.723 1.209 . . . . 0.0 109.221 -178.08 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.412 HD23 ' HA ' ' A' ' 63' ' ' PRO . 64.9 mt -130.97 167.25 19.34 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.865 1.266 . . . . 0.0 107.838 -174.28 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 13.6 p90 -126.05 149.85 48.56 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 107.437 -1.319 . . . . 0.0 107.437 165.835 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 62.9 t-105 -88.03 152.92 21.68 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 106.212 -1.774 . . . . 0.0 106.212 166.805 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 49.0 t0 -145.58 155.25 42.93 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 107.595 -1.261 . . . . 0.0 107.595 166.553 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -100.84 -7.93 49.51 Favored Glycine 0 CA--C 1.526 0.758 0 CA-C-O 118.883 -0.954 . . . . 0.0 112.322 177.95 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 75.6 mt-10 -74.11 -44.29 54.42 Favored 'General case' 0 C--N 1.341 0.201 0 CA-C-N 119.664 1.732 . . . . 0.0 107.824 177.251 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 81.3 mtt180 -102.05 -5.21 24.82 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-O 117.703 -1.142 . . . . 0.0 112.499 -178.499 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 60.6 mtt85 43.95 57.89 3.91 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 126.997 2.119 . . . . 0.0 111.941 177.684 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' THR . . . . . 0.484 HG23 HG13 ' A' ' 62' ' ' VAL . 10.0 t -151.05 156.44 41.11 Favored 'General case' 0 N--CA 1.442 -0.835 0 N-CA-C 107.848 -1.167 . . . . 0.0 107.848 177.174 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 31.3 m-85 -75.27 128.25 35.0 Favored 'General case' 0 C--O 1.238 0.479 0 N-CA-C 106.616 -1.624 . . . . 0.0 106.616 154.499 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.484 HG13 HG23 ' A' ' 60' ' ' THR . 0.0 OUTLIER -126.04 154.46 73.99 Favored Pre-proline 0 C--N 1.325 -0.481 0 C-N-CA 126.81 2.044 . . . . 0.0 111.429 -178.697 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 63' ' ' PRO . . . . . 0.412 ' HA ' HD23 ' A' ' 52' ' ' LEU . 54.4 Cg_endo -71.78 122.68 8.74 Favored 'Trans proline' 0 N--CA 1.456 -0.686 0 C-N-CA 122.87 2.38 . . . . 0.0 111.782 -176.17 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.311 0 N-CA-C 115.144 1.535 . . . . 0.0 115.144 -174.691 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 44.0 m-85 . . . . . 0 C--O 1.241 0.656 0 N-CA-C 109.922 -0.399 . . . . 0.0 109.922 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 62.8 Cg_endo -71.82 -169.0 0.4 Allowed 'Trans proline' 0 N--CA 1.46 -0.468 0 C-N-CA 123.598 2.865 . . . . 0.0 110.516 170.497 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 85.9 t -109.38 88.13 5.78 Favored Pre-proline 0 CA--C 1.539 0.544 0 C-N-CA 126.232 1.813 . . . . 0.0 108.341 178.226 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 64.9 Cg_endo -66.4 175.23 5.23 Favored 'Trans proline' 0 CA--C 1.543 0.935 0 C-N-CA 122.957 2.438 . . . . 0.0 112.744 -177.356 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -154.1 147.76 25.26 Favored 'General case' 0 N--CA 1.465 0.295 0 C-N-CA 123.171 0.588 . . . . 0.0 111.144 168.234 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.492 ' HA ' ' CD2' ' A' ' 18' ' ' TYR . 13.0 p -58.01 -22.9 20.01 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.151 0 C-N-CA 125.22 1.408 . . . . 0.0 114.048 178.711 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 8.0 t -64.92 -3.5 3.51 Favored 'General case' 0 CA--C 1.541 0.633 0 O-C-N 121.022 -1.049 . . . . 0.0 112.52 174.476 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 40.9 p -105.48 -7.98 18.36 Favored 'General case' 0 CA--C 1.543 0.707 0 CA-C-N 119.558 1.072 . . . . 0.0 112.369 178.257 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' TYR . . . . . 0.492 ' CD2' ' HA ' ' A' ' 15' ' ' VAL . 17.8 m-30 -88.99 168.28 12.49 Favored 'General case' 0 C--N 1.342 0.282 0 C-N-CA 124.61 1.164 . . . . 0.0 111.637 -170.226 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 14.5 mt-30 -118.09 116.04 26.05 Favored 'General case' 0 C--O 1.226 -0.181 0 C-N-CA 124.835 1.254 . . . . 0.0 110.099 178.805 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 69.6 t80 -71.27 143.02 50.5 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 118.473 0.578 . . . . 0.0 110.509 172.962 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -131.0 96.75 4.13 Favored 'General case' 0 CA--C 1.515 -0.376 0 C-N-CA 124.425 1.09 . . . . 0.0 110.141 178.529 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.7 pt-20 -53.54 -19.12 3.39 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.86 1.264 . . . . 0.0 113.289 -179.972 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 1.3 t -64.21 -17.92 64.01 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.229 1.412 . . . . 0.0 111.974 178.581 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -143.83 -19.96 0.58 Allowed 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 119.341 0.973 . . . . 0.0 112.467 177.712 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 89.88 10.57 64.63 Favored Glycine 0 CA--C 1.529 0.923 0 CA-C-O 118.331 -1.261 . . . . 0.0 113.433 176.105 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 -110.63 151.08 28.09 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-N 119.257 1.529 . . . . 0.0 108.468 177.602 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 66.0 m-85 -80.29 147.79 31.0 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 106.774 -1.565 . . . . 0.0 106.774 172.764 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 35.9 t80 -105.67 135.32 47.29 Favored 'General case' 0 C--O 1.239 0.515 0 C-N-CA 125.039 1.336 . . . . 0.0 110.223 175.892 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -99.65 85.8 0.51 Allowed Pre-proline 0 N--CA 1.451 -0.403 0 C-N-CA 126.824 2.049 . . . . 0.0 110.771 -178.591 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -65.73 -5.68 12.33 Favored 'Trans proline' 0 N--CA 1.458 -0.58 0 C-N-CA 121.649 1.566 . . . . 0.0 113.994 -179.49 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 36.7 tt0 -77.31 -33.03 55.69 Favored 'General case' 0 N--CA 1.447 -0.594 0 O-C-N 121.263 -0.898 . . . . 0.0 110.46 177.948 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.439 ' HB ' ' CD2' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -135.37 -19.57 1.67 Allowed 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 126.268 1.827 . . . . 0.0 112.988 -162.913 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 94.84 -4.78 68.8 Favored Glycine 0 N--CA 1.445 -0.725 0 CA-C-O 117.678 -1.623 . . . . 0.0 113.623 175.584 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.493 HD13 ' N ' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -76.84 -179.45 5.43 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 119.847 1.824 . . . . 0.0 109.906 178.644 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 41.0 m-85 -116.54 135.34 53.9 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-N 114.672 -1.149 . . . . 0.0 109.688 161.126 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 63.7 t80 -92.18 153.38 19.35 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 126.213 1.805 . . . . 0.0 109.683 168.235 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -128.93 144.28 51.93 Favored Pre-proline 0 CA--C 1.538 0.499 0 O-C-N 121.523 -0.736 . . . . 0.0 110.383 172.461 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 61.9 Cg_endo -72.75 -23.78 18.91 Favored 'Trans proline' 0 N--CA 1.457 -0.654 0 C-N-CA 122.445 2.096 . . . . 0.0 114.573 -176.539 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -84.79 -31.11 24.09 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-N 120.558 1.526 . . . . 0.0 109.935 166.029 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 49.4 m -127.32 92.77 3.57 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-O 122.403 1.096 . . . . 0.0 110.724 -162.924 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 5.5 mp0 -62.7 -5.92 3.14 Favored 'General case' 0 CA--C 1.546 0.825 0 CA-C-N 115.215 -0.902 . . . . 0.0 111.216 168.98 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 24.7 m-85 -62.92 98.0 0.12 Allowed 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 125.829 1.652 . . . . 0.0 107.398 160.395 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 67.9 m-85 -61.69 157.16 18.34 Favored 'General case' 0 C--O 1.232 0.153 0 C-N-CA 126.335 1.854 . . . . 0.0 111.511 177.692 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 10.8 t80 -115.89 108.45 16.3 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 125.029 1.332 . . . . 0.0 108.769 174.812 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 29.7 t30 -90.32 75.74 6.85 Favored 'General case' 0 C--O 1.235 0.299 0 C-N-CA 126.761 2.024 . . . . 0.0 106.111 177.359 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -48.63 -31.07 6.12 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 124.845 1.258 . . . . 0.0 111.413 178.703 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -44.75 -39.25 5.04 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 127.643 2.377 . . . . 0.0 112.594 178.901 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 35.2 m -134.22 20.14 3.72 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.956 1.302 . . . . 0.0 110.101 176.054 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 37.3 mt-30 46.66 17.82 0.06 Allowed 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 128.741 2.817 . . . . 0.0 114.844 -165.995 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 33.7 mm-40 -76.28 166.49 23.37 Favored 'General case' 0 CA--C 1.522 -0.117 0 CA-C-N 119.623 1.101 . . . . 0.0 111.623 -176.027 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 9.6 m-85 -118.98 123.93 45.75 Favored 'General case' 0 N--CA 1.45 -0.448 0 N-CA-C 106.318 -1.734 . . . . 0.0 106.318 -177.788 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.423 HD23 ' HA ' ' A' ' 63' ' ' PRO . 22.6 mt -124.1 167.81 13.72 Favored 'General case' 0 N--CA 1.464 0.252 0 C-N-CA 126.478 1.911 . . . . 0.0 110.495 -177.032 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 9.3 p90 -134.23 148.88 50.92 Favored 'General case' 0 N--CA 1.448 -0.573 0 O-C-N 120.948 -1.095 . . . . 0.0 108.197 164.722 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 39.6 t-105 -70.92 130.49 41.75 Favored 'General case' 0 C--O 1.236 0.365 0 N-CA-C 106.242 -1.762 . . . . 0.0 106.242 167.128 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 18.9 t0 -122.82 92.08 3.63 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-N 119.329 0.968 . . . . 0.0 109.788 174.758 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -59.51 -12.81 20.47 Favored Glycine 0 CA--C 1.529 0.93 0 CA-C-O 117.645 -1.642 . . . . 0.0 113.58 -178.454 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 -69.57 -20.98 63.65 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 120.389 2.094 . . . . 0.0 111.508 174.149 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 78.6 mtt85 -134.58 -0.07 2.95 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 126.771 2.028 . . . . 0.0 111.334 -167.756 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 5.9 mpt_? 44.63 48.3 8.65 Favored 'General case' 0 N--CA 1.463 0.177 0 C-N-CA 129.093 2.957 . . . . 0.0 112.593 174.579 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 13.9 t -143.67 -174.63 4.3 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 107.473 -1.306 . . . . 0.0 107.473 172.052 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 51.6 m-85 -106.05 135.73 46.99 Favored 'General case' 0 C--O 1.234 0.277 0 N-CA-C 106.913 -1.514 . . . . 0.0 106.913 169.77 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -125.87 157.3 69.54 Favored Pre-proline 0 C--N 1.328 -0.359 0 C-N-CA 126.043 1.737 . . . . 0.0 109.176 178.598 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 63' ' ' PRO . . . . . 0.423 ' HA ' HD23 ' A' ' 52' ' ' LEU . 61.0 Cg_endo -70.77 142.08 42.64 Favored 'Trans proline' 0 N--CA 1.452 -0.932 0 C-N-CA 121.232 1.288 . . . . 0.0 111.331 179.629 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.488 0 C-N-CA 125.589 1.555 . . . . 0.0 111.245 -177.29 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 45.6 m-85 . . . . . 0 CA--C 1.536 0.433 0 CA-C-O 119.507 -0.282 . . . . 0.0 111.567 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 61.9 Cg_endo -73.11 -177.8 3.18 Favored 'Trans proline' 0 CA--C 1.537 0.672 0 C-N-CA 124.747 3.631 . . . . 0.0 112.084 174.686 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 29.7 t -110.88 87.33 6.78 Favored Pre-proline 0 CA--C 1.532 0.284 0 C-N-CA 126.818 2.047 . . . . 0.0 108.697 -176.184 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 41.0 Cg_endo -67.27 162.1 40.11 Favored 'Trans proline' 0 CA--C 1.542 0.89 0 C-N-CA 121.847 1.698 . . . . 0.0 109.955 171.539 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.424 ' C ' ' H ' ' A' ' 16' ' ' SER . 50.8 t0 -159.45 32.94 0.2 Allowed 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 123.12 0.568 . . . . 0.0 111.302 -172.817 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . 0.376 7.5 p 43.78 -22.68 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.552 1.055 1 C-N-CA 133.408 4.683 . . . . 0.0 116.727 -165.94 . . . . . . . . 3 2 . 1 . 013 nuclear build core ' A' A ' 16' ' ' SER . . . . . 0.424 ' H ' ' C ' ' A' ' 14' ' ' ASP . 2.8 p -70.18 -18.22 63.19 Favored 'General case' 0 N--CA 1.446 -0.672 0 C-N-CA 128.635 2.774 . . . . 0.0 111.995 -174.086 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 16.5 p -87.62 -13.95 41.37 Favored 'General case' 0 CA--C 1.538 0.501 0 O-C-N 121.139 -0.976 . . . . 0.0 110.712 175.455 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 13.7 m-30 -72.56 148.35 45.04 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-O 122.501 1.143 . . . . 0.0 111.023 -161.014 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 84.7 mt-30 -87.4 101.95 14.06 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 105.921 -1.881 . . . . 0.0 105.921 170.178 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 88.3 t80 -59.05 142.72 50.57 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 107.742 -1.207 . . . . 0.0 107.742 159.817 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -128.13 88.95 2.84 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 104.692 -2.336 . . . . 0.0 104.692 -176.484 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -56.09 -27.89 55.5 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 124.544 1.138 . . . . 0.0 113.699 -171.017 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 10.6 t -45.74 -52.93 10.26 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 126.024 1.73 . . . . 0.0 111.124 177.741 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 22.2 m -93.22 -35.71 12.98 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 118.513 0.597 . . . . 0.0 110.86 169.548 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 80.16 58.36 2.8 Favored Glycine 0 CA--C 1.524 0.61 0 N-CA-C 110.044 -1.222 . . . . 0.0 110.044 -173.198 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 30.3 m-85 -142.23 169.95 16.62 Favored 'General case' 0 C--O 1.24 0.597 0 C-N-CA 130.237 3.415 . . . . 0.0 106.229 173.138 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 82.2 m-85 -101.64 150.89 22.64 Favored 'General case' 0 CA--C 1.522 -0.116 0 O-C-N 121.906 -0.496 . . . . 0.0 111.043 178.709 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 41.6 t80 -119.84 140.92 50.06 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 127.848 2.459 . . . . 0.0 107.886 174.279 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 51.4 t0 -104.92 86.4 1.49 Allowed Pre-proline 0 N--CA 1.467 0.4 0 C-N-CA 127.468 2.307 . . . . 0.0 109.95 -177.134 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo -62.26 -13.77 34.36 Favored 'Trans proline' 0 CA--C 1.533 0.455 0 C-N-CA 122.716 2.278 . . . . 0.0 113.765 -175.924 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -74.32 -14.42 60.89 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 124.169 0.988 . . . . 0.0 111.453 -179.42 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.483 HG21 ' CE2' ' A' ' 61' ' ' TYR . 2.9 p -141.12 -45.77 0.38 Allowed 'General case' 0 C--N 1.332 -0.17 0 C-N-CA 125.519 1.528 . . . . 0.0 110.426 -172.204 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 98.31 46.06 2.25 Favored Glycine 0 N--CA 1.446 -0.654 0 N-CA-C 109.731 -1.348 . . . . 0.0 109.731 -175.719 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 12.7 mt -118.77 173.2 7.01 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 127.111 2.164 . . . . 0.0 107.568 172.535 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 26.4 m-85 -117.86 166.1 12.88 Favored 'General case' 0 C--O 1.238 0.481 0 C-N-CA 123.962 0.905 . . . . 0.0 109.443 168.358 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 69.2 t80 -143.87 158.65 43.55 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 125.995 1.718 . . . . 0.0 109.63 -178.372 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -131.24 143.76 50.66 Favored Pre-proline 0 CA--C 1.538 0.501 0 C-N-CA 125.406 1.482 . . . . 0.0 110.825 175.2 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -74.26 -35.12 4.18 Favored 'Trans proline' 0 CA--C 1.536 0.614 0 C-N-CA 123.465 2.777 . . . . 0.0 114.346 -178.183 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 13.6 m-80 -76.51 -23.32 53.7 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 120.085 1.311 . . . . 0.0 110.851 174.667 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -134.91 85.99 2.22 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 124.135 0.974 . . . . 0.0 108.895 -158.495 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 6.1 mp0 -62.85 -0.08 0.61 Allowed 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 124.598 1.159 . . . . 0.0 114.084 -176.038 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 60.8 m-85 -77.85 110.12 12.46 Favored 'General case' 0 C--O 1.237 0.402 0 O-C-N 120.052 -1.655 . . . . 0.0 108.449 174.525 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 14.5 m-85 -63.03 146.04 54.1 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 125.507 1.523 . . . . 0.0 109.811 -176.094 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 74.7 t80 -102.23 112.81 25.64 Favored 'General case' 0 CA--C 1.516 -0.34 0 CA-C-O 122.735 1.255 . . . . 0.0 108.206 177.785 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 49.3 t30 -84.64 80.88 9.1 Favored 'General case' 0 N--CA 1.44 -0.944 0 C-N-CA 125.266 1.427 . . . . 0.0 108.728 175.785 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -44.42 -37.17 3.25 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 125.182 1.393 . . . . 0.0 111.817 175.737 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 3.2 tt0 -44.35 -43.11 7.3 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 127.842 2.457 . . . . 0.0 112.766 179.927 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 17.9 m -131.78 21.04 4.6 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 125.438 1.495 . . . . 0.0 110.835 177.878 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 43.4 mt-30 48.27 27.99 1.47 Allowed 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 126.153 1.781 . . . . 0.0 112.571 -173.433 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.1 tp-100 -94.09 169.8 10.0 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 124.638 1.175 . . . . 0.0 110.594 -170.422 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 3.4 m-85 -108.29 144.57 35.62 Favored 'General case' 0 C--O 1.236 0.386 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 169.461 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 83.4 mt -142.6 179.93 6.68 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 127.197 2.199 . . . . 0.0 107.663 -178.991 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 17.8 p90 -135.83 146.09 47.13 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 124.435 1.094 . . . . 0.0 108.817 167.75 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 64.8 t-105 -73.43 132.95 43.54 Favored 'General case' 0 C--O 1.236 0.379 0 N-CA-C 105.676 -1.972 . . . . 0.0 105.676 164.961 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 58.9 t0 -129.63 76.6 1.73 Allowed 'General case' 0 CA--C 1.514 -0.412 0 C-N-CA 123.921 0.888 . . . . 0.0 109.004 -174.46 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -57.48 -7.16 2.78 Favored Glycine 0 CA--C 1.534 1.268 0 C-N-CA 124.692 1.139 . . . . 0.0 113.074 -176.079 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 34.3 mm-40 -65.2 -32.68 74.49 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 119.157 1.479 . . . . 0.0 109.414 169.461 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 62.5 mtt180 -118.67 -13.37 9.62 Favored 'General case' 0 C--O 1.231 0.093 0 C-N-CA 127.11 2.164 . . . . 0.0 113.466 -174.732 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 81.9 mtt180 56.58 59.72 3.44 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 124.702 1.201 . . . . 0.0 110.705 -173.8 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 4.7 t -153.94 -179.23 7.67 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 123.515 0.726 . . . . 0.0 109.051 174.475 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' TYR . . . . . 0.483 ' CE2' HG21 ' A' ' 32' ' ' THR . 98.7 m-85 -116.73 123.0 46.11 Favored 'General case' 0 C--O 1.233 0.207 0 N-CA-C 108.587 -0.894 . . . . 0.0 108.587 172.239 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -124.31 157.26 65.24 Favored Pre-proline 0 C--N 1.328 -0.357 0 C-N-CA 126.029 1.731 . . . . 0.0 110.29 -168.689 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo -72.0 130.87 17.25 Favored 'Trans proline' 0 N--CA 1.454 -0.852 0 C-N-CA 122.013 1.809 . . . . 0.0 110.933 -171.909 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 0.395 0 CA-C-O 122.156 0.979 . . . . 0.0 111.089 -176.551 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 . . . . . 0 C--O 1.239 0.53 0 CA-C-O 120.28 0.086 . . . . 0.0 110.96 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_endo -75.79 -178.07 4.07 Favored 'Trans proline' 0 N--CA 1.455 -0.757 0 C-N-CA 123.571 2.847 . . . . 0.0 110.288 168.93 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 13.8 t -109.81 87.64 5.83 Favored Pre-proline 0 CA--C 1.544 0.719 0 C-N-CA 126.95 2.1 . . . . 0.0 108.58 -170.38 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 25.1 Cg_endo -77.1 -178.25 4.44 Favored 'Trans proline' 0 CA--C 1.539 0.769 0 C-N-CA 124.552 3.501 . . . . 0.0 111.726 -173.76 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 22.7 t0 -152.5 142.48 22.19 Favored 'General case' 0 N--CA 1.468 0.437 0 O-C-N 121.473 -0.767 . . . . 0.0 110.102 166.417 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 12.5 p -62.65 -19.95 24.02 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.64 0 O-C-N 121.336 -0.853 . . . . 0.0 110.971 174.089 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 17.4 m -59.41 -10.55 3.3 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.804 1.242 . . . . 0.0 113.914 173.276 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.4 t -115.97 9.26 14.85 Favored 'General case' 0 CA--C 1.545 0.767 0 CA-C-N 120.159 1.345 . . . . 0.0 111.199 177.729 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 11.4 m-30 -89.01 167.68 12.97 Favored 'General case' 0 C--O 1.236 0.36 0 O-C-N 120.837 -1.165 . . . . 0.0 111.756 -178.224 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 43.9 mt-30 -98.54 129.69 45.1 Favored 'General case' 0 C--O 1.224 -0.268 0 N-CA-C 107.455 -1.313 . . . . 0.0 107.455 170.652 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 69.2 t80 -73.62 150.25 41.49 Favored 'General case' 0 C--O 1.24 0.577 0 CA-C-N 119.239 0.927 . . . . 0.0 108.742 161.281 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -126.25 93.83 3.92 Favored 'General case' 0 C--O 1.233 0.206 0 N-CA-C 107.513 -1.292 . . . . 0.0 107.513 175.541 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.82 -27.46 51.47 Favored 'General case' 0 N--CA 1.462 0.141 0 C-N-CA 124.864 1.265 . . . . 0.0 112.676 -179.677 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 13.5 t -50.95 -30.67 15.54 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 126.084 1.754 . . . . 0.0 112.385 173.43 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 31.0 m -139.18 -13.11 1.19 Allowed 'General case' 0 CA--C 1.532 0.255 0 N-CA-C 114.004 1.113 . . . . 0.0 114.004 -172.759 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 77.11 39.65 26.79 Favored Glycine 0 CA--C 1.527 0.841 0 CA-C-N 119.623 1.101 . . . . 0.0 111.651 174.181 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 4.8 m-85 -129.0 171.56 12.23 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 126.833 2.053 . . . . 0.0 107.317 170.691 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 84.2 m-85 -102.79 151.35 22.51 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 124.851 1.261 . . . . 0.0 107.717 163.92 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 37.4 t80 -117.59 139.98 50.24 Favored 'General case' 0 N--CA 1.45 -0.446 0 C-N-CA 126.801 2.04 . . . . 0.0 107.977 174.824 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -113.91 84.06 8.29 Favored Pre-proline 0 N--CA 1.439 -1.014 0 C-N-CA 125.705 1.602 . . . . 0.0 108.939 -162.184 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_endo -64.83 -14.42 44.88 Favored 'Trans proline' 0 C--N 1.349 0.587 0 C-N-CA 123.143 2.562 . . . . 0.0 113.176 -176.881 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 26.9 tt0 -69.38 -20.29 63.82 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 126.349 1.859 . . . . 0.0 111.495 -178.786 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -146.69 -33.63 0.3 Allowed 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 125.235 1.414 . . . . 0.0 112.391 -166.732 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 91.98 39.3 5.51 Favored Glycine 0 CA--C 1.527 0.831 0 C-N-CA 125.079 1.323 . . . . 0.0 111.648 -176.89 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 10.0 mt -122.66 -179.2 4.14 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 125.707 1.603 . . . . 0.0 108.012 177.546 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 47.2 m-85 -123.14 154.98 37.91 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 123.447 0.699 . . . . 0.0 109.369 166.61 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 39.7 t80 -124.41 158.38 32.87 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 127.376 2.27 . . . . 0.0 110.195 177.081 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 15.5 t0 -132.42 142.05 43.5 Favored Pre-proline 0 N--CA 1.468 0.461 0 C-N-CA 126.124 1.77 . . . . 0.0 108.253 -179.414 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo -81.1 -30.18 1.74 Allowed 'Trans proline' 0 C--O 1.239 0.572 0 C-N-CA 122.345 2.03 . . . . 0.0 114.18 -174.577 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -76.74 -30.4 56.58 Favored 'General case' 0 N--CA 1.453 -0.309 0 O-C-N 121.141 -0.974 . . . . 0.0 110.833 173.365 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 48.9 m -136.92 98.08 3.68 Favored 'General case' 0 C--O 1.219 -0.527 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 -168.82 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 26.9 mp0 -56.97 -6.68 0.37 Allowed 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 125.942 1.697 . . . . 0.0 113.782 -178.985 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 25.4 m-85 -66.26 103.51 1.01 Allowed 'General case' 0 N--CA 1.446 -0.643 0 C-N-CA 126.049 1.74 . . . . 0.0 107.803 173.549 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 50.2 m-85 -59.56 156.94 12.42 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 125.056 1.342 . . . . 0.0 109.771 178.235 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 66.7 t80 -111.57 112.76 24.71 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 125.169 1.388 . . . . 0.0 108.042 177.579 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 50.3 t30 -84.15 81.41 8.82 Favored 'General case' 0 N--CA 1.446 -0.651 0 C-N-CA 125.875 1.67 . . . . 0.0 109.098 178.096 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -50.21 -30.83 12.36 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 124.82 1.248 . . . . 0.0 112.354 178.425 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -53.65 -36.61 62.27 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 127.182 2.193 . . . . 0.0 113.68 -179.35 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 60.5 m -128.59 -1.0 5.52 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.656 1.182 . . . . 0.0 112.543 -179.505 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 20.6 mt-30 65.7 35.97 6.6 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.799 1.639 . . . . 0.0 110.166 -169.494 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -103.78 170.39 7.95 Favored 'General case' 0 N--CA 1.468 0.451 0 O-C-N 120.435 -1.416 . . . . 0.0 110.822 -175.331 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 4.2 m-85 -117.98 133.02 56.32 Favored 'General case' 0 C--O 1.234 0.245 0 C-N-CA 124.888 1.275 . . . . 0.0 107.898 177.771 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.455 ' HA ' ' HA ' ' A' ' 63' ' ' PRO . 41.9 mt -132.9 177.84 7.34 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 125.777 1.631 . . . . 0.0 109.135 -175.136 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 32.5 p90 -139.16 153.15 47.89 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 125.457 1.503 . . . . 0.0 108.697 168.611 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 57.2 t-105 -85.71 128.6 34.83 Favored 'General case' 0 C--O 1.233 0.227 0 N-CA-C 106.806 -1.554 . . . . 0.0 106.806 168.927 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 61.8 t0 -121.16 100.01 6.81 Favored 'General case' 0 N--CA 1.446 -0.657 0 N-CA-C 108.444 -0.946 . . . . 0.0 108.444 -174.743 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -71.23 -15.79 74.89 Favored Glycine 0 CA--C 1.526 0.732 0 CA-C-O 118.317 -1.268 . . . . 0.0 112.835 176.95 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -62.99 -43.96 97.35 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 119.615 1.708 . . . . 0.0 107.028 173.389 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 5.6 mtt180 -107.1 -6.44 17.39 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 125.097 1.359 . . . . 0.0 113.288 -170.494 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 86.1 mtt180 43.88 60.81 2.55 Favored 'General case' 0 CA--C 1.52 -0.205 0 C-N-CA 127.989 2.515 . . . . 0.0 109.753 -169.874 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 6.2 t -150.2 172.2 15.71 Favored 'General case' 0 N--CA 1.447 -0.594 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 -179.831 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 74.0 m-85 -104.43 129.16 52.41 Favored 'General case' 0 C--O 1.236 0.363 0 N-CA-C 108.701 -0.852 . . . . 0.0 108.701 166.223 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -126.16 154.98 74.32 Favored Pre-proline 0 C--N 1.327 -0.388 0 C-N-CA 127.272 2.229 . . . . 0.0 108.815 -177.142 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 63' ' ' PRO . . . . . 0.455 ' HA ' ' HA ' ' A' ' 52' ' ' LEU . 68.5 Cg_endo -75.39 137.73 21.24 Favored 'Trans proline' 0 N--CA 1.456 -0.691 0 C-N-CA 122.104 1.869 . . . . 0.0 111.726 -176.986 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.461 0.113 0 C-N-CA 124.847 1.259 . . . . 0.0 111.703 -178.047 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 27.9 m-85 . . . . . 0 CA--C 1.536 0.432 0 CA-C-O 119.646 -0.216 . . . . 0.0 111.52 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -65.67 170.09 11.83 Favored 'Trans proline' 0 CA--C 1.536 0.582 0 C-N-CA 123.819 3.012 . . . . 0.0 109.842 165.313 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 42.4 t -109.23 86.19 3.96 Favored Pre-proline 0 CA--C 1.536 0.428 0 C-N-CA 125.277 1.431 . . . . 0.0 108.539 -170.479 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 42.1 Cg_endo -75.93 166.78 27.44 Favored 'Trans proline' 0 N--CA 1.449 -1.103 0 C-N-CA 121.74 1.627 . . . . 0.0 110.34 -174.366 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 61.5 t0 -142.61 129.38 20.47 Favored 'General case' 0 C--O 1.237 0.412 0 N-CA-C 107.08 -1.452 . . . . 0.0 107.08 173.838 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.476 HG21 ' CE1' ' A' ' 36' ' ' TYR . 12.3 p -53.85 -24.55 10.57 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.352 0 C-N-CA 124.626 1.17 . . . . 0.0 111.995 176.039 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 38.7 t -45.54 -29.54 1.2 Allowed 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.74 1.616 . . . . 0.0 112.389 170.267 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 49.0 p -109.68 2.22 20.03 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 125.149 1.38 . . . . 0.0 112.879 -171.557 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 15.7 m-30 -77.37 175.49 9.72 Favored 'General case' 0 C--O 1.236 0.382 0 O-C-N 121.302 -0.873 . . . . 0.0 110.605 -178.973 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 80.9 mt-30 -116.85 106.59 13.62 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 125.263 1.425 . . . . 0.0 107.473 -176.313 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 49.4 t80 -66.34 147.11 53.78 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.826 -0.435 . . . . 0.0 109.826 176.371 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -135.08 86.0 2.22 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 125.319 1.448 . . . . 0.0 107.203 176.709 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -49.86 -32.22 13.86 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 126.946 2.098 . . . . 0.0 113.635 179.415 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 7.1 t -60.54 -18.65 53.61 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 125.035 1.334 . . . . 0.0 112.503 179.165 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 58.6 m -107.17 -50.3 3.11 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 118.965 0.802 . . . . 0.0 109.582 153.967 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 117.27 9.56 10.38 Favored Glycine 0 CA--C 1.522 0.499 0 C-N-CA 125.452 1.501 . . . . 0.0 112.05 -172.048 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -105.63 168.94 8.77 Favored 'General case' 0 CA--C 1.519 -0.236 0 CA-C-N 118.576 1.188 . . . . 0.0 109.011 -175.443 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 94.8 m-85 -93.33 147.37 22.99 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 107.602 -1.258 . . . . 0.0 107.602 167.884 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 14.9 t80 -111.96 136.11 51.72 Favored 'General case' 0 N--CA 1.442 -0.871 0 C-N-CA 126.35 1.86 . . . . 0.0 107.027 171.57 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -119.69 77.71 21.29 Favored Pre-proline 0 N--CA 1.437 -1.091 0 C-N-CA 125.407 1.483 . . . . 0.0 108.773 -162.874 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 22.6 Cg_endo -62.9 -12.13 27.82 Favored 'Trans proline' 0 C--N 1.348 0.518 0 C-N-CA 122.83 2.354 . . . . 0.0 113.445 -176.861 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 21.0 mm-40 -62.71 -19.92 64.38 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.68 0.792 . . . . 0.0 111.111 174.459 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 5.8 p -141.74 -23.58 0.71 Allowed 'General case' 0 C--O 1.234 0.286 0 N-CA-C 113.834 1.049 . . . . 0.0 113.834 178.569 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 79.03 43.2 11.08 Favored Glycine 0 CA--C 1.531 1.034 0 N-CA-C 109.905 -1.278 . . . . 0.0 109.905 -166.301 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 42.3 mt -111.84 178.55 4.28 Favored 'General case' 0 C--O 1.234 0.282 0 C-N-CA 124.712 1.205 . . . . 0.0 108.175 165.659 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 36.9 m-85 -123.65 154.63 39.09 Favored 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 124.883 1.273 . . . . 0.0 107.605 166.304 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.476 ' CE1' HG21 ' A' ' 15' ' ' VAL . 24.3 t80 -131.02 156.06 45.79 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 125.414 1.485 . . . . 0.0 109.358 -178.217 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -127.22 144.15 49.62 Favored Pre-proline 0 CA--C 1.536 0.436 0 C-N-CA 123.649 0.78 . . . . 0.0 110.359 175.529 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -74.28 -31.75 7.21 Favored 'Trans proline' 0 CA--C 1.535 0.54 0 C-N-CA 122.894 2.396 . . . . 0.0 113.849 -176.758 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 8.5 m-80 -75.38 -29.62 59.91 Favored 'General case' 0 N--CA 1.462 0.144 0 CA-C-N 119.346 0.976 . . . . 0.0 109.925 170.395 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -129.64 89.73 2.88 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 123.881 0.873 . . . . 0.0 109.841 -158.267 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -68.15 9.94 0.27 Allowed 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 124.49 1.116 . . . . 0.0 112.913 -177.627 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 56.6 m-85 -81.78 112.77 19.24 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 126.589 1.956 . . . . 0.0 106.947 170.314 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 23.1 m-85 -77.96 124.49 28.07 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 124.255 1.022 . . . . 0.0 111.036 -177.681 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 92.1 t80 -77.2 118.85 20.12 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 125.153 1.381 . . . . 0.0 108.983 178.925 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 26.4 t30 -90.41 83.96 5.96 Favored 'General case' 0 CA--C 1.512 -0.489 0 C-N-CA 125.432 1.493 . . . . 0.0 109.565 -178.558 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -53.26 -26.03 16.64 Favored 'General case' 0 CA--C 1.538 0.504 0 N-CA-C 114.37 1.248 . . . . 0.0 114.37 -173.734 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -52.67 -66.01 0.46 Allowed 'General case' 0 C--O 1.236 0.343 0 C-N-CA 125.898 1.679 . . . . 0.0 109.084 178.178 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 19.2 m -112.69 22.67 14.3 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 124.922 1.289 . . . . 0.0 111.258 -171.272 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . 0.337 5.3 pt20 44.65 34.14 1.08 Allowed 'General case' 0 CA--C 1.554 1.11 0 C-N-CA 126.72 2.008 . . . . 0.0 113.312 -178.525 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 7.0 mm-40 -97.47 152.69 18.73 Favored 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 126.483 1.913 . . . . 0.0 112.26 178.844 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 3.4 m-30 -95.57 139.72 31.42 Favored 'General case' 0 N--CA 1.47 0.566 0 O-C-N 120.833 -1.167 . . . . 0.0 108.762 172.862 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.486 ' HA ' ' H ' ' A' ' 64' ' ' ALA . 41.4 mt -131.33 174.29 10.21 Favored 'General case' 0 N--CA 1.465 0.279 0 C-N-CA 126.749 2.02 . . . . 0.0 110.267 -176.478 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 31.2 p90 -143.53 149.14 37.03 Favored 'General case' 0 C--O 1.238 0.493 0 C-N-CA 124.107 0.963 . . . . 0.0 110.361 168.077 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 50.1 t-105 -93.16 92.6 7.84 Favored 'General case' 0 CA--C 1.516 -0.36 0 N-CA-C 105.075 -2.195 . . . . 0.0 105.075 -176.53 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 43.8 t0 -87.52 96.45 10.4 Favored 'General case' 0 N--CA 1.446 -0.669 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 -177.691 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -59.44 -15.37 31.55 Favored Glycine 0 CA--C 1.53 0.971 0 CA-C-O 118.414 -1.215 . . . . 0.0 112.694 178.754 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 22.7 mt-10 -66.92 -34.84 78.65 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 119.987 1.894 . . . . 0.0 110.1 175.4 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 21.1 mtt180 -109.58 -4.97 15.86 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 125.541 1.536 . . . . 0.0 111.453 -177.05 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 76.1 mtm180 44.21 49.16 7.77 Favored 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 126.374 1.87 . . . . 0.0 110.169 -174.697 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 3.2 t -147.13 178.81 8.09 Favored 'General case' 0 N--CA 1.443 -0.798 0 N-CA-C 108.909 -0.775 . . . . 0.0 108.909 -177.451 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 89.3 m-85 -109.76 131.72 54.8 Favored 'General case' 0 C--O 1.24 0.572 0 N-CA-C 108.146 -1.057 . . . . 0.0 108.146 178.1 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -125.88 154.43 73.56 Favored Pre-proline 0 C--N 1.325 -0.484 0 C-N-CA 125.788 1.635 . . . . 0.0 108.907 176.092 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 63' ' ' PRO . . . . . 0.42 ' HA ' HD23 ' A' ' 52' ' ' LEU . 72.0 Cg_endo -75.43 124.03 8.06 Favored 'Trans proline' 0 N--CA 1.453 -0.871 0 C-N-CA 122.562 2.174 . . . . 0.0 111.105 179.497 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.486 ' H ' ' HA ' ' A' ' 52' ' ' LEU . . . . . . . . 0 C--O 1.236 0.355 0 CA-C-O 122.531 1.158 . . . . 0.0 109.379 166.674 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 68.6 m-85 . . . . . 0 CA--C 1.537 0.457 0 CA-C-O 119.479 -0.296 . . . . 0.0 111.208 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -71.7 178.47 5.71 Favored 'Trans proline' 0 N--CA 1.459 -0.514 0 C-N-CA 123.964 3.109 . . . . 0.0 110.848 167.498 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 37.1 t -104.6 85.85 1.26 Allowed Pre-proline 0 CA--C 1.541 0.609 0 C-N-CA 127.009 2.123 . . . . 0.0 108.987 -171.494 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_endo -69.91 171.71 14.14 Favored 'Trans proline' 0 C--O 1.237 0.462 0 C-N-CA 123.142 2.561 . . . . 0.0 111.045 179.845 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 14.0 t0 -144.61 139.94 28.41 Favored 'General case' 0 C--O 1.224 -0.238 0 N-CA-C 107.412 -1.329 . . . . 0.0 107.412 178.401 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 6.5 p -65.61 -19.89 26.46 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.599 0 CA-C-N 119.291 0.951 . . . . 0.0 111.22 175.382 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 10.6 t -60.42 -17.83 46.87 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-O 117.334 -1.317 . . . . 0.0 112.092 173.079 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 29.7 p -100.15 -6.13 26.7 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 121.577 1.989 . . . . 0.0 113.028 176.005 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 13.3 m-30 -70.74 173.67 6.96 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 119.531 1.06 . . . . 0.0 112.472 -174.322 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 77.0 mt-30 -114.79 109.28 17.94 Favored 'General case' 0 CA--C 1.528 0.122 0 C-N-CA 126.142 1.777 . . . . 0.0 108.949 176.745 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 81.8 t80 -68.64 142.08 55.2 Favored 'General case' 0 C--O 1.238 0.491 0 CA-C-N 119.343 0.974 . . . . 0.0 110.674 169.708 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 3.6 t0 -119.71 111.42 18.0 Favored 'General case' 0 CA--C 1.504 -0.822 0 N-CA-C 106.686 -1.598 . . . . 0.0 106.686 170.817 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -64.2 -21.94 66.75 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 118.155 -0.926 . . . . 0.0 112.927 178.082 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 1.3 t -61.34 -38.76 88.1 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 118.327 0.512 . . . . 0.0 110.555 -171.82 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 7.8 m -113.36 -19.34 11.77 Favored 'General case' 0 C--O 1.233 0.219 0 C-N-CA 124.703 1.201 . . . . 0.0 111.018 173.87 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 81.46 34.49 25.51 Favored Glycine 0 C--N 1.337 0.599 0 N-CA-C 110.74 -0.944 . . . . 0.0 110.74 174.692 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 4.4 m-85 -119.69 171.05 8.66 Favored 'General case' 0 N--CA 1.463 0.213 0 C-N-CA 126.482 1.913 . . . . 0.0 108.352 178.475 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 67.5 m-85 -103.76 141.01 36.83 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 107.701 -1.222 . . . . 0.0 107.701 171.929 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 52.3 t80 -102.2 136.91 41.21 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 125.868 1.667 . . . . 0.0 106.574 169.91 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 16.7 t0 -97.82 87.45 0.53 Allowed Pre-proline 0 C--N 1.327 -0.387 0 C-N-CA 126.458 1.903 . . . . 0.0 110.332 179.826 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -61.51 -10.54 16.63 Favored 'Trans proline' 0 CA--C 1.537 0.647 0 C-N-CA 121.618 1.546 . . . . 0.0 113.236 176.22 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -80.88 -13.52 58.85 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 124.643 1.177 . . . . 0.0 112.219 -177.784 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 69.8 p -146.48 -23.81 0.43 Allowed 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 113.98 1.104 . . . . 0.0 113.98 168.2 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 108.14 3.27 33.7 Favored Glycine 0 CA--C 1.53 1.009 0 C-N-CA 124.881 1.229 . . . . 0.0 113.936 -179.272 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 39.4 mt -71.38 178.19 3.55 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 125.562 1.545 . . . . 0.0 110.587 173.983 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 54.3 m-85 -116.7 167.19 11.31 Favored 'General case' 0 C--O 1.237 0.424 0 C-N-CA 124.682 1.193 . . . . 0.0 108.333 158.295 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 80.3 t80 -141.4 163.06 33.97 Favored 'General case' 0 C--O 1.237 0.431 0 C-N-CA 126.376 1.87 . . . . 0.0 108.916 176.808 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -133.11 143.9 50.39 Favored Pre-proline 0 CA--C 1.536 0.406 0 C-N-CA 124.189 0.996 . . . . 0.0 110.503 177.971 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -73.71 -38.65 2.27 Favored 'Trans proline' 0 N--CA 1.454 -0.84 0 C-N-CA 123.236 2.624 . . . . 0.0 112.656 -176.017 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 27.0 m-80 -78.13 -35.97 48.38 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-N 119.091 0.86 . . . . 0.0 110.414 -178.272 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 48.8 p -130.86 91.95 3.14 Favored 'General case' 0 C--O 1.223 -0.301 0 N-CA-C 108.379 -0.971 . . . . 0.0 108.379 -159.886 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -60.79 0.17 0.23 Allowed 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 126.311 1.844 . . . . 0.0 115.549 -163.828 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 38.2 m-85 -68.53 123.98 22.33 Favored 'General case' 0 N--CA 1.448 -0.575 0 C-N-CA 125.134 1.374 . . . . 0.0 108.927 174.271 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 25.6 m-85 -75.92 141.64 42.25 Favored 'General case' 0 N--CA 1.448 -0.54 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 175.789 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 56.9 t80 -102.51 115.32 30.34 Favored 'General case' 0 C--N 1.33 -0.242 0 C-N-CA 123.949 0.899 . . . . 0.0 109.288 176.318 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 26.4 t30 -88.29 87.16 7.21 Favored 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 106.992 -1.484 . . . . 0.0 106.992 172.43 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -48.62 -39.6 24.59 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 124.618 1.167 . . . . 0.0 110.112 175.858 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -55.95 -11.34 1.02 Allowed 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 127.673 2.389 . . . . 0.0 116.409 -177.807 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -145.02 6.56 1.16 Allowed 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 119.728 1.149 . . . . 0.0 111.268 160.847 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 50.4 mt-30 64.94 15.78 10.14 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 129.345 3.058 . . . . 0.0 113.273 -168.045 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.92 148.64 49.89 Favored 'General case' 0 N--CA 1.466 0.334 0 O-C-N 121.096 -1.003 . . . . 0.0 111.19 -179.399 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 8.8 m-85 -106.34 132.31 52.53 Favored 'General case' 0 C--O 1.234 0.262 0 N-CA-C 108.165 -1.05 . . . . 0.0 108.165 168.037 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 78.5 mt -135.17 -176.03 4.12 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 127.136 2.174 . . . . 0.0 107.511 -172.741 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 19.6 p90 -146.7 160.24 42.47 Favored 'General case' 0 C--O 1.235 0.316 0 O-C-N 120.758 -1.213 . . . . 0.0 109.527 163.871 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 45.9 t-105 -82.39 105.07 13.15 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 125.15 1.38 . . . . 0.0 108.068 173.104 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 23.1 t0 -89.94 96.86 10.87 Favored 'General case' 0 C--O 1.235 0.339 0 N-CA-C 105.986 -1.857 . . . . 0.0 105.986 170.858 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -76.49 -7.38 85.35 Favored Glycine 0 CA--C 1.531 1.075 0 CA-C-O 118.235 -1.314 . . . . 0.0 112.804 -179.989 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 25.3 mt-10 -73.58 -48.6 31.55 Favored 'General case' 0 C--N 1.341 0.236 0 CA-C-N 119.853 1.827 . . . . 0.0 108.808 172.158 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -81.02 -14.62 57.74 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.631 1.172 . . . . 0.0 112.449 174.01 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.9 mpt_? 46.91 61.42 2.85 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 125.436 1.495 . . . . 0.0 109.913 -164.339 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 5.6 t -150.38 174.85 12.42 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-O 121.543 0.687 . . . . 0.0 109.978 174.059 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 93.6 m-85 -108.63 121.25 44.63 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 125.158 1.383 . . . . 0.0 108.106 179.028 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -125.21 154.31 71.82 Favored Pre-proline 0 C--N 1.324 -0.514 0 C-N-CA 125.403 1.481 . . . . 0.0 110.25 -170.263 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_endo -70.0 126.57 13.3 Favored 'Trans proline' 0 N--CA 1.454 -0.843 0 C-N-CA 122.479 2.119 . . . . 0.0 110.527 178.937 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.332 -0.158 0 N-CA-C 114.235 1.198 . . . . 0.0 114.235 -173.621 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 49.9 m-85 . . . . . 0 CA--C 1.547 0.837 0 N-CA-C 112.579 0.585 . . . . 0.0 112.579 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -69.08 -176.51 1.32 Allowed 'Trans proline' 0 CA--C 1.539 0.742 0 C-N-CA 124.672 3.582 . . . . 0.0 110.699 164.336 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 45.9 t -107.89 86.79 3.26 Favored Pre-proline 0 CA--C 1.541 0.625 0 C-N-CA 125.612 1.565 . . . . 0.0 109.351 -178.881 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 94.3 Cg_endo -67.76 154.81 72.17 Favored 'Trans proline' 0 C--N 1.348 0.523 0 C-N-CA 123.276 2.651 . . . . 0.0 111.772 175.513 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -127.13 129.17 47.41 Favored 'General case' 0 N--CA 1.433 -1.277 0 C-N-CA 126.003 1.721 . . . . 0.0 109.723 -175.254 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 11.8 p -60.03 -24.44 30.02 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 O-C-N 121.776 -0.577 . . . . 0.0 111.41 173.452 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -49.84 -53.73 23.74 Favored 'General case' 0 N--CA 1.438 -1.044 0 C-N-CA 125.818 1.647 . . . . 0.0 112.213 173.507 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 4.4 t -77.91 -4.22 45.71 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-O 117.897 -1.049 . . . . 0.0 112.716 -178.985 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 11.9 m-30 -64.6 156.51 29.75 Favored 'General case' 0 C--O 1.238 0.479 0 CA-C-N 121.412 1.915 . . . . 0.0 111.018 178.888 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 63.0 mt-30 -92.74 121.67 34.37 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 124.332 1.053 . . . . 0.0 108.219 169.148 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 33.8 t80 -63.28 158.67 19.64 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 118.653 0.661 . . . . 0.0 110.639 163.085 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -135.32 108.05 7.49 Favored 'General case' 0 CA--C 1.513 -0.465 0 C-N-CA 123.992 0.917 . . . . 0.0 109.375 160.158 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 1.9 pt-20 -61.34 -25.24 67.01 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 124.636 1.174 . . . . 0.0 112.675 177.912 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 1.4 t -62.73 -50.46 71.0 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 119.388 0.995 . . . . 0.0 109.587 -177.245 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 74.2 m -78.03 -47.76 17.69 Favored 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 124.651 1.18 . . . . 0.0 109.315 173.671 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 102.43 13.51 30.36 Favored Glycine 0 CA--C 1.53 1.027 0 C-N-CA 125.153 1.359 . . . . 0.0 111.004 -168.834 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 3.8 m-85 -111.53 178.28 4.38 Favored 'General case' 0 C--O 1.227 -0.129 0 C-N-CA 126.713 2.005 . . . . 0.0 109.347 -168.635 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 72.1 m-85 -117.13 156.28 27.89 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 108.521 -0.918 . . . . 0.0 108.521 170.889 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 42.3 t80 -114.33 134.95 54.6 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 127.213 2.205 . . . . 0.0 108.78 175.866 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 56.3 t0 -98.56 87.13 0.54 Allowed Pre-proline 0 C--O 1.237 0.404 0 C-N-CA 127.366 2.266 . . . . 0.0 110.381 -178.593 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 61.7 Cg_endo -62.28 -8.55 12.7 Favored 'Trans proline' 0 N--CA 1.457 -0.671 0 C-N-CA 122.085 1.857 . . . . 0.0 114.254 -178.565 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -74.14 -28.2 61.21 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 119.473 1.033 . . . . 0.0 110.703 178.907 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.593 HG21 ' CE2' ' A' ' 61' ' ' TYR . 0.1 OUTLIER -142.35 -22.78 0.68 Allowed 'General case' 0 C--O 1.238 0.48 0 C-N-CA 124.238 1.015 . . . . 0.0 113.317 -164.901 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 103.0 -3.41 48.32 Favored Glycine 0 N--CA 1.444 -0.784 0 C-N-CA 125.091 1.329 . . . . 0.0 112.841 169.593 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.512 HD21 ' HB ' ' A' ' 32' ' ' THR . 0.0 OUTLIER -74.86 173.86 10.02 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 118.807 1.304 . . . . 0.0 108.298 -178.721 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 37.2 m-85 -107.14 165.05 11.65 Favored 'General case' 0 C--N 1.321 -0.639 0 C-N-CA 124.389 1.075 . . . . 0.0 108.609 162.509 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 71.2 t80 -144.0 144.69 31.78 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 126.618 1.967 . . . . 0.0 108.092 -172.672 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -113.26 143.08 28.57 Favored Pre-proline 0 C--O 1.236 0.378 0 C-N-CA 124.952 1.301 . . . . 0.0 108.513 175.706 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 91.2 Cg_endo -77.64 -29.33 4.66 Favored 'Trans proline' 0 N--CA 1.456 -0.729 0 C-N-CA 121.917 1.744 . . . . 0.0 112.423 -178.519 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -73.97 -34.6 64.32 Favored 'General case' 0 C--O 1.234 0.279 0 C-N-CA 123.983 0.913 . . . . 0.0 110.734 174.488 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 1.1 m -131.64 93.5 3.34 Favored 'General case' 0 C--O 1.222 -0.381 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 -157.471 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 8.2 mp0 -64.88 6.68 0.21 Allowed 'General case' 0 CA--C 1.549 0.922 0 O-C-N 121.083 -1.011 . . . . 0.0 113.487 -178.013 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 24.3 m-85 -77.13 104.42 7.62 Favored 'General case' 0 C--O 1.235 0.333 0 O-C-N 120.626 -1.296 . . . . 0.0 108.668 166.893 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 29.0 m-85 -64.3 162.89 13.94 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 126.955 2.102 . . . . 0.0 110.784 179.727 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 64.2 t80 -120.25 110.25 16.36 Favored 'General case' 0 CA--C 1.521 -0.143 0 C-N-CA 125.934 1.694 . . . . 0.0 109.038 179.19 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 41.9 t30 -85.29 86.6 7.36 Favored 'General case' 0 C--N 1.32 -0.716 0 C-N-CA 125.082 1.353 . . . . 0.0 109.142 175.985 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -58.37 -15.55 11.07 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 125.401 1.48 . . . . 0.0 114.049 -176.356 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -54.63 -76.5 0.03 OUTLIER 'General case' 0 CA--C 1.528 0.111 0 C-N-CA 125.027 1.331 . . . . 0.0 108.923 170.475 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 10.3 m -94.59 13.69 23.35 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.243 0.617 . . . . 0.0 110.624 -174.342 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 49.4 mt-30 56.28 24.61 8.41 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 127.3 2.24 . . . . 0.0 112.802 -173.049 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -92.75 166.84 12.25 Favored 'General case' 0 CA--C 1.532 0.285 0 O-C-N 121.269 -0.894 . . . . 0.0 111.629 -167.103 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 4.8 m-85 -109.79 138.64 45.87 Favored 'General case' 0 N--CA 1.467 0.401 0 O-C-N 121.4 -0.812 . . . . 0.0 109.117 -179.996 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.42 HD23 ' HA ' ' A' ' 63' ' ' PRO . 32.8 mt -134.48 179.69 6.13 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 124.82 1.248 . . . . 0.0 110.294 -177.172 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 14.1 p90 -145.75 154.35 41.95 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 124.545 1.138 . . . . 0.0 109.113 161.019 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 53.7 t-105 -80.43 120.26 24.21 Favored 'General case' 0 C--O 1.24 0.558 0 N-CA-C 107.181 -1.415 . . . . 0.0 107.181 167.714 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 42.3 t0 -114.76 95.36 5.19 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 123.926 0.89 . . . . 0.0 108.975 174.552 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -66.67 -15.94 64.96 Favored Glycine 0 N--CA 1.444 -0.796 0 CA-C-O 117.492 -1.727 . . . . 0.0 112.564 174.244 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -64.54 -23.83 67.4 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 120.681 2.24 . . . . 0.0 109.551 171.324 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 4.5 mtt-85 -120.11 -2.3 10.22 Favored 'General case' 0 C--O 1.233 0.208 0 C-N-CA 126.062 1.745 . . . . 0.0 112.677 -177.537 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 81.3 mtp180 44.07 50.28 7.38 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 125.643 1.577 . . . . 0.0 110.607 -171.919 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 4.9 t -151.31 174.85 12.81 Favored 'General case' 0 N--CA 1.45 -0.437 0 O-C-N 121.691 -0.631 . . . . 0.0 110.49 179.399 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' TYR . . . . . 0.593 ' CE2' HG21 ' A' ' 32' ' ' THR . 97.4 m-85 -100.11 135.23 41.84 Favored 'General case' 0 C--O 1.238 0.467 0 N-CA-C 108.547 -0.909 . . . . 0.0 108.547 171.181 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -126.06 153.81 74.02 Favored Pre-proline 0 C--N 1.321 -0.645 0 C-N-CA 125.081 1.353 . . . . 0.0 107.431 -178.86 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 63' ' ' PRO . . . . . 0.42 ' HA ' HD23 ' A' ' 52' ' ' LEU . 88.2 Cg_endo -84.43 131.28 4.76 Favored 'Trans proline' 0 N--CA 1.457 -0.672 0 C-N-CA 122.257 1.971 . . . . 0.0 109.99 -177.591 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.497 0 N-CA-C 115.87 1.804 . . . . 0.0 115.87 -167.08 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 27.6 m-85 . . . . . 0 CA--C 1.54 0.586 0 N-CA-C 110.163 -0.31 . . . . 0.0 110.163 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -72.19 -173.12 1.01 Allowed 'Trans proline' 0 CA--C 1.534 0.482 0 C-N-CA 124.4 3.4 . . . . 0.0 110.415 166.82 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 61.1 t -113.56 85.66 9.38 Favored Pre-proline 0 CA--C 1.539 0.55 0 N-CA-C 106.204 -1.776 . . . . 0.0 106.204 172.739 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 69.7 Cg_endo -72.86 161.85 42.62 Favored 'Trans proline' 0 CA--C 1.539 0.751 0 C-N-CA 122.399 2.066 . . . . 0.0 110.572 -177.816 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -136.13 137.14 40.69 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 123.773 0.829 . . . . 0.0 110.627 -175.161 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.457 ' HA ' ' CD2' ' A' ' 18' ' ' TYR . 11.9 p -61.2 -22.01 26.21 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.664 0 N-CA-C 112.992 0.738 . . . . 0.0 112.992 179.479 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 3.0 t -68.98 8.35 0.55 Allowed 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 125.145 1.378 . . . . 0.0 112.586 171.748 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.3 t -126.3 4.85 7.02 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 120.598 1.545 . . . . 0.0 111.358 169.174 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' TYR . . . . . 0.457 ' CD2' ' HA ' ' A' ' 15' ' ' VAL . 16.0 m-30 -82.78 150.49 26.61 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 118.921 0.782 . . . . 0.0 109.719 179.768 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 37.2 mt-30 -95.42 103.92 15.8 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 127.17 2.188 . . . . 0.0 111.035 177.477 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 88.0 t80 -58.12 151.48 18.85 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 120.271 1.396 . . . . 0.0 110.376 -179.991 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -129.61 93.58 3.57 Favored 'General case' 0 CA--C 1.516 -0.354 0 N-CA-C 106.091 -1.818 . . . . 0.0 106.091 177.345 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 1.9 pt-20 -51.99 -33.09 36.52 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-O 118.528 -0.748 . . . . 0.0 112.291 176.487 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 1.3 t -68.82 -5.68 22.32 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 123.297 0.639 . . . . 0.0 111.645 -174.408 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 50.7 m -137.1 -12.91 1.64 Allowed 'General case' 0 CA--C 1.53 0.204 0 O-C-N 120.185 -1.572 . . . . 0.0 112.463 167.874 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 88.39 18.77 54.59 Favored Glycine 0 C--N 1.338 0.64 0 CA-C-N 118.983 0.81 . . . . 0.0 112.124 169.936 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 7.1 m-85 -125.04 175.16 7.53 Favored 'General case' 0 C--N 1.332 -0.195 0 C-N-CA 126.88 2.072 . . . . 0.0 108.122 -171.725 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 58.8 m-85 -99.26 135.35 40.8 Favored 'General case' 0 N--CA 1.448 -0.529 0 N-CA-C 106.892 -1.522 . . . . 0.0 106.892 176.114 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 25.3 t80 -99.41 141.24 32.46 Favored 'General case' 0 C--O 1.238 0.472 0 N-CA-C 107.047 -1.464 . . . . 0.0 107.047 168.026 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 29.5 m-20 -118.45 76.44 12.96 Favored Pre-proline 0 CA--C 1.535 0.389 0 N-CA-C 108.935 -0.765 . . . . 0.0 108.935 -159.088 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -65.05 -10.64 26.36 Favored 'Trans proline' 0 CA--C 1.534 0.486 0 C-N-CA 124.326 3.35 . . . . 0.0 114.722 -167.644 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 33.7 tt0 -76.58 -25.73 54.29 Favored 'General case' 0 CA--C 1.537 0.474 0 O-C-N 121.504 -0.747 . . . . 0.0 110.979 175.985 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.599 ' HB ' HD23 ' A' ' 34' ' ' LEU . 0.8 OUTLIER -136.34 -26.32 1.13 Allowed 'General case' 0 C--O 1.234 0.278 0 C-N-CA 124.215 1.006 . . . . 0.0 112.495 -165.642 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 108.12 -3.77 33.5 Favored Glycine 0 CA--C 1.527 0.811 0 C-N-CA 124.069 0.843 . . . . 0.0 115.074 169.924 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.599 HD23 ' HB ' ' A' ' 32' ' ' THR . 0.9 OUTLIER -84.36 -177.11 6.54 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 126.591 1.957 . . . . 0.0 109.975 -172.739 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 25.0 m-85 -115.95 139.04 50.63 Favored 'General case' 0 C--O 1.238 0.459 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 155.569 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 62.4 t80 -104.25 154.43 19.79 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 125.426 1.49 . . . . 0.0 108.246 178.911 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 37.0 t70 -127.4 143.57 47.76 Favored Pre-proline 0 N--CA 1.467 0.388 0 N-CA-C 112.157 0.428 . . . . 0.0 112.157 167.184 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -67.61 -31.01 34.16 Favored 'Trans proline' 0 N--CA 1.455 -0.771 0 C-N-CA 122.953 2.435 . . . . 0.0 114.205 -179.555 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 4.2 m-80 -87.19 -17.57 32.36 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 119.58 1.082 . . . . 0.0 111.626 172.692 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -138.85 81.57 1.85 Allowed 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 -162.52 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -60.5 5.91 0.04 OUTLIER 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.146 1.378 . . . . 0.0 113.709 177.171 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 24.3 m-85 -75.64 93.56 3.08 Favored 'General case' 0 N--CA 1.444 -0.74 0 C-N-CA 125.302 1.441 . . . . 0.0 107.766 171.598 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 43.8 m-85 -58.54 123.97 18.07 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 124.378 1.071 . . . . 0.0 108.675 -179.74 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 8.0 t80 -86.22 108.22 18.27 Favored 'General case' 0 N--CA 1.447 -0.609 0 C-N-CA 125.243 1.417 . . . . 0.0 107.219 -176.65 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 33.6 t30 -82.62 79.42 9.04 Favored 'General case' 0 N--CA 1.446 -0.655 0 N-CA-C 107.997 -1.112 . . . . 0.0 107.997 171.326 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -53.28 -33.12 51.92 Favored 'General case' 0 C--N 1.341 0.213 0 C-N-CA 123.553 0.741 . . . . 0.0 112.129 -178.783 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -44.3 -62.23 1.24 Allowed 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 128.261 2.625 . . . . 0.0 109.904 177.379 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.1 t -106.97 11.22 30.05 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.634 1.173 . . . . 0.0 110.578 -175.233 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 34.0 mt-30 46.98 40.81 9.98 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 127.011 2.125 . . . . 0.0 110.67 -176.433 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 17.4 mm-40 -103.95 159.73 15.41 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 126.238 1.815 . . . . 0.0 109.017 174.66 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -112.09 129.42 56.23 Favored 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 106.679 -1.6 . . . . 0.0 106.679 170.987 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.445 HD12 HD11 ' A' ' 34' ' ' LEU . 50.8 mt -118.4 177.51 4.79 Favored 'General case' 0 N--CA 1.442 -0.875 0 C-N-CA 126.124 1.769 . . . . 0.0 107.352 -179.748 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 14.0 p90 -141.71 154.2 45.15 Favored 'General case' 0 N--CA 1.441 -0.889 0 N-CA-C 106.786 -1.561 . . . . 0.0 106.786 158.751 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 20.3 t-105 -76.22 136.78 39.71 Favored 'General case' 0 N--CA 1.445 -0.687 0 N-CA-C 106.195 -1.78 . . . . 0.0 106.195 169.453 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 6.6 t0 -131.92 99.43 4.75 Favored 'General case' 0 CA--C 1.507 -0.695 0 CA-C-O 122.442 1.115 . . . . 0.0 109.719 175.102 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -65.89 -8.26 40.6 Favored Glycine 0 N--CA 1.442 -0.913 0 CA-C-O 117.256 -1.858 . . . . 0.0 113.221 -174.449 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' GLU . . . . . 0.464 ' HG3' ' H ' ' A' ' 58' ' ' ARG . 1.8 pt-20 -72.67 -64.82 0.88 Allowed 'General case' 0 C--N 1.338 0.108 0 CA-C-N 120.363 2.082 . . . . 0.0 107.47 177.342 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 58' ' ' ARG . . . . . 0.464 ' H ' ' HG3' ' A' ' 57' ' ' GLU . 82.3 mtt180 -74.85 -7.12 52.5 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 125.181 1.392 . . . . 0.0 111.817 179.059 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 90.5 mtt180 44.79 56.25 5.39 Favored 'General case' 0 C--O 1.231 0.128 0 C-N-CA 126.51 1.924 . . . . 0.0 110.55 -172.595 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 7.4 t -146.62 164.0 34.05 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 109.217 -0.66 . . . . 0.0 109.217 167.781 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 27.4 m-85 -81.66 135.93 35.52 Favored 'General case' 0 C--O 1.237 0.426 0 N-CA-C 107.216 -1.402 . . . . 0.0 107.216 166.877 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -126.01 154.77 73.93 Favored Pre-proline 0 C--N 1.323 -0.587 0 C-N-CA 125.806 1.642 . . . . 0.0 108.863 176.585 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -67.98 135.67 35.75 Favored 'Trans proline' 0 N--CA 1.451 -1.012 0 C-N-CA 121.949 1.766 . . . . 0.0 109.715 171.791 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.463 0.187 0 C-N-CA 124.154 0.982 . . . . 0.0 112.698 -178.316 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 51.7 m-85 . . . . . 0 C--O 1.239 0.514 0 N-CA-C 109.43 -0.581 . . . . 0.0 109.43 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -70.62 -175.12 1.25 Allowed 'Trans proline' 0 CA--C 1.537 0.646 0 C-N-CA 124.489 3.459 . . . . 0.0 111.239 167.277 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 38.8 t -104.97 88.12 2.21 Favored Pre-proline 0 CA--C 1.543 0.709 0 C-N-CA 125.991 1.717 . . . . 0.0 109.478 -178.744 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 19.8 Cg_endo -70.55 173.66 11.35 Favored 'Trans proline' 0 CA--C 1.546 1.079 0 C-N-CA 123.087 2.525 . . . . 0.0 110.856 173.549 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -156.62 133.61 10.4 Favored 'General case' 0 N--CA 1.468 0.439 0 O-C-N 121.272 -0.893 . . . . 0.0 110.053 171.932 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.439 ' HA ' ' CD2' ' A' ' 18' ' ' TYR . 12.5 p -54.24 -25.14 12.97 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.42 0 N-CA-C 113.604 0.964 . . . . 0.0 113.604 177.928 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 14.0 m -62.02 -14.07 32.08 Favored 'General case' 0 C--O 1.237 0.406 0 O-C-N 120.943 -1.098 . . . . 0.0 112.96 179.987 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 5.5 t -120.55 9.94 10.98 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 124.012 0.925 . . . . 0.0 111.85 176.187 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' TYR . . . . . 0.439 ' CD2' ' HA ' ' A' ' 15' ' ' VAL . 17.0 m-30 -73.4 152.6 40.76 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-N 119.708 1.14 . . . . 0.0 109.719 168.858 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 51.6 mt-30 -87.38 115.58 24.9 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 108.529 -0.915 . . . . 0.0 108.529 174.236 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 85.4 t80 -66.32 147.89 52.65 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 118.224 0.465 . . . . 0.0 110.233 168.693 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -119.13 112.58 19.7 Favored 'General case' 0 N--CA 1.442 -0.871 0 C-N-CA 127.681 2.393 . . . . 0.0 106.517 177.829 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -81.6 -15.85 53.39 Favored 'General case' 0 CA--C 1.533 0.314 0 O-C-N 121.396 -0.815 . . . . 0.0 113.087 178.178 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 5.2 t -67.09 -31.77 72.49 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.533 1.133 . . . . 0.0 111.335 179.619 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 69.2 m -128.26 -26.16 2.86 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 119.883 1.22 . . . . 0.0 112.889 171.386 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 104.24 25.3 7.12 Favored Glycine 0 CA--C 1.527 0.806 0 CA-C-O 117.889 -1.506 . . . . 0.0 113.674 172.651 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 2.7 m-85 -110.91 -179.58 3.78 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 120.206 2.003 . . . . 0.0 108.821 -179.84 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 68.2 m-85 -120.88 123.35 42.33 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 124.636 1.174 . . . . 0.0 108.239 178.055 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 23.5 t80 -91.14 134.77 34.26 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 125.571 1.548 . . . . 0.0 110.76 -179.642 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 12.6 t0 -101.11 88.06 0.99 Allowed Pre-proline 0 CA--C 1.533 0.319 0 C-N-CA 128.034 2.534 . . . . 0.0 112.429 178.543 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -64.81 -6.84 13.33 Favored 'Trans proline' 0 CA--C 1.533 0.47 0 C-N-CA 121.656 1.571 . . . . 0.0 115.332 172.002 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 3.3 tm0? -64.92 -52.03 58.66 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 119.852 1.206 . . . . 0.0 108.297 176.032 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 77.7 p -99.97 -51.96 3.56 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-N 118.295 0.498 . . . . 0.0 111.081 174.461 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 125.98 5.82 6.13 Favored Glycine 0 CA--C 1.535 1.341 0 C-N-CA 126.818 2.151 . . . . 0.0 112.135 -166.257 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 84.5 mt -74.21 174.36 8.86 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 119.126 1.463 . . . . 0.0 110.935 176.476 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 27.0 m-85 -120.38 169.77 9.99 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 125.902 1.681 . . . . 0.0 108.294 161.604 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 28.3 t80 -145.52 153.57 41.26 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 128.913 2.885 . . . . 0.0 107.67 -174.935 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 8.9 t0 -121.32 142.51 35.42 Favored Pre-proline 0 CA--C 1.532 0.267 0 C-N-CA 124.968 1.307 . . . . 0.0 107.89 179.419 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -74.74 -32.95 5.37 Favored 'Trans proline' 0 N--CA 1.453 -0.887 0 C-N-CA 121.635 1.557 . . . . 0.0 115.279 -174.101 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -73.32 -35.6 66.08 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 120.508 1.503 . . . . 0.0 108.45 172.072 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 69.4 m -126.43 93.52 3.82 Favored 'General case' 0 N--CA 1.449 -0.494 0 C-N-CA 123.493 0.717 . . . . 0.0 110.246 -157.349 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 25.6 mp0 -55.72 -0.92 0.04 OUTLIER 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 127.34 2.256 . . . . 0.0 114.597 179.531 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 49.3 m-85 -70.9 106.19 3.53 Favored 'General case' 0 N--CA 1.442 -0.839 0 C-N-CA 125.595 1.558 . . . . 0.0 108.194 170.351 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 40.7 m-85 -65.75 153.82 40.72 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 125.613 1.565 . . . . 0.0 109.972 179.01 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 74.9 t80 -108.58 133.95 52.01 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 125.668 1.587 . . . . 0.0 107.983 175.41 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 43.1 t30 -110.8 73.9 0.85 Allowed 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 128.944 2.898 . . . . 0.0 109.619 -173.305 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -49.53 -26.4 3.44 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 125.651 1.58 . . . . 0.0 114.036 -172.014 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 3.1 tt0 -53.95 -31.18 49.62 Favored 'General case' 0 N--CA 1.446 -0.656 0 C-N-CA 128.989 2.915 . . . . 0.0 113.315 174.858 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 4.1 m -143.9 9.6 1.52 Allowed 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 124.894 1.277 . . . . 0.0 111.479 -168.537 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 52.0 mt-30 47.39 30.43 1.57 Allowed 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 126.415 1.886 . . . . 0.0 113.623 -173.907 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -104.22 161.48 14.0 Favored 'General case' 0 C--O 1.233 0.213 0 C-N-CA 125.083 1.353 . . . . 0.0 112.653 -175.995 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -103.26 134.86 45.95 Favored 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 124.7 1.2 . . . . 0.0 110.783 178.336 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 53.8 mt -133.34 179.8 5.98 Favored 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 125.943 1.697 . . . . 0.0 109.193 -177.091 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 14.1 p90 -148.52 155.21 40.85 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 125.103 1.361 . . . . 0.0 108.684 164.518 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 68.9 t-105 -77.42 119.29 20.83 Favored 'General case' 0 C--O 1.233 0.232 0 N-CA-C 107.333 -1.358 . . . . 0.0 107.333 167.878 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 39.7 t0 -98.68 94.44 6.64 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 107.88 -1.155 . . . . 0.0 107.88 167.505 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -62.7 -14.98 53.27 Favored Glycine 0 CA--C 1.531 1.091 0 CA-C-O 119.081 -0.844 . . . . 0.0 113.394 178.13 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -74.6 -17.29 60.74 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 119.228 1.514 . . . . 0.0 110.667 174.941 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 83.9 mtt85 -123.34 -4.49 8.35 Favored 'General case' 0 C--O 1.223 -0.299 0 C-N-CA 125.342 1.457 . . . . 0.0 111.799 178.711 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 97.2 mtt180 44.34 59.36 3.31 Favored 'General case' 0 C--O 1.233 0.209 0 C-N-CA 125.389 1.476 . . . . 0.0 110.335 -173.096 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 5.8 t -152.95 173.67 15.1 Favored 'General case' 0 N--CA 1.448 -0.551 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 177.681 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 82.2 m-85 -104.96 134.34 48.23 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 107.624 -1.25 . . . . 0.0 107.624 173.185 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -126.12 154.6 74.21 Favored Pre-proline 0 C--N 1.324 -0.527 0 C-N-CA 125.327 1.451 . . . . 0.0 109.492 -178.223 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -74.16 125.68 9.95 Favored 'Trans proline' 0 N--CA 1.458 -0.581 0 C-N-CA 123.413 2.742 . . . . 0.0 111.08 -178.916 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.463 0.187 0 N-CA-C 114.607 1.336 . . . . 0.0 114.607 -173.25 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 82.0 m-85 . . . . . 0 CA--C 1.543 0.706 0 CA-C-O 119.572 -0.251 . . . . 0.0 110.865 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_endo -72.71 -167.44 0.34 Allowed 'Trans proline' 0 CA--C 1.536 0.578 0 C-N-CA 123.991 3.128 . . . . 0.0 109.891 166.255 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 43.2 t -106.99 86.5 2.43 Favored Pre-proline 0 CA--C 1.541 0.634 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 174.016 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 91.8 Cg_endo -65.08 164.6 24.51 Favored 'Trans proline' 0 CA--C 1.536 0.604 0 C-N-CA 123.577 2.852 . . . . 0.0 110.252 178.205 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -152.94 142.97 22.28 Favored 'General case' 0 N--CA 1.475 0.776 0 O-C-N 120.608 -1.307 . . . . 0.0 113.236 -179.64 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 14.4 p -60.13 -19.82 18.75 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.287 0 C-N-CA 124.906 1.282 . . . . 0.0 112.885 171.494 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.4 t -57.59 -5.59 0.38 Allowed 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 124.632 1.173 . . . . 0.0 113.079 170.267 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.4 t -137.11 12.67 3.07 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-N 119.617 1.099 . . . . 0.0 113.74 176.468 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 16.4 m-30 -72.42 164.18 26.78 Favored 'General case' 0 C--O 1.236 0.363 0 O-C-N 120.476 -1.39 . . . . 0.0 111.295 175.028 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 19.2 mt-30 -108.08 129.22 55.16 Favored 'General case' 0 CA--C 1.519 -0.217 0 C-N-CA 125.179 1.392 . . . . 0.0 108.794 169.726 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 49.8 t80 -77.94 150.71 33.97 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 118.357 0.526 . . . . 0.0 110.073 170.017 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -128.58 88.08 2.68 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 107.504 -1.295 . . . . 0.0 107.504 173.846 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.7 pt-20 -52.77 -19.89 2.8 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 127.831 2.452 . . . . 0.0 113.589 175.057 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 6.7 t -51.33 -36.72 44.15 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 124.137 0.975 . . . . 0.0 111.413 168.344 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 54.3 m -138.61 -8.07 1.46 Allowed 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 124.7 1.2 . . . . 0.0 113.834 -178.05 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 88.47 19.96 50.2 Favored Glycine 0 CA--C 1.528 0.859 0 O-C-N 120.198 -1.564 . . . . 0.0 113.723 167.798 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 32.7 m-85 -110.37 174.88 5.65 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 125.673 1.589 . . . . 0.0 109.381 -179.025 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 83.8 m-85 -120.56 151.45 39.4 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 124.675 1.19 . . . . 0.0 109.098 177.117 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 55.3 t80 -125.6 137.08 53.88 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 125.412 1.485 . . . . 0.0 110.715 -175.511 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -97.75 88.74 0.65 Allowed Pre-proline 0 N--CA 1.463 0.182 0 C-N-CA 128.088 2.555 . . . . 0.0 112.418 -179.817 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo -58.09 -10.51 8.2 Favored 'Trans proline' 0 CA--C 1.536 0.614 0 CA-C-N 121.19 1.461 . . . . 0.0 115.012 175.265 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -66.81 -41.55 87.38 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 120.058 1.299 . . . . 0.0 109.786 176.295 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 22.4 p -137.34 -11.09 1.66 Allowed 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 116.156 1.909 . . . . 0.0 116.156 -173.819 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 95.14 6.68 60.04 Favored Glycine 0 CA--C 1.528 0.904 0 O-C-N 121.21 -0.931 . . . . 0.0 113.329 171.921 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 15.2 mt -82.1 163.15 22.21 Favored 'General case' 0 C--O 1.237 0.426 0 CA-C-N 118.169 0.985 . . . . 0.0 109.196 174.901 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 57.6 m-85 -108.9 157.44 18.62 Favored 'General case' 0 C--O 1.234 0.274 0 C-N-CA 123.141 0.576 . . . . 0.0 109.954 171.07 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 56.0 t80 -127.93 151.37 49.19 Favored 'General case' 0 C--O 1.238 0.448 0 C-N-CA 128.918 2.887 . . . . 0.0 107.865 -178.995 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -130.14 144.02 51.47 Favored Pre-proline 0 C--N 1.331 -0.213 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 173.345 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -64.99 -24.43 60.28 Favored 'Trans proline' 0 N--CA 1.455 -0.769 0 C-N-CA 122.539 2.159 . . . . 0.0 114.038 -175.427 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 17.7 m-80 -104.07 -19.04 14.31 Favored 'General case' 0 C--O 1.237 0.417 0 C-N-CA 123.721 0.808 . . . . 0.0 112.002 176.527 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 33.6 t -120.77 84.52 2.24 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 125.278 1.431 . . . . 0.0 109.163 177.63 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 24.9 mp0 -58.61 -8.16 1.18 Allowed 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 124.459 1.104 . . . . 0.0 111.657 162.443 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 26.8 m-85 -70.3 99.56 1.57 Allowed 'General case' 0 N--CA 1.45 -0.452 0 N-CA-C 107.357 -1.349 . . . . 0.0 107.357 164.732 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 54.3 m-85 -59.92 146.4 42.43 Favored 'General case' 0 C--O 1.237 0.432 0 C-N-CA 125.877 1.671 . . . . 0.0 109.974 -174.722 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 73.9 t80 -96.81 118.77 33.97 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-O 122.417 1.103 . . . . 0.0 109.748 173.634 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' ASN . . . . . 0.402 ' HB3' ' HG2' ' A' ' 50' ' ' GLN . 21.0 t-20 -88.07 79.57 7.92 Favored 'General case' 0 N--CA 1.443 -0.806 0 C-N-CA 127.108 2.163 . . . . 0.0 107.557 -179.273 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -53.64 -32.65 52.29 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 123.684 0.794 . . . . 0.0 111.034 177.652 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.7 tt0 -51.01 -28.09 9.26 Favored 'General case' 0 N--CA 1.449 -0.496 0 C-N-CA 127.454 2.302 . . . . 0.0 114.365 -176.8 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -144.95 4.75 1.12 Allowed 'General case' 0 CA--C 1.535 0.39 0 N-CA-C 112.697 0.629 . . . . 0.0 112.697 174.692 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 26.8 mt-30 68.16 60.68 0.41 Allowed 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 125.968 1.707 . . . . 0.0 109.997 -177.461 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.402 ' HG2' ' HB3' ' A' ' 45' ' ' ASN . 0.0 OUTLIER -124.89 168.18 13.64 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 125.929 1.692 . . . . 0.0 114.871 174.715 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 4.4 m-85 -107.14 149.82 27.25 Favored 'General case' 0 C--O 1.233 0.202 0 N-CA-C 107.898 -1.149 . . . . 0.0 107.898 162.246 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 90.9 mt -145.99 -176.78 5.28 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 127.279 2.232 . . . . 0.0 107.025 -178.607 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 4.4 p90 -127.68 179.81 5.33 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 125.165 1.386 . . . . 0.0 108.278 162.726 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 27.5 t-105 -105.08 135.71 45.91 Favored 'General case' 0 C--O 1.238 0.499 0 N-CA-C 105.055 -2.202 . . . . 0.0 105.055 160.685 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -124.01 115.97 22.08 Favored 'General case' 0 N--CA 1.446 -0.628 0 C-N-CA 124.742 1.217 . . . . 0.0 108.013 177.886 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -77.27 -15.93 81.04 Favored Glycine 0 N--CA 1.445 -0.758 0 CA-C-O 117.407 -1.774 . . . . 0.0 112.361 177.316 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -65.7 -47.85 74.0 Favored 'General case' 0 C--N 1.345 0.388 0 CA-C-N 121.308 2.554 . . . . 0.0 108.241 -177.167 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 5.4 mtt85 -102.19 5.0 39.98 Favored 'General case' 0 CA--C 1.529 0.149 0 C-N-CA 125.805 1.642 . . . . 0.0 111.293 -179.051 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 3.2 mtt180 44.78 60.34 2.97 Favored 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 126.601 1.96 . . . . 0.0 109.798 -178.174 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 5.5 t -149.85 173.05 14.19 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-O 121.763 0.792 . . . . 0.0 110.193 -168.551 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 82.2 m-85 -113.74 116.39 29.33 Favored 'General case' 0 C--O 1.234 0.283 0 C-N-CA 124.906 1.283 . . . . 0.0 108.246 172.802 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -125.58 158.98 62.86 Favored Pre-proline 0 C--N 1.327 -0.382 0 C-N-CA 126.831 2.052 . . . . 0.0 110.409 -168.941 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -72.89 124.14 9.44 Favored 'Trans proline' 0 N--CA 1.458 -0.602 0 C-N-CA 122.931 2.421 . . . . 0.0 111.924 -175.986 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.245 0 C-N-CA 123.737 0.815 . . . . 0.0 112.713 179.855 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.463 0.452 0 N-CA-C 109.824 -1.31 . . . . 0.0 109.824 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 2.8 p-80 -144.8 4.38 1.13 Allowed 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 125.011 1.324 . . . . 0.0 111.792 -175.571 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 6.5 mtm -117.34 175.62 5.53 Favored 'General case' 0 C--O 1.234 0.244 0 C-N-CA 125.101 1.36 . . . . 0.0 108.939 174.572 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 36.6 tt0 46.79 81.61 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 127.521 2.329 . . . . 0.0 111.767 -171.038 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 8.1 tt0 -70.07 -17.82 63.25 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-O 118.079 -0.963 . . . . 0.0 112.702 175.525 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 73.2 m 59.3 93.21 0.04 OUTLIER 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.816 1.247 . . . . 0.0 113.277 172.063 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 25.7 p90 -118.56 -169.07 1.65 Allowed 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 126.084 1.754 . . . . 0.0 109.965 -175.056 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 46.4 m 58.87 76.4 0.35 Allowed 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 125.445 1.498 . . . . 0.0 113.019 177.525 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -142.41 -171.25 3.36 Favored 'General case' 0 N--CA 1.445 -0.687 0 C-N-CA 125.425 1.49 . . . . 0.0 110.442 -178.795 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 17.7 m-85 -111.71 166.7 10.35 Favored Pre-proline 0 CA--C 1.54 0.59 0 C-N-CA 127.558 2.343 . . . . 0.0 108.919 -176.138 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 96.2 Cg_endo -65.36 -176.06 0.48 Allowed 'Trans proline' 0 CA--C 1.537 0.644 0 C-N-CA 123.623 2.882 . . . . 0.0 111.594 169.404 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 48.8 t -113.95 85.82 10.4 Favored Pre-proline 0 CA--C 1.541 0.609 0 N-CA-C 106.987 -1.486 . . . . 0.0 106.987 178.09 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -67.0 175.53 5.47 Favored 'Trans proline' 0 C--N 1.35 0.614 0 C-N-CA 123.39 2.726 . . . . 0.0 112.121 -176.881 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 63.3 t0 -142.46 125.23 15.99 Favored 'General case' 0 C--O 1.237 0.445 0 N-CA-C 105.154 -2.165 . . . . 0.0 105.154 166.429 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 5.3 p -55.33 -23.05 13.0 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.433 0 C-N-CA 123.816 0.846 . . . . 0.0 111.499 175.531 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 31.6 t -67.65 2.29 1.96 Allowed 'General case' 0 CA--C 1.54 0.573 0 O-C-N 120.895 -1.128 . . . . 0.0 112.248 175.565 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 47.3 p -114.65 3.22 14.72 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 125.272 1.429 . . . . 0.0 110.878 174.608 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 14.7 m-30 -85.57 175.79 8.58 Favored 'General case' 0 C--O 1.236 0.391 0 O-C-N 121.03 -1.044 . . . . 0.0 109.579 -179.362 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 15.7 mt-30 -120.14 114.27 21.7 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 124.271 1.029 . . . . 0.0 110.119 -178.348 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 69.0 t80 -72.79 135.74 45.31 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 123.344 0.658 . . . . 0.0 110.407 175.116 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -118.98 75.81 1.06 Allowed 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 125.421 1.488 . . . . 0.0 108.649 -173.543 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -56.52 -19.49 15.82 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 125.343 1.457 . . . . 0.0 114.662 -167.528 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 1.3 t -54.67 -30.76 56.32 Favored 'General case' 0 CA--C 1.554 1.111 0 C-N-CA 124.705 1.202 . . . . 0.0 110.234 170.427 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 47.1 m -132.12 -16.94 2.77 Favored 'General case' 0 C--N 1.346 0.439 0 N-CA-C 115.61 1.707 . . . . 0.0 115.61 -178.854 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 99.78 2.39 56.25 Favored Glycine 0 CA--C 1.535 1.326 0 CA-C-N 120.865 1.666 . . . . 0.0 114.297 172.223 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 80.4 m-85 -95.32 169.3 10.17 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 125.106 1.363 . . . . 0.0 110.657 178.083 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 71.3 m-85 -102.09 151.91 21.6 Favored 'General case' 0 N--CA 1.453 -0.319 0 N-CA-C 106.335 -1.728 . . . . 0.0 106.335 160.411 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 40.6 t80 -115.68 140.4 49.23 Favored 'General case' 0 C--O 1.241 0.625 0 C-N-CA 125.926 1.69 . . . . 0.0 107.457 175.525 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -121.96 76.34 39.65 Favored Pre-proline 0 N--CA 1.444 -0.763 0 N-CA-C 106.636 -1.616 . . . . 0.0 106.636 -158.561 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 27.2 Cg_endo -60.9 -19.49 62.53 Favored 'Trans proline' 0 CA--C 1.537 0.665 0 C-N-CA 122.415 2.077 . . . . 0.0 114.353 -168.536 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 14.8 tt0 -68.09 -22.79 64.9 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.539 1.135 . . . . 0.0 111.33 178.956 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.492 ' CB ' HD22 ' A' ' 34' ' ' LEU . 0.5 OUTLIER -116.13 -58.21 2.12 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 127.725 2.41 . . . . 0.0 107.091 -178.309 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 113.88 -7.59 23.71 Favored Glycine 0 CA--C 1.53 1.005 0 C-N-CA 127.443 2.449 . . . . 0.0 110.861 -169.992 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.492 HD22 ' CB ' ' A' ' 32' ' ' THR . 0.0 OUTLIER -59.5 168.71 1.49 Allowed 'General case' 0 N--CA 1.434 -1.237 0 C-N-CA 129.118 2.967 . . . . 0.0 111.086 170.95 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 63.4 m-85 -116.1 140.46 49.26 Favored 'General case' 0 C--O 1.238 0.478 0 CA-C-N 114.45 -1.25 . . . . 0.0 108.658 158.934 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 58.6 t80 -105.41 153.9 21.04 Favored 'General case' 0 C--N 1.325 -0.493 0 C-N-CA 125.387 1.475 . . . . 0.0 108.093 171.345 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 6.9 t0 -119.76 142.77 33.64 Favored Pre-proline 0 C--N 1.329 -0.31 0 N-CA-C 105.898 -1.89 . . . . 0.0 105.898 171.255 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -73.48 -28.68 11.84 Favored 'Trans proline' 0 N--CA 1.455 -0.779 0 C-N-CA 121.369 1.38 . . . . 0.0 113.01 -174.35 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 52.3 m-80 -95.24 -25.41 16.37 Favored 'General case' 0 N--CA 1.448 -0.528 0 C-N-CA 125.986 1.714 . . . . 0.0 110.467 -177.603 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 4.1 m -121.03 95.65 4.78 Favored 'General case' 0 C--O 1.223 -0.317 0 C-N-CA 124.536 1.135 . . . . 0.0 108.733 -178.654 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 20.7 mp0 -64.06 1.15 0.74 Allowed 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 125.665 1.586 . . . . 0.0 114.121 179.417 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 26.4 m-85 -77.29 109.04 10.86 Favored 'General case' 0 C--O 1.234 0.26 0 C-N-CA 126.024 1.73 . . . . 0.0 108.97 169.657 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 18.8 m-85 -67.23 157.38 33.97 Favored 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 125.472 1.509 . . . . 0.0 109.442 179.872 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' TYR . . . . . 0.425 ' CZ ' ' HA ' ' A' ' 46' ' ' ALA . 7.8 t80 -118.86 105.17 11.24 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 125.443 1.497 . . . . 0.0 107.885 178.875 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 30.1 t30 -79.25 92.18 5.09 Favored 'General case' 0 N--CA 1.445 -0.7 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 168.152 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.425 ' HA ' ' CZ ' ' A' ' 44' ' ' TYR . . . -56.54 -35.18 67.81 Favored 'General case' 0 N--CA 1.456 -0.144 0 C-N-CA 124.046 0.938 . . . . 0.0 112.482 179.743 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -45.76 -55.78 6.11 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 126.157 1.783 . . . . 0.0 111.606 -176.941 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.9 m -109.99 -1.84 17.42 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 123.736 0.814 . . . . 0.0 111.36 -172.827 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 40.9 mt-30 50.46 60.59 3.74 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 126.302 1.841 . . . . 0.0 109.442 -163.741 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -106.85 149.29 27.57 Favored 'General case' 0 C--O 1.233 0.198 0 N-CA-C 107.992 -1.114 . . . . 0.0 107.992 167.237 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 3.8 m-85 -104.79 131.03 52.75 Favored 'General case' 0 CA--C 1.515 -0.397 0 N-CA-C 105.475 -2.046 . . . . 0.0 105.475 168.498 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.403 HD23 ' HA ' ' A' ' 63' ' ' PRO . 49.9 mt -127.08 177.89 6.36 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 125.521 1.528 . . . . 0.0 108.164 -171.709 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 26.1 p90 -142.94 156.3 44.86 Favored 'General case' 0 N--CA 1.447 -0.618 0 N-CA-C 108.845 -0.798 . . . . 0.0 108.845 160.89 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 26.6 t-105 -82.52 118.95 23.63 Favored 'General case' 0 N--CA 1.448 -0.562 0 N-CA-C 106.937 -1.505 . . . . 0.0 106.937 171.288 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 20.9 t0 -109.39 93.58 4.58 Favored 'General case' 0 CA--C 1.516 -0.365 0 N-CA-C 107.918 -1.141 . . . . 0.0 107.918 171.966 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -62.89 -12.4 42.29 Favored Glycine 0 CA--C 1.53 1.029 0 CA-C-O 117.947 -1.474 . . . . 0.0 113.641 179.846 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 11.7 mt-10 -75.77 -32.95 60.14 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 121.228 2.514 . . . . 0.0 109.363 173.911 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 51.0 mtt85 -104.43 -5.06 22.02 Favored 'General case' 0 CA--C 1.529 0.137 0 C-N-CA 125.201 1.4 . . . . 0.0 111.727 -177.807 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 38.9 mtp180 44.28 43.75 6.16 Favored 'General case' 0 CA--C 1.514 -0.436 0 C-N-CA 128.604 2.762 . . . . 0.0 110.836 178.978 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 4.9 t -145.43 172.18 13.57 Favored 'General case' 0 N--CA 1.444 -0.737 0 N-CA-C 106.573 -1.639 . . . . 0.0 106.573 177.874 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 71.0 m-85 -94.58 140.42 29.88 Favored 'General case' 0 C--O 1.242 0.71 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 170.992 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -125.79 154.45 73.35 Favored Pre-proline 0 C--N 1.321 -0.661 0 C-N-CA 126.161 1.784 . . . . 0.0 107.182 173.124 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.403 ' HA ' HD23 ' A' ' 52' ' ' LEU . 39.9 Cg_endo -68.33 145.52 65.96 Favored 'Trans proline' 0 N--CA 1.45 -1.081 0 C-N-CA 122.132 1.888 . . . . 0.0 109.62 172.974 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -106.19 30.8 5.61 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 124.207 1.003 . . . . 0.0 111.411 173.872 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 5.9 mp -80.7 99.85 8.4 Favored 'General case' 0 C--N 1.332 -0.184 0 O-C-N 121.073 -1.017 . . . . 0.0 108.371 179.311 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 67.68 154.7 0.1 Allowed 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 126.769 2.028 . . . . 0.0 111.989 175.919 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 5.2 mt-30 -163.65 164.47 23.97 Favored 'General case' 0 C--N 1.316 -0.873 0 C-N-CA 128.529 2.732 . . . . 0.0 110.91 -176.265 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 45.09 77.23 0.08 Allowed 'General case' 0 C--O 1.236 0.373 0 C-N-CA 126.763 2.025 . . . . 0.0 110.946 174.398 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -61.74 80.12 0.02 OUTLIER 'General case' 0 C--O 1.233 0.198 0 C-N-CA 126.979 2.112 . . . . 0.0 112.047 -168.728 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 -131.56 -6.92 3.69 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 128.045 2.538 . . . . 0.0 109.919 168.291 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -112.31 -86.65 1.61 Allowed Glycine 0 C--N 1.339 0.718 0 N-CA-C 108.306 -1.918 . . . . 0.0 108.306 171.643 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 6.9 t-160 49.53 35.1 7.75 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 125.042 1.337 . . . . 0.0 111.904 -166.388 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 3.1 mmmt -129.44 6.21 5.24 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 124.816 1.246 . . . . 0.0 112.599 -171.982 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -149.74 -171.53 3.92 Favored 'General case' 0 C--N 1.324 -0.523 0 C-N-CA 129.512 3.125 . . . . 0.0 106.406 171.703 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -57.81 -41.56 82.45 Favored 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 125.572 1.549 . . . . 0.0 113.348 167.684 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -117.06 179.28 17.43 Favored Glycine 0 N--CA 1.443 -0.862 0 N-CA-C 108.477 -1.849 . . . . 0.0 108.477 -176.794 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -121.4 79.44 36.91 Favored Pre-proline 0 CA--C 1.54 0.582 0 C-N-CA 122.812 0.445 . . . . 0.0 110.148 -171.617 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 67.3 Cg_endo -67.01 -4.35 11.31 Favored 'Trans proline' 0 CA--C 1.541 0.861 0 C-N-CA 125.195 3.93 . . . . 0.0 114.897 -172.211 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -77.76 13.76 1.25 Allowed 'General case' 0 C--N 1.327 -0.413 0 C-N-CA 127.368 2.267 . . . . 0.0 114.969 -165.288 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 6.1 mtpm? -98.2 -8.02 28.21 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 120.199 1.363 . . . . 0.0 112.073 177.468 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 9.8 tt0 -69.33 -21.92 63.8 Favored 'General case' 0 C--O 1.233 0.223 0 N-CA-C 113.261 0.837 . . . . 0.0 113.261 -166.354 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 106.42 -19.2 37.28 Favored Glycine 0 CA--C 1.524 0.651 0 C-N-CA 124.654 1.121 . . . . 0.0 113.401 -176.847 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 25.2 mttp -91.74 -51.65 5.13 Favored 'General case' 0 C--O 1.218 -0.576 0 CA-C-N 119.019 1.41 . . . . 0.0 108.131 167.967 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . 0.308 11.5 pt-20 56.59 -74.49 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 117.309 2.337 . . . . 0.0 117.309 154.694 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 20.8 mmmt -118.79 14.62 13.42 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 125.675 1.59 . . . . 0.0 111.846 174.335 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 60.57 176.38 0.1 Allowed 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 131.035 3.734 . . . . 0.0 111.313 -162.882 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -49.47 -34.75 17.7 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 125.842 1.657 . . . . 0.0 112.513 -178.35 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 54.38 -152.33 0.33 Allowed 'General case' 0 CA--C 1.538 0.481 0 N-CA-C 108.26 -1.015 . . . . 0.0 108.26 -179.872 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 30.1 m170 56.2 9.33 0.49 Allowed 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 119.882 3.29 . . . . 0.0 119.882 146.949 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 13.5 tptt 70.25 -164.58 0.16 Allowed 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 121.071 1.76 . . . . 0.0 108.046 -167.603 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 9.1 m -115.26 24.73 11.4 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 124.512 1.125 . . . . 0.0 108.484 -176.542 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 11.9 mptt . . . . . 0 C--O 1.255 1.379 0 C-N-CA 125.659 1.584 . . . . 0.0 107.779 -133.461 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 0.986 0 N-CA-C 109.683 -1.367 . . . . 0.0 109.683 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 12.4 p-80 -100.91 13.32 35.49 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-N 119.425 1.613 . . . . 0.0 111.296 176.351 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 83.0 mtp -142.45 114.27 8.06 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 127.889 2.475 . . . . 0.0 105.605 178.959 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -158.48 66.35 0.44 Allowed 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 125.428 1.491 . . . . 0.0 107.926 167.364 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 -128.04 -6.98 5.46 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.384 -179.136 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 46.0 m 53.35 32.34 13.57 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 112.488 0.551 . . . . 0.0 112.488 -179.699 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 3.0 p90 -61.53 -14.92 33.51 Favored 'General case' 0 CA--C 1.539 0.54 0 O-C-N 121.178 -0.951 . . . . 0.0 112.665 178.268 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 6.3 t -107.19 122.58 46.8 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 126.486 1.915 . . . . 0.0 109.426 177.967 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -68.4 -62.33 1.44 Allowed 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 123.376 0.671 . . . . 0.0 109.257 165.414 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 28.5 m-85 -108.84 165.01 13.44 Favored Pre-proline 0 C--O 1.239 0.544 0 C-N-CA 124.054 0.942 . . . . 0.0 111.49 -168.237 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 68.5 Cg_endo -74.51 -178.98 4.38 Favored 'Trans proline' 0 C--N 1.349 0.586 0 C-N-CA 122.957 2.438 . . . . 0.0 110.207 171.896 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 25.0 t -104.73 86.46 1.46 Allowed Pre-proline 0 CA--C 1.538 0.506 0 N-CA-C 106.05 -1.833 . . . . 0.0 106.05 176.422 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -68.67 170.62 14.81 Favored 'Trans proline' 0 N--CA 1.457 -0.639 0 C-N-CA 123.125 2.55 . . . . 0.0 109.134 -176.616 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 12.0 t0 -144.53 138.28 27.43 Favored 'General case' 0 CA--C 1.511 -0.532 0 N-CA-C 107.342 -1.355 . . . . 0.0 107.342 176.011 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.539 ' HA ' ' CD2' ' A' ' 18' ' ' TYR . 1.5 t -69.1 -19.27 23.6 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 N-CA-C 107.902 -1.147 . . . . 0.0 107.902 178.399 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 86.7 p -61.66 -15.66 41.87 Favored 'General case' 0 N--CA 1.43 -1.446 0 N-CA-C 113.606 0.965 . . . . 0.0 113.606 -179.384 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 14.0 t -124.08 9.92 8.73 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 126.308 1.843 . . . . 0.0 112.807 177.836 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.539 ' CD2' ' HA ' ' A' ' 15' ' ' VAL . 18.3 m-30 -68.86 170.59 9.35 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-N 120.393 1.451 . . . . 0.0 108.488 166.577 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 14.3 mt-30 -118.1 106.25 12.67 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 124.521 1.128 . . . . 0.0 110.028 177.962 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 84.8 t80 -56.03 141.76 38.78 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 124.599 1.16 . . . . 0.0 111.456 170.879 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -126.04 95.09 4.28 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 124.158 0.983 . . . . 0.0 109.312 179.727 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -57.35 -23.21 47.51 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 125.176 1.39 . . . . 0.0 113.285 -177.637 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 5.2 t -48.59 -35.58 13.82 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 127.128 2.171 . . . . 0.0 109.659 172.983 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -120.68 -55.76 1.99 Allowed 'General case' 0 N--CA 1.445 -0.719 0 C-N-CA 124.167 0.987 . . . . 0.0 108.538 -177.768 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 117.0 28.71 2.36 Favored Glycine 0 CA--C 1.527 0.833 0 C-N-CA 123.965 0.793 . . . . 0.0 114.424 -174.904 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 39.4 m-85 -130.82 165.33 23.24 Favored 'General case' 0 C--O 1.239 0.504 0 C-N-CA 126.244 1.817 . . . . 0.0 106.804 -176.261 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 79.6 m-85 -90.41 140.17 29.97 Favored 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 124.554 1.141 . . . . 0.0 108.037 173.265 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 31.3 t80 -102.34 134.86 44.95 Favored 'General case' 0 C--O 1.237 0.433 0 N-CA-C 107.459 -1.311 . . . . 0.0 107.459 170.039 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -112.69 77.0 2.28 Favored Pre-proline 0 N--CA 1.447 -0.587 0 C-N-CA 125.89 1.676 . . . . 0.0 109.429 -166.347 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -67.22 -6.27 15.81 Favored 'Trans proline' 0 N--CA 1.46 -0.465 0 C-N-CA 122.929 2.42 . . . . 0.0 114.145 -170.82 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 3.9 tt0 -63.29 -26.11 68.62 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 118.516 0.598 . . . . 0.0 110.408 174.314 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 7.3 p -139.98 -21.15 0.88 Allowed 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 124.78 1.232 . . . . 0.0 113.474 179.453 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 97.45 14.81 39.95 Favored Glycine 0 CA--C 1.529 0.963 0 CA-C-N 119.054 0.843 . . . . 0.0 112.764 -178.463 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 24.3 mt -86.51 -178.33 6.39 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 118.634 1.217 . . . . 0.0 109.18 175.664 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 39.0 m-85 -126.63 146.42 50.18 Favored 'General case' 0 C--O 1.238 0.461 0 C-N-CA 124.507 1.123 . . . . 0.0 109.825 166.374 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 85.9 t80 -117.83 154.79 31.21 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.932 1.693 . . . . 0.0 109.348 177.878 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -124.95 143.81 45.11 Favored Pre-proline 0 CA--C 1.535 0.383 0 C-N-CA 126.248 1.819 . . . . 0.0 109.151 171.927 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 70.7 Cg_endo -79.33 -31.92 1.93 Allowed 'Trans proline' 0 N--CA 1.459 -0.516 0 C-N-CA 123.691 2.927 . . . . 0.0 113.853 -176.238 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 8.2 m-80 -81.98 -22.04 36.82 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 124.049 0.939 . . . . 0.0 109.592 176.656 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 38.4 m -137.6 98.1 3.61 Favored 'General case' 0 CA--C 1.513 -0.477 0 C-N-CA 125.501 1.521 . . . . 0.0 108.94 -170.554 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 19.7 mp0 -67.35 24.33 0.02 OUTLIER 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 127.733 2.413 . . . . 0.0 113.203 -179.278 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 33.2 m-85 -99.25 101.44 12.76 Favored 'General case' 0 CA--C 1.536 0.42 0 O-C-N 120.202 -1.561 . . . . 0.0 108.261 177.501 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 29.6 m-85 -65.69 111.83 3.38 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 128.554 2.741 . . . . 0.0 110.604 -179.747 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 63.8 t80 -75.33 127.29 32.81 Favored 'General case' 0 C--N 1.326 -0.452 0 C-N-CA 125.618 1.567 . . . . 0.0 110.448 -176.495 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 45.0 t30 -99.3 81.33 2.53 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 126.886 2.074 . . . . 0.0 109.54 175.364 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -46.08 -36.79 6.08 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 124.749 1.22 . . . . 0.0 111.992 176.936 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.7 tt0 -49.78 -31.07 10.75 Favored 'General case' 0 N--CA 1.447 -0.611 0 C-N-CA 127.573 2.349 . . . . 0.0 114.121 -178.425 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 40.2 m -134.04 17.13 3.81 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 123.52 0.728 . . . . 0.0 111.223 172.146 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 40.8 mt-30 44.99 32.31 0.83 Allowed 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 125.519 1.528 . . . . 0.0 112.006 -163.376 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -93.6 168.33 11.1 Favored 'General case' 0 N--CA 1.452 -0.345 0 O-C-N 120.9 -1.125 . . . . 0.0 109.848 -176.167 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 5.7 m-85 -116.57 128.07 55.08 Favored 'General case' 0 N--CA 1.446 -0.633 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 -174.985 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.436 HD23 ' HA ' ' A' ' 63' ' ' PRO . 22.6 mt -124.02 178.24 5.39 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 127.326 2.25 . . . . 0.0 109.885 179.686 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 5.1 p90 -145.69 152.44 39.62 Favored 'General case' 0 C--O 1.235 0.318 0 C-N-CA 127.788 2.435 . . . . 0.0 106.943 168.441 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 69.2 t-105 -77.1 142.98 39.53 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 107.316 -1.364 . . . . 0.0 107.316 164.569 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 63.9 t0 -131.85 104.53 6.93 Favored 'General case' 0 C--O 1.234 0.272 0 N-CA-C 108.876 -0.786 . . . . 0.0 108.876 169.708 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -75.81 -7.63 83.82 Favored Glycine 0 CA--C 1.533 1.163 0 C-N-CA 124.362 0.982 . . . . 0.0 113.345 -178.935 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 73.7 mt-10 -75.04 -31.57 61.34 Favored 'General case' 0 CA--C 1.531 0.222 0 O-C-N 121.066 -1.255 . . . . 0.0 109.933 170.342 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 63.9 mtt180 -110.04 -7.31 14.95 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 125.502 1.521 . . . . 0.0 112.668 -177.115 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 61.3 mtt85 44.98 55.66 5.97 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 128.294 2.638 . . . . 0.0 110.752 -174.02 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 11.3 t -150.72 169.46 21.56 Favored 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 123.268 0.627 . . . . 0.0 109.833 174.051 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 93.4 m-85 -92.43 134.88 34.52 Favored 'General case' 0 C--O 1.238 0.458 0 N-CA-C 107.23 -1.396 . . . . 0.0 107.23 164.071 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -126.95 157.7 71.02 Favored Pre-proline 0 C--N 1.322 -0.608 0 C-N-CA 127.026 2.13 . . . . 0.0 111.113 178.362 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.436 ' HA ' HD23 ' A' ' 52' ' ' LEU . 42.8 Cg_endo -75.23 123.41 7.74 Favored 'Trans proline' 0 CA--C 1.533 0.471 0 C-N-CA 123.925 3.083 . . . . 0.0 112.568 -177.939 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -90.03 14.13 13.11 Favored 'General case' 0 N--CA 1.465 0.298 0 N-CA-C 115.831 1.789 . . . . 0.0 115.831 -169.091 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -45.53 -75.21 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 126.776 2.031 . . . . 0.0 111.726 -167.706 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 14.8 mp0 -87.13 -50.47 6.6 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-N 118.448 0.567 . . . . 0.0 110.155 179.088 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 51.26 17.41 0.49 Allowed 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 127.398 2.279 . . . . 0.0 113.281 -174.503 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 24.9 p -159.82 144.04 14.71 Favored 'General case' 0 N--CA 1.443 -0.784 0 O-C-N 120.597 -1.314 . . . . 0.0 108.744 170.327 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -128.81 8.88 5.8 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 127.378 2.271 . . . . 0.0 110.509 174.157 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 29.7 t0 -124.55 93.95 4.06 Favored 'General case' 0 C--O 1.241 0.648 0 N-CA-C 107.758 -1.201 . . . . 0.0 107.758 -178.754 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 119.55 162.15 11.85 Favored Glycine 0 CA--C 1.524 0.654 0 C-N-CA 125.137 1.351 . . . . 0.0 109.955 178.355 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 38.8 m170 -75.61 86.0 2.67 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 123.95 0.9 . . . . 0.0 109.796 177.391 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 2.1 mptt -130.29 170.79 13.66 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-N 118.833 0.742 . . . . 0.0 110.611 166.428 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -144.45 -56.4 0.35 Allowed 'General case' 0 C--O 1.224 -0.273 0 C-N-CA 123.804 0.842 . . . . 0.0 109.713 172.359 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 5.7 p -141.6 -24.88 0.71 Allowed 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 123.92 0.888 . . . . 0.0 112.953 166.596 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -168.9 -159.76 15.32 Favored Glycine 0 C--N 1.334 0.419 0 N-CA-C 110.577 -1.009 . . . . 0.0 110.577 -161.75 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -131.85 68.55 80.62 Favored Pre-proline 0 C--O 1.239 0.545 0 CA-C-N 117.541 0.67 . . . . 0.0 111.231 168.31 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_endo -57.41 106.83 0.26 Allowed 'Trans proline' 0 N--CA 1.454 -0.829 0 C-N-CA 124.367 3.378 . . . . 0.0 109.392 174.88 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 58.5 m 45.0 42.74 6.64 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 123.666 0.787 . . . . 0.0 112.323 -175.991 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -135.24 14.3 3.52 Favored 'General case' 0 N--CA 1.461 0.102 0 C-N-CA 123.232 0.613 . . . . 0.0 111.232 178.834 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 22.6 tt0 -153.69 61.21 0.74 Allowed 'General case' 0 C--O 1.235 0.309 0 N-CA-C 108.088 -1.078 . . . . 0.0 108.088 176.487 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 76.48 -30.47 1.44 Allowed Glycine 0 CA--C 1.534 1.226 0 O-C-N 120.718 -1.239 . . . . 0.0 113.922 172.48 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 1.6 mtmm -52.91 -25.68 12.53 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 118.735 1.267 . . . . 0.0 111.162 168.509 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -51.58 -36.04 43.78 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 125.508 1.523 . . . . 0.0 112.728 176.023 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.38 4.51 15.38 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 124.059 0.944 . . . . 0.0 111.02 -176.856 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 73.3 mttt -97.28 -44.72 6.79 Favored 'General case' 0 CA--C 1.51 -0.567 0 O-C-N 120.774 -1.204 . . . . 0.0 109.733 167.881 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 14.5 tt0 56.82 68.88 0.8 Allowed 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 124.638 1.175 . . . . 0.0 110.348 177.719 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -138.95 75.36 1.51 Allowed 'General case' 0 C--O 1.232 0.166 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 -169.42 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 31.1 t-80 -74.61 109.21 7.9 Favored 'General case' 0 C--O 1.239 0.514 0 N-CA-C 107.219 -1.4 . . . . 0.0 107.219 170.199 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 15.6 tptt -152.36 -22.49 0.17 Allowed 'General case' 0 N--CA 1.464 0.262 0 CA-C-O 116.266 -1.826 . . . . 0.0 113.03 -178.081 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 5.2 m 44.02 61.32 2.38 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 125.525 1.53 . . . . 0.0 111.799 160.227 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 1.2 mtpt . . . . . 0 C--O 1.253 1.244 0 N-CA-C 104.446 -2.427 . . . . 0.0 104.446 -178.031 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.73 0 N-CA-C 110.14 -1.184 . . . . 0.0 110.14 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 13.3 m80 69.79 -167.02 0.17 Allowed 'General case' 0 C--O 1.24 0.574 0 C-N-CA 125.767 1.627 . . . . 0.0 109.868 -167.438 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' MET . . . . . 0.468 ' HG2' ' H ' ' A' ' 4' ' ' GLN . 7.6 ttt -74.57 -162.69 0.17 Allowed 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 125.728 1.611 . . . . 0.0 109.608 178.421 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.468 ' H ' ' HG2' ' A' ' 3' ' ' MET . 10.7 mt-30 -140.91 152.58 45.15 Favored 'General case' 0 N--CA 1.452 -0.333 0 O-C-N 120.912 -1.118 . . . . 0.0 109.594 170.607 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -65.27 -17.42 64.49 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 125.219 1.408 . . . . 0.0 113.281 -177.367 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 8.4 t 59.59 64.53 1.31 Allowed 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 125.825 1.65 . . . . 0.0 111.856 170.25 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 40.9 p90 -112.88 -22.06 10.84 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 124.28 1.032 . . . . 0.0 113.581 -176.111 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 2.1 t 49.77 58.66 5.2 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 125.972 1.709 . . . . 0.0 113.041 174.22 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 38.8 mm-40 -130.68 176.31 8.29 Favored 'General case' 0 C--O 1.233 0.225 0 C-N-CA 124.659 1.184 . . . . 0.0 112.019 177.174 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 61.4 m-85 -60.0 163.0 8.53 Favored Pre-proline 0 C--O 1.242 0.708 0 C-N-CA 126.05 1.74 . . . . 0.0 112.013 -169.96 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 92.3 Cg_endo -68.62 179.28 3.2 Favored 'Trans proline' 0 N--CA 1.456 -0.713 0 C-N-CA 123.541 2.827 . . . . 0.0 109.976 167.639 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 10.7 t -105.1 88.39 2.41 Favored Pre-proline 0 N--CA 1.45 -0.445 0 N-CA-C 106.748 -1.575 . . . . 0.0 106.748 176.403 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_endo -58.67 170.89 2.26 Favored 'Trans proline' 0 CA--C 1.545 1.048 0 CA-C-N 120.248 1.124 . . . . 0.0 110.397 171.703 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 15.3 t0 -132.84 129.25 38.22 Favored 'General case' 0 N--CA 1.447 -0.621 0 N-CA-C 106.139 -1.8 . . . . 0.0 106.139 164.524 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.671 HG11 ' CE2' ' A' ' 36' ' ' TYR . 1.7 t -59.0 -26.6 33.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 114.515 -1.221 . . . . 0.0 108.149 173.545 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 36.4 p -60.34 -38.22 83.1 Favored 'General case' 0 N--CA 1.437 -1.114 0 C-N-CA 118.033 -1.467 . . . . 0.0 109.047 -172.42 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 16.4 p -87.68 18.33 4.09 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 126.436 1.894 . . . . 0.0 111.778 179.374 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.586 ' CE2' HG13 ' A' ' 15' ' ' VAL . 13.3 m-30 -79.96 160.6 25.88 Favored 'General case' 0 C--O 1.234 0.258 0 O-C-N 119.903 -1.748 . . . . 0.0 110.049 170.518 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 25.6 mt-30 -100.56 109.6 21.71 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 107.975 -1.12 . . . . 0.0 107.975 -178.429 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 66.9 t80 -63.45 152.68 37.68 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 124.081 0.953 . . . . 0.0 110.421 176.042 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -128.73 105.3 8.16 Favored 'General case' 0 CA--C 1.512 -0.505 0 C-N-CA 125.139 1.376 . . . . 0.0 108.498 168.135 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -61.09 -27.47 68.39 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 119.172 -0.442 . . . . 0.0 112.109 169.917 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 15.1 t -66.08 -4.98 8.36 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.347 1.059 . . . . 0.0 113.184 -178.132 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 12.5 t -140.75 -47.8 0.42 Allowed 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 123.301 0.641 . . . . 0.0 109.555 172.619 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 112.0 43.66 0.92 Allowed Glycine 0 CA--C 1.526 0.743 0 C-N-CA 124.921 1.248 . . . . 0.0 111.929 -177.75 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 68.8 m-85 -136.13 170.28 16.27 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 119.401 1.601 . . . . 0.0 111.161 -177.785 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 79.4 m-85 -110.91 125.96 54.22 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 124.76 1.224 . . . . 0.0 107.707 173.685 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 34.8 t80 -88.56 139.48 30.43 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 124.368 1.067 . . . . 0.0 108.396 177.962 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 27.7 t0 -97.4 86.54 0.42 Allowed Pre-proline 0 CA--C 1.529 0.145 0 C-N-CA 126.946 2.098 . . . . 0.0 109.247 177.796 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -70.37 -5.08 15.77 Favored 'Trans proline' 0 N--CA 1.456 -0.702 0 C-N-CA 122.592 2.195 . . . . 0.0 113.685 175.798 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 2.4 mm-40 -73.77 -28.26 61.57 Favored 'General case' 0 CA--C 1.533 0.309 0 O-C-N 121.328 -0.858 . . . . 0.0 109.368 175.284 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 23.7 p -140.31 -24.11 0.81 Allowed 'General case' 0 C--O 1.238 0.453 0 N-CA-C 115.079 1.511 . . . . 0.0 115.079 -169.404 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 104.13 9.95 35.49 Favored Glycine 0 CA--C 1.53 1.021 0 C-N-CA 124.135 0.874 . . . . 0.0 112.986 177.426 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 19.8 mt -89.84 179.99 5.86 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 125.544 1.538 . . . . 0.0 109.07 178.253 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 57.4 m-85 -124.3 171.37 9.94 Favored 'General case' 0 C--O 1.234 0.282 0 C-N-CA 124.474 1.11 . . . . 0.0 108.843 162.368 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.671 ' CE2' HG11 ' A' ' 15' ' ' VAL . 68.1 t80 -143.21 159.36 42.46 Favored 'General case' 0 C--O 1.238 0.467 0 C-N-CA 128.224 2.609 . . . . 0.0 108.337 179.24 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -127.66 144.35 50.82 Favored Pre-proline 0 C--O 1.235 0.321 0 C-N-CA 124.576 1.15 . . . . 0.0 108.373 174.229 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 61.9 Cg_endo -75.07 -35.07 3.3 Favored 'Trans proline' 0 N--CA 1.45 -1.057 0 C-N-CA 121.944 1.763 . . . . 0.0 113.324 -173.036 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 3.6 m-80 -83.08 -21.72 33.64 Favored 'General case' 0 CA--C 1.524 -0.056 0 CA-C-N 119.152 0.887 . . . . 0.0 110.91 175.807 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 42.7 t -130.89 89.36 2.74 Favored 'General case' 0 N--CA 1.45 -0.472 0 N-CA-C 107.449 -1.315 . . . . 0.0 107.449 -166.85 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -55.92 -9.25 0.55 Allowed 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.873 1.269 . . . . 0.0 113.255 -177.792 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 11.5 m-85 -62.95 107.04 0.91 Allowed 'General case' 0 N--CA 1.449 -0.486 0 C-N-CA 124.951 1.3 . . . . 0.0 108.807 170.566 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 28.2 m-85 -59.89 156.75 13.76 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 124.756 1.222 . . . . 0.0 109.28 170.915 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 83.0 t80 -117.35 124.45 48.96 Favored 'General case' 0 N--CA 1.447 -0.602 0 C-N-CA 124.508 1.123 . . . . 0.0 108.116 177.74 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 27.1 t30 -98.15 84.65 3.3 Favored 'General case' 0 N--CA 1.446 -0.654 0 C-N-CA 126.754 2.022 . . . . 0.0 107.824 176.084 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -53.85 -26.52 24.89 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 124.324 1.049 . . . . 0.0 112.181 175.639 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -52.49 -41.64 63.58 Favored 'General case' 0 N--CA 1.446 -0.637 0 C-N-CA 124.496 1.118 . . . . 0.0 112.113 176.861 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 14.6 m -128.43 15.91 6.57 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 125.15 1.38 . . . . 0.0 111.726 -179.766 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 40.2 mt-30 50.62 19.01 0.53 Allowed 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 127.091 2.156 . . . . 0.0 114.35 -171.803 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -91.31 159.14 16.17 Favored 'General case' 0 N--CA 1.454 -0.239 0 C-N-CA 124.02 0.928 . . . . 0.0 109.798 -171.071 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -98.49 146.75 25.45 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 108.548 -0.908 . . . . 0.0 108.548 174.849 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.48 HD23 ' HA ' ' A' ' 63' ' ' PRO . 82.7 mt -140.01 -178.03 5.26 Favored 'General case' 0 C--N 1.326 -0.413 0 C-N-CA 125.564 1.546 . . . . 0.0 107.915 -179.386 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 26.5 p90 -143.32 149.69 38.13 Favored 'General case' 0 C--N 1.327 -0.378 0 C-N-CA 125.188 1.395 . . . . 0.0 108.191 168.073 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 42.0 t-105 -85.71 139.38 31.4 Favored 'General case' 0 C--O 1.235 0.337 0 N-CA-C 106.57 -1.641 . . . . 0.0 106.57 168.399 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 7.6 t0 -134.85 113.8 11.95 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 122.899 0.48 . . . . 0.0 110.057 -175.833 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -74.37 -12.01 82.18 Favored Glycine 0 CA--C 1.533 1.183 0 CA-C-O 119.117 -0.824 . . . . 0.0 113.498 176.179 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -67.15 -35.23 79.26 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 119.67 1.735 . . . . 0.0 108.937 176.388 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 43.0 mtt85 -120.21 -4.29 10.0 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 124.556 1.142 . . . . 0.0 112.75 -177.558 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 9.7 mtp85 49.19 51.53 16.08 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 126.695 1.998 . . . . 0.0 110.475 -173.247 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 1.4 t -146.36 173.86 11.89 Favored 'General case' 0 CA--C 1.536 0.424 0 O-C-N 121.345 -0.847 . . . . 0.0 108.793 -179.888 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 99.1 m-85 -111.03 119.66 39.78 Favored 'General case' 0 C--O 1.234 0.276 0 C-N-CA 125.044 1.337 . . . . 0.0 108.547 -179.445 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -126.4 156.84 72.12 Favored Pre-proline 0 N--CA 1.469 0.503 0 C-N-CA 125.946 1.698 . . . . 0.0 111.871 -169.805 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.48 ' HA ' HD23 ' A' ' 52' ' ' LEU . 60.9 Cg_endo -74.43 118.46 5.36 Favored 'Trans proline' 0 N--CA 1.459 -0.553 0 C-N-CA 122.439 2.092 . . . . 0.0 111.947 -175.505 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -81.74 26.28 0.5 Allowed 'General case' 0 N--CA 1.466 0.347 0 O-C-N 121.479 -0.763 . . . . 0.0 112.069 178.159 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 7.4 mp -88.43 -42.55 12.08 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 124.483 1.113 . . . . 0.0 109.347 178.408 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.9 pt-20 -56.21 -43.45 78.54 Favored 'General case' 0 N--CA 1.463 0.205 0 C-N-CA 123.978 0.911 . . . . 0.0 108.929 -175.37 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -85.35 -1.55 57.11 Favored 'General case' 0 N--CA 1.449 -0.486 0 C-N-CA 126.04 1.736 . . . . 0.0 113.533 -175.664 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.43 10.97 23.09 Favored 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 124.634 1.174 . . . . 0.0 112.3 -172.827 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 51.1 66.8 1.07 Allowed 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 124.629 1.172 . . . . 0.0 111.397 -175.386 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -55.21 -34.96 64.39 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 124.671 1.188 . . . . 0.0 109.588 164.069 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 75.29 -81.87 0.92 Allowed Glycine 0 N--CA 1.444 -0.792 0 N-CA-C 107.824 -2.11 . . . . 0.0 107.824 -173.011 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -156.09 31.6 0.34 Allowed 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 126.291 1.836 . . . . 0.0 111.916 -175.197 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 20.9 mtmm -106.99 -171.22 1.84 Allowed 'General case' 0 C--O 1.237 0.445 0 C-N-CA 123.905 0.882 . . . . 0.0 109.915 -175.785 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -146.62 172.53 13.45 Favored 'General case' 0 C--N 1.326 -0.452 0 C-N-CA 127.568 2.347 . . . . 0.0 106.906 -175.162 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -52.18 -0.22 0.01 OUTLIER 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 128.875 2.87 . . . . 0.0 116.383 173.657 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 173.34 -159.74 29.94 Favored Glycine 0 N--CA 1.444 -0.804 0 CA-C-N 119.776 1.171 . . . . 0.0 110.321 -162.571 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -134.33 157.63 77.04 Favored Pre-proline 0 CA--C 1.537 0.473 0 C-N-CA 125.783 1.633 . . . . 0.0 109.479 179.016 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_endo -64.64 136.77 51.39 Favored 'Trans proline' 0 N--CA 1.457 -0.634 0 C-N-CA 122.918 2.412 . . . . 0.0 111.302 -178.892 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 44.8 m 59.49 -176.0 0.1 Allowed 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 125.678 1.591 . . . . 0.0 111.942 -176.785 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 44.5 tttt 56.0 38.78 30.32 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 123.556 0.742 . . . . 0.0 110.623 177.341 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 20.5 pt-20 -147.62 21.69 1.16 Allowed 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 126.183 1.793 . . . . 0.0 111.229 -177.523 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 82.85 -16.53 26.31 Favored Glycine 0 CA--C 1.533 1.167 0 O-C-N 120.937 -1.102 . . . . 0.0 113.205 -175.179 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 54.2 mttt -100.04 10.42 41.31 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 119.636 1.718 . . . . 0.0 114.14 179.049 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -47.44 -23.16 0.55 Allowed 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 126.392 1.877 . . . . 0.0 115.021 178.542 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 7.8 ptmt -134.0 26.32 3.92 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 124.418 1.087 . . . . 0.0 111.593 176.584 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 15.2 mmtp -134.75 28.19 3.59 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 124.652 1.181 . . . . 0.0 111.588 -171.72 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -61.64 -72.03 0.13 Allowed 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 123.44 0.696 . . . . 0.0 110.454 174.406 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 52.61 66.09 1.32 Allowed 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 124.83 1.252 . . . . 0.0 109.871 -165.997 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 62.2 t-80 -59.19 136.52 57.98 Favored 'General case' 0 C--O 1.239 0.516 0 N-CA-C 109.638 -0.505 . . . . 0.0 109.638 172.036 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 9.0 mtpt -131.46 -78.81 0.52 Allowed 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 124.709 1.204 . . . . 0.0 108.841 176.178 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 10.5 m 45.83 54.79 7.54 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 119.215 0.916 . . . . 0.0 108.951 -162.97 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 44.9 tttp . . . . . 0 C--O 1.248 1.011 0 O-C-N 120.704 -1.248 . . . . 0.0 108.928 178.002 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.635 0 N-CA-C 109.828 -1.309 . . . . 0.0 109.828 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -144.65 146.3 32.19 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 108.074 -1.084 . . . . 0.0 108.074 174.954 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 5.1 ptt? -65.32 165.76 11.16 Favored 'General case' 0 C--O 1.236 0.348 0 N-CA-C 109.912 -0.403 . . . . 0.0 109.912 178.712 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 32.8 mt-30 -63.33 96.7 0.11 Allowed 'General case' 0 C--O 1.234 0.237 0 C-N-CA 124.05 0.94 . . . . 0.0 109.135 172.406 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -143.09 22.24 1.91 Allowed 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 127.33 2.252 . . . . 0.0 109.33 -174.631 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 8.7 t -71.0 108.5 4.6 Favored 'General case' 0 N--CA 1.454 -0.275 0 O-C-N 119.717 -1.864 . . . . 0.0 107.281 171.921 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 44.6 p90 -63.08 -41.56 99.45 Favored 'General case' 0 N--CA 1.456 -0.162 0 C-N-CA 122.771 0.429 . . . . 0.0 111.034 -175.188 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 52.16 78.16 0.13 Allowed 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 126.485 1.914 . . . . 0.0 110.419 177.73 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -69.39 -38.08 77.84 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 114.955 -1.02 . . . . 0.0 111.622 -169.752 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 12.9 m-85 -126.41 165.74 26.11 Favored Pre-proline 0 CA--C 1.539 0.553 0 C-N-CA 126.605 1.962 . . . . 0.0 110.055 176.61 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -59.23 -164.88 0.03 OUTLIER 'Trans proline' 0 CA--C 1.542 0.916 1 C-N-CA 125.769 4.312 . . . . 0.0 113.881 162.268 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 47.0 t -126.2 88.06 55.01 Favored Pre-proline 0 CA--C 1.541 0.613 0 C-N-CA 127.083 2.153 . . . . 0.0 108.804 -176.473 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_endo -65.24 160.0 44.33 Favored 'Trans proline' 0 CA--C 1.539 0.745 0 C-N-CA 123.657 2.905 . . . . 0.0 112.451 -173.468 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 42.5 t0 -148.73 127.64 12.67 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 106.709 -1.589 . . . . 0.0 106.709 175.797 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 11.3 p -60.4 -21.44 22.9 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.534 0 C-N-CA 123.956 0.902 . . . . 0.0 112.123 177.92 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 42.6 t -62.77 -7.49 5.06 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 125.489 1.516 . . . . 0.0 113.381 -178.882 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 14.5 t -124.29 12.35 8.82 Favored 'General case' 0 CA--C 1.533 0.296 0 O-C-N 120.549 -1.344 . . . . 0.0 111.34 177.142 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 10.9 m-30 -73.88 169.28 17.74 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-O 122.101 0.953 . . . . 0.0 110.8 175.423 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 87.4 mt-30 -113.55 101.72 9.61 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 125.936 1.694 . . . . 0.0 107.49 177.763 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 74.9 t80 -67.17 147.02 53.62 Favored 'General case' 0 C--N 1.328 -0.348 0 O-C-N 121.82 -0.55 . . . . 0.0 110.215 169.828 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -129.17 87.99 2.64 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 123.351 0.661 . . . . 0.0 110.793 179.789 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -58.72 -21.94 56.27 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 114.075 1.139 . . . . 0.0 114.075 -168.967 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 3.2 t -58.61 -19.12 35.85 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.577 1.151 . . . . 0.0 112.41 174.405 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 48.8 m -137.54 -23.51 1.08 Allowed 'General case' 0 CA--C 1.539 0.519 0 N-CA-C 114.563 1.32 . . . . 0.0 114.563 177.43 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 98.6 19.98 20.98 Favored Glycine 0 CA--C 1.536 1.364 0 CA-C-N 120.361 1.437 . . . . 0.0 115.535 170.413 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 7.7 m-85 -122.62 169.55 10.92 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 119.595 1.698 . . . . 0.0 110.395 175.72 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 88.3 m-85 -102.49 153.43 20.06 Favored 'General case' 0 N--CA 1.448 -0.531 0 C-N-CA 125.186 1.395 . . . . 0.0 109.617 173.656 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 55.2 t80 -118.86 143.75 46.78 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 126.107 1.763 . . . . 0.0 108.699 172.147 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 65.7 t0 -106.15 87.29 2.43 Favored Pre-proline 0 C--N 1.33 -0.272 0 C-N-CA 126.749 2.02 . . . . 0.0 111.941 -175.738 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -61.16 -6.74 6.92 Favored 'Trans proline' 0 CA--C 1.535 0.551 0 C-N-CA 123.038 2.492 . . . . 0.0 114.747 176.145 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 25.7 mt-30 -74.98 -19.97 59.87 Favored 'General case' 0 CA--C 1.535 0.366 0 O-C-N 120.731 -1.23 . . . . 0.0 111.057 173.772 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 27.5 p -143.19 -40.75 0.31 Allowed 'General case' 0 C--O 1.235 0.339 0 C-N-CA 123.687 0.795 . . . . 0.0 112.791 -166.364 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 96.03 40.25 4.09 Favored Glycine 0 CA--C 1.525 0.663 0 C-N-CA 124.606 1.098 . . . . 0.0 111.744 -176.046 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 10.8 mt -115.56 167.01 11.27 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 124.961 1.305 . . . . 0.0 108.997 172.853 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 37.2 m-85 -106.88 160.57 15.41 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 118.801 0.728 . . . . 0.0 110.359 166.37 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 38.3 t80 -141.95 152.02 43.12 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 126.593 1.957 . . . . 0.0 109.23 -174.78 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -124.63 143.71 44.23 Favored Pre-proline 0 CA--C 1.535 0.402 0 C-N-CA 125.762 1.625 . . . . 0.0 108.797 174.863 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 95.5 Cg_endo -77.46 -21.27 11.74 Favored 'Trans proline' 0 CA--C 1.535 0.535 0 C-N-CA 123.089 2.526 . . . . 0.0 115.159 -172.553 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 81.9 m-20 -92.31 -33.94 14.41 Favored 'General case' 0 N--CA 1.447 -0.622 0 C-N-CA 125.513 1.525 . . . . 0.0 110.018 174.731 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 41.5 p -125.19 84.1 2.24 Favored 'General case' 0 N--CA 1.451 -0.375 0 C-N-CA 123.861 0.864 . . . . 0.0 108.806 -165.978 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 21.0 mp0 -57.87 -1.09 0.09 Allowed 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 127.149 2.18 . . . . 0.0 114.726 -175.666 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 45.3 m-85 -65.4 107.48 1.67 Allowed 'General case' 0 C--O 1.236 0.35 0 C-N-CA 125.529 1.532 . . . . 0.0 107.807 169.764 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 68.9 m-85 -65.72 140.83 58.48 Favored 'General case' 0 C--O 1.235 0.312 0 C-N-CA 123.87 0.868 . . . . 0.0 108.846 -178.96 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 64.8 t80 -95.29 109.72 21.82 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-O 122.752 1.263 . . . . 0.0 108.2 175.246 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 35.9 t30 -83.29 80.32 9.11 Favored 'General case' 0 N--CA 1.44 -0.946 0 CA-C-N 114.171 -1.377 . . . . 0.0 108.509 173.966 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -46.25 -35.3 5.11 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 125.095 1.358 . . . . 0.0 112.225 178.444 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -44.41 -50.62 9.18 Favored 'General case' 0 N--CA 1.444 -0.756 0 C-N-CA 127.942 2.497 . . . . 0.0 111.908 177.624 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 13.9 m -126.09 19.4 7.67 Favored 'General case' 0 C--N 1.332 -0.169 0 C-N-CA 124.845 1.258 . . . . 0.0 111.065 -178.345 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 11.1 mp0 50.88 18.67 0.54 Allowed 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 127.75 2.42 . . . . 0.0 113.275 -174.975 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -84.82 164.07 18.68 Favored 'General case' 0 N--CA 1.447 -0.578 0 C-N-CA 125.145 1.378 . . . . 0.0 111.303 -170.463 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 4.9 m-85 -118.57 121.57 40.54 Favored 'General case' 0 N--CA 1.449 -0.516 0 N-CA-C 105.62 -1.993 . . . . 0.0 105.62 -177.119 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 63.7 mt -124.4 176.56 6.4 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 125.076 1.35 . . . . 0.0 108.223 -170.895 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 13.5 p90 -135.4 148.21 49.28 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 108.121 -1.066 . . . . 0.0 108.121 168.604 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 57.8 t-105 -74.89 135.44 41.5 Favored 'General case' 0 C--O 1.236 0.359 0 N-CA-C 106.395 -1.706 . . . . 0.0 106.395 165.898 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 35.3 t0 -129.05 95.05 3.97 Favored 'General case' 0 N--CA 1.448 -0.564 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 177.567 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -66.09 -17.98 66.35 Favored Glycine 0 CA--C 1.526 0.744 0 CA-C-O 119.232 -0.76 . . . . 0.0 112.381 176.647 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 -68.33 -30.29 69.23 Favored 'General case' 0 C--N 1.34 0.166 0 CA-C-N 119.206 1.503 . . . . 0.0 109.366 174.559 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 47.6 mtt180 -102.86 -9.9 19.52 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.67 1.188 . . . . 0.0 112.106 178.327 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 11.8 mtm-85 44.68 54.94 6.23 Favored 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 127.539 2.335 . . . . 0.0 111.111 -167.297 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 7.5 t -154.94 178.15 10.5 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 124.092 0.957 . . . . 0.0 109.104 177.995 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 97.3 m-85 -109.36 128.28 54.99 Favored 'General case' 0 C--O 1.233 0.221 0 N-CA-C 107.571 -1.27 . . . . 0.0 107.571 168.349 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -126.73 158.34 68.4 Favored Pre-proline 0 C--N 1.324 -0.525 0 C-N-CA 126.494 1.918 . . . . 0.0 110.64 -173.692 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -72.61 136.93 26.74 Favored 'Trans proline' 0 N--CA 1.455 -0.778 0 C-N-CA 122.421 2.081 . . . . 0.0 110.135 -178.057 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -103.12 17.13 24.81 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 123.521 0.728 . . . . 0.0 111.959 -176.824 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 27.1 mt -71.47 -29.08 64.42 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 123.831 0.852 . . . . 0.0 110.019 -173.513 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 12.9 mt-10 -66.17 -18.75 65.54 Favored 'General case' 0 C--O 1.235 0.325 0 C-N-CA 125.592 1.557 . . . . 0.0 112.89 176.281 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 13.4 tt0 -76.94 71.03 3.43 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-N 119.805 1.184 . . . . 0.0 112.534 -169.192 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 1.4 t -137.13 50.31 2.0 Allowed 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 126.246 1.819 . . . . 0.0 107.905 173.381 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -58.07 103.65 0.15 Allowed 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 125.74 1.616 . . . . 0.0 107.243 165.269 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -148.25 1.92 0.64 Allowed 'General case' 0 N--CA 1.466 0.352 0 N-CA-C 113.574 0.953 . . . . 0.0 113.574 -175.073 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 105.0 69.0 0.75 Allowed Glycine 0 C--N 1.333 0.397 0 N-CA-C 109.72 -1.352 . . . . 0.0 109.72 -174.373 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 12.6 m170 48.76 58.78 4.93 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 125.627 1.571 . . . . 0.0 110.241 -179.053 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 48.4 mttm -131.53 27.99 4.66 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 125.726 1.61 . . . . 0.0 109.96 173.745 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -65.0 166.2 9.72 Favored 'General case' 0 C--O 1.24 0.594 0 O-C-N 121.445 -0.785 . . . . 0.0 109.537 176.55 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 2.2 m -48.87 -37.57 19.96 Favored 'General case' 0 N--CA 1.444 -0.742 0 C-N-CA 126.968 2.107 . . . . 0.0 112.643 -178.777 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -65.11 -47.49 80.99 Favored Glycine 0 CA--C 1.521 0.434 0 N-CA-C 111.423 -0.671 . . . . 0.0 111.423 -169.967 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . 43.66 63.9 7.48 Favored Pre-proline 0 C--O 1.238 0.492 0 C-N-CA 126.666 1.986 . . . . 0.0 113.568 173.885 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo -72.54 -6.58 19.32 Favored 'Trans proline' 0 N--CA 1.455 -0.771 0 C-N-CA 123.313 2.676 . . . . 0.0 112.658 177.124 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 22.7 t -141.91 154.93 45.45 Favored 'General case' 0 N--CA 1.447 -0.602 0 N-CA-C 106.429 -1.693 . . . . 0.0 106.429 160.501 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 72.5 mttt -137.96 19.32 2.82 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.567 1.147 . . . . 0.0 110.124 159.948 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 68.56 104.33 0.05 Allowed 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 126.248 1.819 . . . . 0.0 111.076 -172.673 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 110.63 -26.08 13.71 Favored Glycine 0 CA--C 1.527 0.816 0 C-N-CA 125.6 1.571 . . . . 0.0 112.844 173.123 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 6.9 mtpt -131.18 20.13 4.88 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 118.337 1.068 . . . . 0.0 112.378 -172.969 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -47.4 117.39 1.76 Allowed 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 119.554 1.07 . . . . 0.0 111.772 178.095 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 12.8 mtmt 61.03 -12.78 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 127.039 2.136 . . . . 0.0 114.147 -176.439 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -83.6 52.39 2.24 Favored 'General case' 0 N--CA 1.462 0.16 0 O-C-N 119.773 -1.829 . . . . 0.0 108.71 178.778 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -125.99 8.76 7.42 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 124.611 1.165 . . . . 0.0 111.945 -177.854 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . 0.257 0.2 OUTLIER 58.85 -178.97 0.08 Allowed 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 127.799 2.44 . . . . 0.0 112.424 -159.49 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -140.53 163.65 32.28 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 107.554 -1.276 . . . . 0.0 107.554 163.189 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 3.0 tttp -86.6 21.15 2.25 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 123.285 0.634 . . . . 0.0 111.12 175.451 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 4.2 m 64.42 85.13 0.14 Allowed 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 125.288 1.435 . . . . 0.0 109.04 -158.904 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 8.7 mttm . . . . . 0 C--O 1.25 1.124 0 C-N-CA 127.953 2.501 . . . . 0.0 105.998 174.579 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.573 0 N-CA-C 109.451 -1.46 . . . . 0.0 109.451 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 31.7 m170 -123.54 -172.64 2.56 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 126.407 1.883 . . . . 0.0 109.172 -177.578 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 46.3 mtt -130.57 161.51 31.37 Favored 'General case' 0 N--CA 1.467 0.383 0 O-C-N 121.274 -0.891 . . . . 0.0 108.817 178.631 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 5.5 tp60 -102.24 27.28 6.83 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.385 1.474 . . . . 0.0 110.607 -168.715 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 20.1 pt-20 -62.41 -20.43 64.47 Favored 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 114.018 1.118 . . . . 0.0 114.018 -169.768 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 3.1 m 52.12 56.61 7.51 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.834 1.254 . . . . 0.0 112.238 176.474 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -74.5 121.91 22.25 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 177.646 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 88.7 p -160.53 148.79 16.44 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 118.119 -0.944 . . . . 0.0 112.247 176.24 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 6.0 pt20 -153.54 -22.71 0.14 Allowed 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 116.498 2.036 . . . . 0.0 116.498 172.08 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 37.8 m-85 -94.89 165.19 17.59 Favored Pre-proline 0 C--O 1.241 0.614 0 O-C-N 120.958 -1.089 . . . . 0.0 109.202 172.256 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 29.5 Cg_endo -65.29 -178.25 0.81 Allowed 'Trans proline' 0 CA--C 1.54 0.824 0 C-N-CA 122.965 2.443 . . . . 0.0 111.422 160.202 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 59.1 t -111.34 87.99 8.31 Favored Pre-proline 0 CA--C 1.537 0.465 0 C-N-CA 127.653 2.381 . . . . 0.0 107.584 -173.242 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -68.82 164.92 31.57 Favored 'Trans proline' 0 CA--C 1.539 0.74 0 C-N-CA 123.467 2.778 . . . . 0.0 111.751 -179.109 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.9 t0 -143.25 130.58 20.96 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 108.003 -1.11 . . . . 0.0 108.003 167.653 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 14.0 p -58.68 -17.3 10.26 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.769 0 C-N-CA 124.25 1.02 . . . . 0.0 112.047 176.456 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 32.2 t -53.55 -26.2 20.28 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 125.708 1.603 . . . . 0.0 113.061 173.535 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 5.9 t -119.77 17.68 12.68 Favored 'General case' 0 CA--C 1.545 0.774 0 CA-C-N 119.33 0.968 . . . . 0.0 111.738 -175.18 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 8.1 m-30 -73.64 -168.98 0.63 Allowed 'General case' 0 C--O 1.237 0.398 0 C-N-CA 125.305 1.442 . . . . 0.0 110.456 171.741 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 6.8 mt-30 -122.43 150.86 41.9 Favored 'General case' 0 N--CA 1.446 -0.637 0 N-CA-C 107.018 -1.475 . . . . 0.0 107.018 163.81 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 78.2 t80 -93.95 152.42 18.86 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 108.122 -1.066 . . . . 0.0 108.122 163.909 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -136.05 86.52 2.24 Favored 'General case' 0 CA--C 1.511 -0.539 0 N-CA-C 107.477 -1.305 . . . . 0.0 107.477 175.114 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -47.03 -30.89 2.91 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 126.773 2.029 . . . . 0.0 112.773 179.773 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 1.3 t -65.9 -26.78 67.77 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 123.844 0.858 . . . . 0.0 110.682 -176.78 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 30.2 m -109.15 -24.15 11.28 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.599 1.159 . . . . 0.0 111.641 167.544 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 79.93 27.62 52.77 Favored Glycine 0 CA--C 1.526 0.757 0 C-N-CA 124.558 1.075 . . . . 0.0 112.162 -178.384 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 31.4 m-85 -118.09 169.1 9.95 Favored 'General case' 0 CA--C 1.521 -0.169 0 C-N-CA 124.965 1.306 . . . . 0.0 108.426 179.51 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 73.6 m-85 -94.17 154.46 17.56 Favored 'General case' 0 N--CA 1.449 -0.499 0 N-CA-C 108.25 -1.018 . . . . 0.0 108.25 159.848 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 20.1 t80 -117.93 137.1 53.06 Favored 'General case' 0 N--CA 1.447 -0.624 0 C-N-CA 127.845 2.458 . . . . 0.0 106.472 174.636 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 47.9 t0 -100.62 86.72 0.69 Allowed Pre-proline 0 C--N 1.327 -0.384 0 C-N-CA 128.088 2.555 . . . . 0.0 108.359 -179.648 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_endo -66.0 -11.9 33.03 Favored 'Trans proline' 0 N--CA 1.458 -0.593 0 C-N-CA 122.162 1.908 . . . . 0.0 114.244 177.646 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 56.7 mm-40 -63.51 -52.99 58.86 Favored 'General case' 0 C--O 1.233 0.196 0 N-CA-C 107.164 -1.421 . . . . 0.0 107.164 173.276 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 45.4 p -110.35 -32.53 6.92 Favored 'General case' 0 CA--C 1.532 0.274 0 N-CA-C 114.112 1.153 . . . . 0.0 114.112 -169.564 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 106.74 12.16 25.06 Favored Glycine 0 CA--C 1.529 0.968 0 C-N-CA 124.994 1.283 . . . . 0.0 113.378 -175.816 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 50.7 mt -87.58 169.52 12.1 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 118.57 1.185 . . . . 0.0 109.701 178.453 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 42.7 m-85 -112.02 161.53 16.36 Favored 'General case' 0 C--O 1.234 0.284 0 O-C-N 121.454 -0.779 . . . . 0.0 109.062 163.076 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 93.3 t80 -142.63 152.67 42.72 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 126.077 1.751 . . . . 0.0 108.685 -176.384 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -124.15 144.18 44.68 Favored Pre-proline 0 N--CA 1.467 0.38 0 CA-C-N 118.777 0.717 . . . . 0.0 109.892 177.11 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -72.99 -34.25 6.65 Favored 'Trans proline' 0 N--CA 1.456 -0.727 0 C-N-CA 122.263 1.975 . . . . 0.0 114.271 -177.366 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -77.65 -27.59 51.04 Favored 'General case' 0 CA--C 1.517 -0.323 0 CA-C-N 120.043 1.292 . . . . 0.0 112.617 172.791 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -134.08 83.66 2.06 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 106.833 -1.543 . . . . 0.0 106.833 -153.522 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -60.23 -6.77 1.59 Allowed 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 126.167 1.787 . . . . 0.0 114.18 -165.754 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 39.1 m-85 -65.04 123.57 19.82 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 123.956 0.902 . . . . 0.0 110.048 171.766 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 38.8 m-85 -75.44 152.86 37.9 Favored 'General case' 0 N--CA 1.45 -0.451 0 N-CA-C 108.688 -0.856 . . . . 0.0 108.688 174.046 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 9.0 t80 -114.42 109.12 17.83 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 126.099 1.76 . . . . 0.0 106.641 -177.885 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 44.7 t30 -83.62 77.15 9.9 Favored 'General case' 0 N--CA 1.445 -0.688 0 C-N-CA 125.272 1.429 . . . . 0.0 107.357 171.129 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -52.18 -33.14 39.37 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 123.017 0.527 . . . . 0.0 110.32 178.667 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -47.78 -32.04 5.55 Favored 'General case' 0 N--CA 1.448 -0.548 0 C-N-CA 127.663 2.385 . . . . 0.0 114.74 178.069 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 19.9 m -138.36 25.96 2.64 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 123.851 0.86 . . . . 0.0 110.039 170.12 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 24.5 mt-30 52.35 18.44 0.92 Allowed 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 127.503 2.321 . . . . 0.0 114.893 -176.859 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -95.52 159.58 14.92 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 123.638 0.775 . . . . 0.0 110.535 -166.942 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 9.5 m-85 -114.12 127.15 55.78 Favored 'General case' 0 CA--C 1.516 -0.358 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 -169.947 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 53.2 mt -126.53 174.63 8.51 Favored 'General case' 0 C--N 1.324 -0.54 0 C-N-CA 124.415 1.086 . . . . 0.0 108.691 -170.066 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 13.5 p90 -134.59 153.49 51.94 Favored 'General case' 0 N--CA 1.447 -0.608 0 N-CA-C 106.881 -1.526 . . . . 0.0 106.881 162.072 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 46.9 t-105 -78.28 127.69 32.61 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 105.713 -1.958 . . . . 0.0 105.713 164.703 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 19.9 t0 -110.24 108.78 19.02 Favored 'General case' 0 CA--C 1.515 -0.378 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 166.475 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -72.57 -15.39 77.57 Favored Glycine 0 N--CA 1.441 -1.003 0 CA-C-O 116.84 -2.089 . . . . 0.0 112.831 176.266 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -69.87 -56.18 7.76 Favored 'General case' 0 C--N 1.346 0.442 0 CA-C-N 121.021 2.411 . . . . 0.0 107.596 176.667 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 62.3 mtt85 -80.96 -3.97 53.41 Favored 'General case' 0 N--CA 1.456 -0.136 0 C-N-CA 124.047 0.939 . . . . 0.0 113.148 178.937 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 42.0 mtt180 43.36 58.18 3.52 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 126.982 2.113 . . . . 0.0 109.7 -175.276 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 6.2 t -153.88 157.45 39.29 Favored 'General case' 0 N--CA 1.448 -0.563 0 N-CA-C 107.143 -1.428 . . . . 0.0 107.143 176.759 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 71.7 m-85 -86.88 132.07 33.92 Favored 'General case' 0 C--O 1.237 0.398 0 N-CA-C 106.202 -1.777 . . . . 0.0 106.202 169.662 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -125.8 154.48 73.38 Favored Pre-proline 0 C--N 1.322 -0.627 0 C-N-CA 125.124 1.37 . . . . 0.0 110.391 -176.682 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -72.22 130.3 16.21 Favored 'Trans proline' 0 N--CA 1.454 -0.834 0 C-N-CA 122.523 2.149 . . . . 0.0 110.253 -178.112 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -91.36 14.54 14.31 Favored 'General case' 0 C--O 1.235 0.297 0 N-CA-C 112.992 0.738 . . . . 0.0 112.992 -178.539 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 5.7 mp -71.33 -44.44 65.11 Favored 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 124.869 1.268 . . . . 0.0 112.005 -169.461 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -152.27 -49.74 0.11 Allowed 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 107.302 -1.369 . . . . 0.0 107.302 -165.56 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 61.91 26.85 16.28 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 124.954 1.302 . . . . 0.0 111.273 173.659 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 27.2 m -163.6 96.45 0.84 Allowed 'General case' 0 N--CA 1.453 -0.317 0 N-CA-C 106.456 -1.683 . . . . 0.0 106.456 -177.308 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -156.92 170.23 22.98 Favored 'General case' 0 N--CA 1.448 -0.569 0 N-CA-C 108.04 -1.096 . . . . 0.0 108.04 173.176 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -72.3 -17.96 61.83 Favored 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 124.171 0.988 . . . . 0.0 112.795 -169.175 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 150.0 -15.98 1.04 Allowed Glycine 0 CA--C 1.525 0.692 0 C-N-CA 124.704 1.145 . . . . 0.0 113.068 175.016 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 14.6 m-70 -61.39 -50.35 73.21 Favored 'General case' 0 C--O 1.226 -0.168 0 CA-C-N 118.222 1.011 . . . . 0.0 109.695 165.857 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . 0.305 0.0 OUTLIER 52.28 9.42 0.1 Allowed 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 128.861 2.864 . . . . 0.0 116.34 174.07 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -77.95 -40.79 38.37 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 125.504 1.522 . . . . 0.0 110.652 -173.165 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -157.62 -40.83 0.07 Allowed 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 124.629 1.172 . . . . 0.0 109.328 -177.857 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 174.89 -145.76 8.09 Favored Glycine 0 CA--C 1.524 0.623 0 N-CA-C 111.197 -0.761 . . . . 0.0 111.197 -167.6 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -144.48 165.34 23.67 Favored Pre-proline 0 CA--C 1.538 0.515 0 C-N-CA 125.887 1.675 . . . . 0.0 110.282 -175.208 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 98.9 Cg_endo -69.55 -164.34 0.12 Allowed 'Trans proline' 0 CA--C 1.543 0.946 0 C-N-CA 123.888 3.058 . . . . 0.0 109.824 155.557 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 63.25 8.44 3.39 Favored 'General case' 0 CA--C 1.549 0.918 0 O-C-N 120.415 -1.428 . . . . 0.0 112.543 179.367 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.99 -6.21 51.63 Favored 'General case' 0 N--CA 1.467 0.409 0 O-C-N 120.124 -1.61 . . . . 0.0 112.517 178.188 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 177.11 -46.3 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.131 0 C-N-CA 126.486 1.914 . . . . 0.0 106.12 -168.861 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -78.92 76.41 1.91 Allowed Glycine 0 N--CA 1.447 -0.573 0 C-N-CA 126.268 1.89 . . . . 0.0 110.344 -165.09 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 37.8 mttm 60.84 49.01 6.36 Favored 'General case' 0 N--CA 1.466 0.332 0 C-N-CA 126.288 1.835 . . . . 0.0 110.149 172.878 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.03 -57.19 13.17 Favored 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 127.337 2.255 . . . . 0.0 112.586 166.472 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 46.4 pttt -130.04 12.55 5.66 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 124.023 0.929 . . . . 0.0 113.197 -163.293 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 34.4 mmtp -133.03 93.56 3.21 Favored 'General case' 0 CA--C 1.516 -0.332 0 N-CA-C 106.724 -1.584 . . . . 0.0 106.724 -179.888 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -79.2 10.87 3.2 Favored 'General case' 0 CA--C 1.536 0.433 0 N-CA-C 113.099 0.777 . . . . 0.0 113.099 -176.08 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . 0.256 23.7 pttm 48.34 -153.63 0.09 Allowed 'General case' 0 N--CA 1.474 0.734 0 CA-C-N 119.661 1.119 . . . . 0.0 108.441 -173.784 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -133.1 49.88 2.28 Favored 'General case' 0 CA--C 1.535 0.371 0 O-C-N 120.901 -1.124 . . . . 0.0 108.03 172.575 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.414 ' HG3' ' H ' ' A' ' 91' ' ' THR . 18.3 tptt 49.31 -164.61 0.03 OUTLIER 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 107.884 -1.154 . . . . 0.0 107.884 -142.927 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 91' ' ' THR . . . . . 0.414 ' H ' ' HG3' ' A' ' 90' ' ' LYS . 1.8 m -152.92 111.7 3.75 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 102.144 -3.28 . . . . 0.0 102.144 153.214 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 92' ' ' LYS . . . . . 0.457 ' HE2' ' C ' ' A' ' 92' ' ' LYS . 0.2 OUTLIER . . . . . 0 C--O 1.245 0.824 0 N-CA-C 103.559 -2.756 . . . . 0.0 103.559 172.787 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.121 0 N-CA-C 108.397 -1.881 . . . . 0.0 108.397 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 30.0 m170 -64.38 -23.45 67.3 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-N 118.813 1.307 . . . . 0.0 110.457 162.453 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 17.5 ptt? -136.26 175.94 9.14 Favored 'General case' 0 C--O 1.243 0.758 0 C-N-CA 127.85 2.46 . . . . 0.0 107.017 170.506 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -151.88 125.48 8.93 Favored 'General case' 0 N--CA 1.453 -0.287 0 N-CA-C 105.812 -1.921 . . . . 0.0 105.812 153.152 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -131.11 -74.39 0.53 Allowed 'General case' 0 C--O 1.237 0.443 0 N-CA-C 105.727 -1.953 . . . . 0.0 105.727 174.56 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.5 t 60.93 30.43 19.62 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 125.213 1.405 . . . . 0.0 110.093 -178.238 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 18.2 p90 -152.15 160.12 43.47 Favored 'General case' 0 N--CA 1.443 -0.782 0 C-N-CA 125.321 1.448 . . . . 0.0 108.255 168.748 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -144.39 -177.49 5.5 Favored 'General case' 0 C--O 1.24 0.557 0 O-C-N 121.742 -0.598 . . . . 0.0 111.326 171.306 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -105.36 -175.58 2.83 Favored 'General case' 0 N--CA 1.443 -0.808 0 C-N-CA 125.018 1.327 . . . . 0.0 108.928 164.117 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 36.6 m-85 -80.09 161.22 66.37 Favored Pre-proline 0 CA--C 1.539 0.52 0 CA-C-O 119.119 -0.467 . . . . 0.0 110.0 -173.995 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -66.09 169.55 13.37 Favored 'Trans proline' 0 C--N 1.349 0.57 0 C-N-CA 123.78 2.987 . . . . 0.0 109.828 172.803 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 38.8 t -111.94 85.4 6.42 Favored Pre-proline 0 CA--C 1.539 0.547 0 N-CA-C 107.659 -1.237 . . . . 0.0 107.659 177.668 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -72.92 178.38 6.52 Favored 'Trans proline' 0 N--CA 1.457 -0.643 0 C-N-CA 123.669 2.913 . . . . 0.0 111.035 177.285 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -159.3 32.21 0.2 Allowed 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 113.367 0.877 . . . . 0.0 113.367 -177.285 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . 0.373 11.9 p 42.88 23.25 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.553 1.08 0 C-N-CA 128.072 2.549 . . . . 0.0 113.085 -173.805 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 7.5 t -113.51 -12.73 12.88 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 127.795 2.438 . . . . 0.0 109.287 -174.746 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 2.8 p -112.7 1.57 15.73 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 124.516 1.127 . . . . 0.0 111.08 -179.945 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 11.5 m-30 -85.0 173.27 10.65 Favored 'General case' 0 C--N 1.341 0.235 0 C-N-CA 124.597 1.159 . . . . 0.0 111.344 -167.294 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 68.5 mt-30 -119.89 99.1 6.43 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 126.023 1.729 . . . . 0.0 108.541 -174.297 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 87.1 t80 -58.18 143.82 42.83 Favored 'General case' 0 C--N 1.326 -0.422 0 O-C-N 122.302 -0.249 . . . . 0.0 111.012 171.246 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 4.1 t0 -122.64 112.68 18.26 Favored 'General case' 0 CA--C 1.515 -0.379 0 C-N-CA 123.902 0.881 . . . . 0.0 109.802 172.716 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -63.46 -19.36 64.66 Favored 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 124.794 1.238 . . . . 0.0 112.974 176.875 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 3.2 t -59.48 -32.81 70.61 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 123.445 0.698 . . . . 0.0 111.643 176.62 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 66.6 m -132.6 -20.54 2.3 Favored 'General case' 0 N--CA 1.462 0.162 0 C-N-CA 123.953 0.901 . . . . 0.0 112.209 -173.781 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 86.83 10.9 71.6 Favored Glycine 0 CA--C 1.526 0.737 0 C-N-CA 124.084 0.849 . . . . 0.0 111.942 -179.684 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 5.0 m-85 -96.87 168.74 10.3 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-N 118.429 1.115 . . . . 0.0 108.438 -177.313 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 93.8 m-85 -100.94 141.18 34.2 Favored 'General case' 0 N--CA 1.45 -0.44 0 N-CA-C 107.404 -1.332 . . . . 0.0 107.404 171.205 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 39.0 t80 -107.6 139.79 41.59 Favored 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 125.532 1.533 . . . . 0.0 107.634 175.03 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 62.3 t0 -104.1 87.27 1.53 Allowed Pre-proline 0 C--N 1.328 -0.347 0 C-N-CA 126.108 1.763 . . . . 0.0 111.672 -178.734 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -61.5 -12.48 24.61 Favored 'Trans proline' 0 N--CA 1.457 -0.659 0 C-N-CA 122.505 2.137 . . . . 0.0 114.289 176.959 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 22.4 mm-40 -72.7 -30.12 63.95 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-N 119.205 0.911 . . . . 0.0 110.599 178.65 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 22.0 p -120.54 -50.28 2.21 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 124.657 1.183 . . . . 0.0 109.276 -166.947 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 101.12 46.11 1.77 Allowed Glycine 0 CA--C 1.525 0.709 0 N-CA-C 108.995 -1.642 . . . . 0.0 108.995 -168.68 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 20.9 mt -126.57 171.19 11.31 Favored 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 125.384 1.474 . . . . 0.0 109.295 176.682 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 51.0 m-85 -114.69 164.79 13.56 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 124.69 1.196 . . . . 0.0 108.672 166.18 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 50.3 t80 -145.64 152.11 39.13 Favored 'General case' 0 C--O 1.239 0.518 0 C-N-CA 126.873 2.069 . . . . 0.0 107.576 179.025 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -121.9 143.83 39.54 Favored Pre-proline 0 CA--C 1.535 0.39 0 C-N-CA 123.421 0.689 . . . . 0.0 109.636 175.219 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo -76.33 -25.68 9.62 Favored 'Trans proline' 0 N--CA 1.458 -0.593 0 C-N-CA 121.953 1.768 . . . . 0.0 113.236 -176.093 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 26.8 m-20 -90.9 -21.21 21.51 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 119.538 1.063 . . . . 0.0 112.676 175.262 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 86.4 p -129.26 91.12 3.13 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 123.861 0.864 . . . . 0.0 109.597 179.406 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -56.02 -5.96 0.21 Allowed 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 128.71 2.804 . . . . 0.0 115.63 -171.71 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 54.5 m-85 -68.95 158.47 34.6 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 123.861 0.864 . . . . 0.0 108.851 172.755 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 31.6 m-85 -105.26 133.16 50.48 Favored 'General case' 0 N--CA 1.449 -0.518 0 N-CA-C 108.286 -1.005 . . . . 0.0 108.286 179.788 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 74.6 t80 -90.28 118.18 29.59 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 107.982 -1.118 . . . . 0.0 107.982 175.517 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 20.9 t30 -96.49 86.2 4.09 Favored 'General case' 0 N--CA 1.442 -0.831 0 C-N-CA 126.328 1.851 . . . . 0.0 107.941 179.08 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -50.3 -36.27 31.03 Favored 'General case' 0 N--CA 1.463 0.223 0 C-N-CA 123.957 0.903 . . . . 0.0 111.544 179.584 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 3.8 tt0 -47.19 -37.97 11.15 Favored 'General case' 0 N--CA 1.446 -0.633 0 C-N-CA 127.284 2.234 . . . . 0.0 113.126 -176.764 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 13.6 m -135.79 24.3 3.36 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 124.588 1.155 . . . . 0.0 109.76 176.422 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . 0.364 4.6 pt20 44.65 23.72 0.08 Allowed 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 129.052 2.941 . . . . 0.0 114.403 -175.36 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -92.43 172.18 8.56 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 126.507 1.923 . . . . 0.0 111.361 -171.186 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 4.9 m-85 -118.28 131.55 56.34 Favored 'General case' 0 N--CA 1.45 -0.428 0 N-CA-C 106.965 -1.495 . . . . 0.0 106.965 -177.77 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 48.9 mt -125.92 176.69 6.8 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 126.156 1.782 . . . . 0.0 107.859 -177.063 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 13.9 p90 -139.83 149.35 43.36 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 107.706 -1.22 . . . . 0.0 107.706 168.274 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 39.7 t-105 -78.13 127.19 31.92 Favored 'General case' 0 C--O 1.239 0.506 0 N-CA-C 107.46 -1.311 . . . . 0.0 107.46 172.277 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -120.81 86.88 2.65 Favored 'General case' 0 CA--C 1.512 -0.496 0 CA-C-O 121.631 0.729 . . . . 0.0 109.516 -179.634 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -58.71 -19.33 42.33 Favored Glycine 0 CA--C 1.526 0.778 0 CA-C-O 118.648 -1.085 . . . . 0.0 111.996 175.891 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -59.6 -34.75 73.14 Favored 'General case' 0 C--N 1.342 0.28 0 CA-C-N 118.989 1.395 . . . . 0.0 109.368 176.553 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 21.6 mtt180 -121.77 -1.55 9.44 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 127.232 2.213 . . . . 0.0 111.509 -171.997 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 60.1 mtt180 44.26 54.39 6.16 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 127.715 2.406 . . . . 0.0 111.489 -171.17 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 10.2 t -148.68 175.56 11.1 Favored 'General case' 0 C--N 1.328 -0.357 0 O-C-N 122.047 -0.408 . . . . 0.0 109.947 175.473 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 87.9 m-85 -98.96 134.78 41.32 Favored 'General case' 0 C--O 1.237 0.405 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 168.149 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -126.44 154.81 75.05 Favored Pre-proline 0 C--N 1.322 -0.627 0 C-N-CA 125.667 1.587 . . . . 0.0 109.359 176.841 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_endo -76.65 122.46 6.43 Favored 'Trans proline' 0 N--CA 1.46 -0.499 0 C-N-CA 123.099 2.533 . . . . 0.0 112.26 -174.276 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -82.64 24.92 0.68 Allowed 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 124.691 1.196 . . . . 0.0 112.999 -178.219 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -57.34 114.43 2.19 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 124.82 1.248 . . . . 0.0 108.215 174.626 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.417 ' HG3' ' H ' ' A' ' 68' ' ' SER 0.258 4.9 tp10 64.33 -74.53 0.05 OUTLIER 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 128.31 2.644 . . . . 0.0 111.831 -176.712 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 53.55 32.77 14.87 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 128.17 2.588 . . . . 0.0 113.321 -171.336 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 68' ' ' SER . . . . . 0.417 ' H ' ' HG3' ' A' ' 66' ' ' GLU . 0.5 OUTLIER -156.25 -5.24 0.11 Allowed 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 114.955 1.465 . . . . 0.0 114.955 -178.764 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -165.16 179.45 6.32 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 125.05 1.34 . . . . 0.0 109.663 -175.848 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -69.64 -52.18 28.16 Favored 'General case' 0 CA--C 1.534 0.341 0 O-C-N 121.722 -0.612 . . . . 0.0 110.685 -174.973 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 152.99 -115.92 0.71 Allowed Glycine 0 CA--C 1.527 0.804 0 C-N-CA 124.531 1.063 . . . . 0.0 111.079 173.687 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER 67.93 11.21 8.27 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 128.071 2.548 . . . . 0.0 111.494 -162.981 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 8.7 pttt -165.48 153.99 11.62 Favored 'General case' 0 C--O 1.235 0.302 0 O-C-N 120.359 -1.463 . . . . 0.0 109.186 -173.111 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -84.86 121.35 27.6 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 106.66 -1.607 . . . . 0.0 106.66 160.812 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 3.8 m 46.03 -74.9 0.0 OUTLIER 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 128.167 2.587 . . . . 0.0 115.549 158.761 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -152.89 -75.22 0.01 OUTLIER Glycine 0 N--CA 1.449 -0.493 0 C-N-CA 127.028 2.251 . . . . 0.0 107.99 -173.565 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . 74.95 154.28 0.15 Allowed Pre-proline 0 CA--C 1.548 0.891 0 C-N-CA 129.084 2.954 . . . . 0.0 111.141 -170.151 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 90.8 Cg_endo -86.03 -14.44 5.09 Favored 'Trans proline' 0 C--N 1.351 0.693 0 C-N-CA 124.692 3.594 . . . . 0.0 113.683 178.865 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 1.7 p -61.75 -178.74 0.16 Allowed 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 125.503 1.521 . . . . 0.0 109.526 160.329 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 29.1 tttt 72.36 46.37 0.31 Allowed 'General case' 0 N--CA 1.453 -0.279 0 CA-C-O 123.424 1.583 . . . . 0.0 109.071 168.513 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 73.33 72.12 0.13 Allowed 'General case' 0 CA--C 1.521 -0.168 0 C-N-CA 126.507 1.923 . . . . 0.0 108.15 163.346 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -169.93 -46.84 0.03 OUTLIER Glycine 0 C--N 1.332 0.333 0 CA-C-N 115.725 -0.671 . . . . 0.0 112.273 175.213 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 48.5 tttp -151.86 25.65 0.65 Allowed 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 117.951 0.876 . . . . 0.0 110.567 -173.986 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.73 -23.33 66.72 Favored 'General case' 0 CA--C 1.551 0.995 0 O-C-N 120.724 -1.235 . . . . 0.0 114.276 -162.504 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -119.5 1.91 11.2 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 127.522 2.329 . . . . 0.0 111.438 166.199 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . 0.304 0.0 OUTLIER 44.0 -168.25 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 127.296 2.238 . . . . 0.0 111.064 -150.431 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -109.99 -85.52 0.54 Allowed 'General case' 0 C--O 1.236 0.361 0 N-CA-C 108.418 -0.956 . . . . 0.0 108.418 -176.647 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -134.45 157.76 45.65 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 119.681 1.128 . . . . 0.0 110.561 177.018 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -82.57 -78.29 0.21 Allowed 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 108.075 -1.083 . . . . 0.0 108.075 172.951 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -157.64 8.34 0.16 Allowed 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 125.46 1.504 . . . . 0.0 111.577 -162.91 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 10.9 m 69.25 90.16 0.1 Allowed 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 125.609 1.563 . . . . 0.0 108.215 -165.082 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.104 0 C-N-CA 127.449 2.3 . . . . 0.0 107.065 172.634 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.72 0 N-CA-C 110.623 -0.991 . . . . 0.0 110.623 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 5.1 t60 75.38 97.92 0.07 Allowed 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 126.269 1.827 . . . . 0.0 110.006 -172.788 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 2.7 tpt 49.44 65.51 1.38 Allowed 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 126.449 1.899 . . . . 0.0 112.138 -178.025 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 68.5 mt-30 -66.58 117.9 9.42 Favored 'General case' 0 CA--C 1.534 0.338 0 O-C-N 121.514 -0.741 . . . . 0.0 109.26 168.307 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -79.36 -80.33 0.12 Allowed 'General case' 0 CA--C 1.532 0.273 0 N-CA-C 107.633 -1.247 . . . . 0.0 107.633 160.443 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 57.9 m 45.4 70.28 0.37 Allowed 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 125.256 1.422 . . . . 0.0 110.821 -163.32 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 3.3 p90 43.96 70.12 0.35 Allowed 'General case' 0 CA--C 1.515 -0.376 0 C-N-CA 127.095 2.158 . . . . 0.0 112.135 159.899 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -141.53 105.91 4.84 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-N 113.11 -1.859 . . . . 0.0 107.246 -173.053 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 1.4 pt20 -152.32 -171.78 4.04 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 126.162 1.785 . . . . 0.0 107.679 168.145 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 32.6 m-85 -88.47 159.36 47.2 Favored Pre-proline 0 CA--C 1.532 0.282 0 O-C-N 120.814 -1.179 . . . . 0.0 109.979 174.438 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 95.5 Cg_endo -67.91 177.7 4.06 Favored 'Trans proline' 0 N--CA 1.454 -0.834 0 C-N-CA 121.782 1.654 . . . . 0.0 109.023 161.282 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 45.7 t -104.71 86.27 1.4 Allowed Pre-proline 0 CA--C 1.537 0.46 0 C-N-CA 124.27 1.028 . . . . 0.0 109.162 -173.093 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_endo -69.62 153.69 69.25 Favored 'Trans proline' 0 N--CA 1.456 -0.694 0 C-N-CA 122.015 1.81 . . . . 0.0 110.386 -178.302 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -136.3 133.17 36.63 Favored 'General case' 0 C--O 1.235 0.305 0 C-N-CA 123.193 0.597 . . . . 0.0 111.808 -176.231 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.401 ' HA ' ' CD2' ' A' ' 18' ' ' TYR . 10.8 p -56.62 -25.95 22.33 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.407 0 C-N-CA 125.382 1.473 . . . . 0.0 113.544 -178.968 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 2.0 t -61.8 -12.3 16.52 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.999 0.919 . . . . 0.0 112.039 174.576 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 37.0 p -113.41 1.06 14.96 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.633 1.173 . . . . 0.0 111.723 -179.648 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.401 ' CD2' ' HA ' ' A' ' 15' ' ' VAL . 15.3 m-30 -79.77 166.56 21.62 Favored 'General case' 0 C--O 1.238 0.499 0 O-C-N 120.858 -1.151 . . . . 0.0 110.159 179.984 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 28.0 mt-30 -105.31 112.55 25.7 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 124.728 1.211 . . . . 0.0 108.573 175.356 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 61.5 t80 -61.34 137.66 58.24 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 108.558 -0.904 . . . . 0.0 108.558 169.86 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 22.2 t0 -117.74 70.44 0.79 Allowed 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 125.932 1.693 . . . . 0.0 109.436 -172.389 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.55 -3.79 1.63 Allowed 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 115.527 1.677 . . . . 0.0 115.527 -169.224 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 1.3 t -65.94 -27.17 67.97 Favored 'General case' 0 C--N 1.315 -0.897 0 C-N-CA 126.659 1.984 . . . . 0.0 111.795 164.979 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 25.0 p -127.78 -25.83 3.04 Favored 'General case' 0 C--O 1.237 0.419 0 CA-C-N 120.169 1.35 . . . . 0.0 112.464 174.914 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 96.64 9.5 56.39 Favored Glycine 0 CA--C 1.533 1.201 0 CA-C-N 118.737 0.698 . . . . 0.0 112.39 177.206 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 8.3 m-85 -100.58 177.29 5.05 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.774 1.63 . . . . 0.0 109.1 178.119 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 77.9 m-85 -101.59 139.55 37.1 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 106.997 -1.483 . . . . 0.0 106.997 166.698 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 17.4 t80 -101.97 135.62 43.21 Favored 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 125.827 1.651 . . . . 0.0 107.099 172.956 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -110.55 85.08 4.42 Favored Pre-proline 0 N--CA 1.442 -0.863 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 -171.004 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_endo -61.36 -13.5 29.25 Favored 'Trans proline' 0 C--N 1.348 0.511 0 C-N-CA 122.388 2.059 . . . . 0.0 113.362 -179.919 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 98.6 mm-40 -60.64 -28.96 68.95 Favored 'General case' 0 N--CA 1.448 -0.567 0 C-N-CA 124.877 1.271 . . . . 0.0 111.423 178.697 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 12.6 p -145.96 -18.17 0.45 Allowed 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 113.664 0.987 . . . . 0.0 113.664 -176.745 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 99.53 7.57 53.71 Favored Glycine 0 CA--C 1.531 1.059 0 CA-C-N 119.446 1.021 . . . . 0.0 114.065 179.23 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 40.0 mt -85.69 179.51 7.07 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 124.847 1.259 . . . . 0.0 109.612 175.249 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 25.0 m-85 -118.91 159.79 23.14 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 124.329 1.052 . . . . 0.0 109.35 162.815 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 71.1 t80 -127.19 165.68 19.15 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 128.402 2.681 . . . . 0.0 109.128 173.993 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 6.1 t0 -137.77 144.1 42.97 Favored Pre-proline 0 N--CA 1.465 0.283 0 O-C-N 120.735 -1.228 . . . . 0.0 108.294 177.829 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 68.9 Cg_endo -71.62 -30.49 14.69 Favored 'Trans proline' 0 N--CA 1.454 -0.808 0 C-N-CA 121.354 1.37 . . . . 0.0 113.422 -175.281 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 77.2 m-20 -87.77 -28.53 21.65 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 125.139 1.375 . . . . 0.0 110.483 175.411 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 1.6 m -117.76 95.47 4.94 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 123.775 0.83 . . . . 0.0 109.572 -176.084 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 20.4 mp0 -62.18 -2.79 1.05 Allowed 'General case' 0 CA--C 1.547 0.843 0 O-C-N 121.387 -0.821 . . . . 0.0 111.758 166.676 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 17.8 m-85 -70.57 98.87 1.55 Allowed 'General case' 0 N--CA 1.444 -0.736 0 C-N-CA 125.39 1.476 . . . . 0.0 107.538 162.736 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 34.3 m-85 -59.27 153.85 17.73 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 125.204 1.402 . . . . 0.0 110.072 175.418 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 76.8 t80 -110.19 113.45 26.14 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 125.011 1.324 . . . . 0.0 108.514 177.826 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 38.7 t30 -87.45 81.58 7.77 Favored 'General case' 0 N--CA 1.445 -0.695 0 C-N-CA 125.22 1.408 . . . . 0.0 108.888 177.553 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -44.9 -38.46 4.66 Favored 'General case' 0 C--N 1.341 0.202 0 C-N-CA 124.273 1.029 . . . . 0.0 111.723 176.07 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 4.4 tt0 -44.41 -38.85 4.29 Favored 'General case' 0 N--CA 1.446 -0.626 0 C-N-CA 127.843 2.457 . . . . 0.0 113.054 -177.376 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 70.8 m -136.61 16.17 3.13 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 124.305 1.042 . . . . 0.0 111.726 176.852 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 25.7 mt-30 58.77 14.89 3.44 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 126.855 2.062 . . . . 0.0 113.494 -173.297 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 41.2 mm-40 -77.31 167.06 22.34 Favored 'General case' 0 C--N 1.334 -0.07 0 O-C-N 121.139 -0.976 . . . . 0.0 111.459 -177.209 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 37.0 m-85 -114.27 132.8 56.02 Favored 'General case' 0 C--O 1.236 0.347 0 C-N-CA 124.145 0.978 . . . . 0.0 109.97 172.141 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 66.6 mt -129.81 179.91 5.57 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 126.55 1.94 . . . . 0.0 108.801 -173.609 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 23.6 p90 -144.64 157.98 43.97 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 124.012 0.925 . . . . 0.0 109.685 165.425 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 54.5 t-105 -89.18 125.49 35.08 Favored 'General case' 0 C--O 1.237 0.434 0 N-CA-C 107.121 -1.437 . . . . 0.0 107.121 170.276 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -120.99 108.69 14.18 Favored 'General case' 0 CA--C 1.516 -0.328 0 CA-C-O 121.304 0.573 . . . . 0.0 110.578 177.557 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -72.6 -1.75 53.84 Favored Glycine 0 CA--C 1.526 0.723 0 CA-C-O 117.99 -1.45 . . . . 0.0 114.294 -172.792 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 2.9 pt-20 -76.23 -54.49 6.72 Favored 'General case' 0 C--N 1.339 0.138 0 CA-C-N 120.072 1.936 . . . . 0.0 110.255 171.511 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 13.0 mtt180 -88.42 -8.11 55.51 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 124.17 0.988 . . . . 0.0 110.567 -177.856 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 3.3 mpt_? 44.88 59.46 3.41 Favored 'General case' 0 C--N 1.342 0.263 0 C-N-CA 125.988 1.715 . . . . 0.0 109.321 -174.326 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 8.4 t -148.88 179.49 7.81 Favored 'General case' 0 C--O 1.238 0.457 0 N-CA-C 108.766 -0.828 . . . . 0.0 108.766 175.917 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 72.0 m-85 -104.32 132.29 50.74 Favored 'General case' 0 C--O 1.241 0.641 0 C-N-CA 123.878 0.871 . . . . 0.0 109.656 172.853 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -127.57 154.96 77.62 Favored Pre-proline 0 C--N 1.326 -0.421 0 C-N-CA 126.638 1.975 . . . . 0.0 110.631 -178.671 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_endo -70.12 131.18 20.2 Favored 'Trans proline' 0 CA--C 1.534 0.5 0 C-N-CA 123.321 2.681 . . . . 0.0 111.732 174.483 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -95.87 63.97 2.4 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 124.729 1.211 . . . . 0.0 108.981 178.693 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 90.7 mt -125.75 97.68 5.24 Favored 'General case' 0 CA--C 1.519 -0.242 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 -166.395 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 75.21 -14.35 0.77 Allowed 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 127.219 2.208 . . . . 0.0 113.112 -171.093 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 4.0 tm0? -45.1 120.04 2.25 Favored 'General case' 0 C--O 1.238 0.487 0 C-N-CA 125.622 1.569 . . . . 0.0 109.382 165.268 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 4.1 m -177.01 108.68 0.07 Allowed 'General case' 0 N--CA 1.447 -0.585 0 C-N-CA 129.012 2.925 . . . . 0.0 106.388 179.519 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 58.02 -174.78 0.08 Allowed 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 126.1 1.76 . . . . 0.0 113.923 176.807 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -106.66 116.81 32.58 Favored 'General case' 0 C--O 1.239 0.533 0 C-N-CA 125.492 1.517 . . . . 0.0 107.727 -166.93 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -140.95 20.73 2.68 Favored Glycine 0 CA--C 1.538 1.525 0 C-N-CA 126.472 1.987 . . . . 0.0 112.894 -178.826 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 9.2 t-160 51.56 52.53 14.49 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 127.959 2.503 . . . . 0.0 112.069 179.602 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 40.5 mtmt -135.63 151.8 50.6 Favored 'General case' 0 C--O 1.234 0.252 0 C-N-CA 124.667 1.187 . . . . 0.0 108.402 177.587 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' GLU . . . . . 0.402 ' O ' ' HB ' ' A' ' 75' ' ' THR . 0.2 OUTLIER -72.12 73.14 0.91 Allowed 'General case' 0 C--O 1.233 0.212 0 N-CA-C 107.846 -1.168 . . . . 0.0 107.846 171.303 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 75' ' ' THR . . . . . 0.402 ' HB ' ' O ' ' A' ' 74' ' ' GLU . 77.2 m 72.64 -46.51 0.65 Allowed 'General case' 0 CA--C 1.536 0.418 0 O-C-N 120.861 -1.15 . . . . 0.0 112.314 172.804 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 166.81 46.86 0.02 OUTLIER Glycine 0 N--CA 1.444 -0.809 0 O-C-N 121.311 -0.868 . . . . 0.0 111.68 -153.222 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -116.63 69.11 4.27 Favored Pre-proline 0 CA--C 1.541 0.628 0 CA-C-N 117.93 0.865 . . . . 0.0 111.093 172.07 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 64.9 Cg_endo -74.03 -4.04 14.76 Favored 'Trans proline' 0 CA--C 1.541 0.86 1 C-N-CA 125.478 4.119 . . . . 0.0 114.815 -175.743 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 70.1 m 50.73 28.69 3.73 Favored 'General case' 0 CA--C 1.544 0.725 0 N-CA-C 116.656 2.095 . . . . 0.0 116.656 165.755 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 1.3 mtpt -127.93 28.88 5.51 Favored 'General case' 0 N--CA 1.473 0.678 0 O-C-N 121.058 -1.026 . . . . 0.0 111.068 170.031 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 12.6 tp10 -124.13 15.98 9.16 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.56 1.144 . . . . 0.0 110.779 174.072 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 82.32 -0.31 89.07 Favored Glycine 0 CA--C 1.529 0.946 0 O-C-N 120.888 -1.132 . . . . 0.0 113.853 170.358 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 9.3 ptmt -98.16 11.17 38.62 Favored 'General case' 0 C--O 1.222 -0.382 0 CA-C-N 119.428 1.614 . . . . 0.0 110.254 168.534 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -52.13 -13.8 0.36 Allowed 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 129.816 3.246 . . . . 0.0 115.298 174.928 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 44.8 pttt -114.86 3.5 14.63 Favored 'General case' 0 C--O 1.233 0.232 0 C-N-CA 125.805 1.642 . . . . 0.0 111.117 -178.333 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 40.2 pttt -148.26 33.98 0.81 Allowed 'General case' 0 N--CA 1.453 -0.307 0 CA-C-O 117.622 -1.18 . . . . 0.0 112.853 -170.032 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -44.26 -58.57 2.82 Favored 'General case' 0 C--O 1.233 0.236 0 C-N-CA 125.149 1.379 . . . . 0.0 111.416 -171.926 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -73.82 -76.88 0.12 Allowed 'General case' 0 C--N 1.343 0.309 0 CA-C-N 119.42 1.009 . . . . 0.0 109.977 173.03 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 23.6 t-80 -152.95 33.44 0.48 Allowed 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 123.766 0.826 . . . . 0.0 110.74 -175.011 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 3.6 ttpm? 60.55 21.96 11.72 Favored 'General case' 0 N--CA 1.474 0.749 0 O-C-N 120.662 -1.274 . . . . 0.0 110.86 -172.901 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -66.98 164.86 16.76 Favored 'General case' 0 N--CA 1.448 -0.548 0 C-N-CA 124.914 1.286 . . . . 0.0 109.964 -176.179 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 38.7 mttp . . . . . 0 C--O 1.252 1.197 0 N-CA-C 104.252 -2.499 . . . . 0.0 104.252 161.418 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.901 0 N-CA-C 109.092 -1.603 . . . . 0.0 109.092 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 53.8 m170 -74.31 152.6 39.6 Favored 'General case' 0 C--O 1.241 0.615 0 CA-C-N 119.04 1.42 . . . . 0.0 108.391 161.895 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -123.99 163.81 20.63 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 125.63 1.572 . . . . 0.0 109.113 -178.269 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 12.4 mt-30 -141.59 -61.64 0.47 Allowed 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 125.773 1.629 . . . . 0.0 107.49 168.548 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 4.8 pt-20 -98.34 -27.3 14.17 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 123.84 0.856 . . . . 0.0 111.577 -169.637 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 20.2 m 44.34 70.75 0.3 Allowed 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 126.451 1.9 . . . . 0.0 112.295 -176.061 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -105.33 152.92 22.32 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-O 121.642 0.734 . . . . 0.0 109.535 169.641 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 5.4 t -166.57 -167.22 0.96 Allowed 'General case' 0 N--CA 1.447 -0.606 0 C-N-CA 124.184 0.993 . . . . 0.0 108.666 -172.527 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 88.4 mt-30 -67.56 164.92 17.95 Favored 'General case' 0 N--CA 1.447 -0.59 0 CA-C-O 121.941 0.877 . . . . 0.0 110.607 167.159 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 18.4 m-85 -94.22 163.03 24.57 Favored Pre-proline 0 CA--C 1.543 0.68 0 C-N-CA 126.511 1.924 . . . . 0.0 110.161 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 79.0 Cg_endo -73.53 -174.31 1.61 Allowed 'Trans proline' 0 CA--C 1.539 0.726 0 C-N-CA 123.989 3.126 . . . . 0.0 111.619 176.396 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 21.2 t -106.93 86.54 2.43 Favored Pre-proline 0 CA--C 1.532 0.276 0 C-N-CA 125.56 1.544 . . . . 0.0 108.452 176.589 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 91.7 Cg_endo -66.66 159.06 52.81 Favored 'Trans proline' 0 N--CA 1.457 -0.67 0 C-N-CA 122.161 1.907 . . . . 0.0 109.335 173.754 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.2 t0 -131.02 134.3 46.56 Favored 'General case' 0 C--O 1.234 0.249 0 N-CA-C 108.333 -0.988 . . . . 0.0 108.333 171.133 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.497 ' HA ' ' CD2' ' A' ' 18' ' ' TYR . 2.9 p -57.02 -25.18 22.0 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.472 0 C-N-CA 123.999 0.92 . . . . 0.0 111.864 178.002 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 56.6 m -59.08 -20.04 49.74 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 119.305 0.957 . . . . 0.0 113.51 173.222 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 12.2 p -119.07 16.33 13.28 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 119.805 1.184 . . . . 0.0 111.914 -176.761 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.497 ' CD2' ' HA ' ' A' ' 15' ' ' VAL . 20.2 m-30 -71.89 159.57 34.05 Favored 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 160.614 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 26.4 mt-30 -111.12 114.6 27.98 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 125.787 1.635 . . . . 0.0 111.788 177.479 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 49.5 t80 -67.08 156.76 35.27 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 120.618 1.554 . . . . 0.0 113.341 -177.654 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -129.47 102.98 6.63 Favored 'General case' 0 C--N 1.342 0.273 0 N-CA-C 107.561 -1.274 . . . . 0.0 107.561 166.075 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -52.75 -29.89 29.72 Favored 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 124.795 1.238 . . . . 0.0 112.063 171.368 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 1.4 t -67.1 -20.73 65.83 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-O 117.899 -1.048 . . . . 0.0 111.987 -174.461 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 72.9 m -136.0 -9.79 2.04 Favored 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 113.795 1.035 . . . . 0.0 113.795 177.505 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 81.54 6.3 89.27 Favored Glycine 0 CA--C 1.526 0.721 0 C-N-CA 124.469 1.033 . . . . 0.0 114.007 169.243 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 5.3 m-85 -97.97 169.26 9.76 Favored 'General case' 0 C--O 1.238 0.485 0 CA-C-N 118.328 1.064 . . . . 0.0 108.746 174.819 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 56.5 m-85 -104.04 140.26 38.0 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 125.799 1.639 . . . . 0.0 108.33 175.379 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 41.6 t80 -107.58 142.42 37.53 Favored 'General case' 0 CA--C 1.512 -0.497 0 N-CA-C 107.386 -1.339 . . . . 0.0 107.386 179.666 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 11.8 m-20 -117.4 78.02 10.64 Favored Pre-proline 0 N--CA 1.441 -0.913 0 N-CA-C 107.71 -1.219 . . . . 0.0 107.71 -160.753 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 22.3 Cg_endo -64.57 -4.69 8.74 Favored 'Trans proline' 0 C--N 1.348 0.513 0 C-N-CA 124.044 3.163 . . . . 0.0 113.989 -173.706 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 99.6 mm-40 -71.89 -24.37 61.64 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-O 118.823 -0.608 . . . . 0.0 111.008 172.421 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 1.1 p -143.57 -15.9 0.64 Allowed 'General case' 0 CA--C 1.532 0.274 0 N-CA-C 114.747 1.388 . . . . 0.0 114.747 -176.061 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 89.69 12.25 62.76 Favored Glycine 0 CA--C 1.531 1.043 0 CA-C-N 119.848 1.204 . . . . 0.0 113.563 -176.198 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 55.0 mt -88.83 178.83 6.34 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.574 1.149 . . . . 0.0 109.256 178.253 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 39.3 m-85 -124.19 149.74 46.0 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 123.577 0.751 . . . . 0.0 109.164 163.583 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 41.0 t80 -118.39 150.26 39.85 Favored 'General case' 0 C--O 1.24 0.56 0 C-N-CA 126.822 2.049 . . . . 0.0 109.628 178.0 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -116.85 143.54 31.69 Favored Pre-proline 0 CA--C 1.537 0.477 0 C-N-CA 123.444 0.698 . . . . 0.0 109.516 171.784 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_endo -81.51 -22.43 5.61 Favored 'Trans proline' 0 N--CA 1.458 -0.617 0 C-N-CA 122.509 2.139 . . . . 0.0 114.922 -174.098 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 56.5 m-80 -77.38 -40.66 42.99 Favored 'General case' 0 N--CA 1.445 -0.681 0 O-C-N 120.915 -1.116 . . . . 0.0 108.675 164.406 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 38.5 m -124.54 95.61 4.59 Favored 'General case' 0 N--CA 1.452 -0.375 0 CA-C-O 122.028 0.918 . . . . 0.0 110.536 -156.965 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 20.2 mp0 -62.55 3.62 0.2 Allowed 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 125.758 1.623 . . . . 0.0 113.871 -174.388 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 19.0 m-85 -79.41 98.63 6.84 Favored 'General case' 0 N--CA 1.438 -1.034 0 C-N-CA 125.333 1.453 . . . . 0.0 108.17 -179.604 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 48.6 m-85 -59.17 120.25 8.84 Favored 'General case' 0 N--CA 1.445 -0.7 0 C-N-CA 125.706 1.603 . . . . 0.0 109.014 177.949 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 79.5 t80 -78.65 138.52 38.35 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 124.242 1.017 . . . . 0.0 108.385 176.77 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 12.0 t-20 -116.65 85.79 2.38 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 127.033 2.133 . . . . 0.0 107.256 175.025 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -45.41 -40.26 7.93 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 127.65 2.38 . . . . 0.0 111.736 178.004 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 6.5 tt0 -44.63 -41.74 6.88 Favored 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 127.397 2.279 . . . . 0.0 112.704 179.823 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 4.0 m -129.87 14.21 5.82 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 125.495 1.518 . . . . 0.0 109.774 -176.723 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . 0.411 4.5 pt20 44.38 30.64 0.49 Allowed 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 128.732 2.813 . . . . 0.0 113.989 -172.745 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -90.77 162.83 14.69 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 127.402 2.281 . . . . 0.0 110.633 -169.435 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 3.4 m-85 -110.44 131.8 54.74 Favored 'General case' 0 C--O 1.233 0.234 0 C-N-CA 124.558 1.143 . . . . 0.0 108.991 174.019 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 60.7 mt -128.67 178.08 6.58 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 126.91 2.084 . . . . 0.0 108.218 -178.129 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 9.6 p90 -138.03 148.38 45.05 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 106.807 -1.553 . . . . 0.0 106.807 166.922 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 43.8 t-105 -71.96 136.92 46.97 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 105.42 -2.067 . . . . 0.0 105.42 162.412 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -131.07 95.85 3.9 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 178.403 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -71.25 -5.5 59.26 Favored Glycine 0 CA--C 1.528 0.851 0 CA-C-O 118.722 -1.043 . . . . 0.0 112.538 -178.373 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -71.9 -58.77 3.17 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 119.496 1.648 . . . . 0.0 107.096 173.182 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 75.6 mtt-85 -80.36 -18.54 48.74 Favored 'General case' 0 C--O 1.232 0.173 0 C-N-CA 125.381 1.472 . . . . 0.0 112.636 -179.804 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 97.6 mtt180 55.93 58.84 4.12 Favored 'General case' 0 C--O 1.234 0.239 0 C-N-CA 127.094 2.157 . . . . 0.0 109.457 -173.912 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 6.2 t -155.22 -177.69 6.72 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 125.195 1.398 . . . . 0.0 108.55 175.045 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 76.0 m-85 -112.61 129.9 56.22 Favored 'General case' 0 C--O 1.238 0.477 0 C-N-CA 124.321 1.048 . . . . 0.0 108.791 172.462 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -126.29 154.74 74.66 Favored Pre-proline 0 C--N 1.326 -0.441 0 C-N-CA 126.4 1.88 . . . . 0.0 110.499 -171.53 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_endo -75.28 124.84 8.74 Favored 'Trans proline' 0 C--N 1.348 0.506 0 C-N-CA 122.927 2.418 . . . . 0.0 111.204 -178.299 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -85.97 14.59 5.92 Favored 'General case' 0 N--CA 1.467 0.411 0 N-CA-C 115.896 1.813 . . . . 0.0 115.896 -167.18 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 6.6 mp -82.35 -85.3 0.11 Allowed 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 108.817 -0.808 . . . . 0.0 108.817 -168.53 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 16.3 mt-10 -66.59 -45.75 78.22 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 118.289 0.495 . . . . 0.0 110.612 177.316 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 68.9 mt-30 48.58 36.22 7.24 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 123.77 0.828 . . . . 0.0 110.523 -166.327 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 1.4 t -169.18 49.02 0.04 OUTLIER 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 126.571 1.948 . . . . 0.0 107.815 -179.009 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -131.55 148.51 52.63 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 126.074 1.749 . . . . 0.0 110.584 -173.709 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -67.73 -47.51 69.09 Favored 'General case' 0 CA--C 1.529 0.137 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.973 174.497 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -125.08 -166.14 12.29 Favored Glycine 0 CA--C 1.522 0.478 0 C-N-CA 125.669 1.604 . . . . 0.0 110.228 -174.849 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -58.56 -59.22 5.73 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.028 0.931 . . . . 0.0 111.943 -175.897 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 99.5 mttt 49.53 -171.35 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 126.034 1.734 . . . . 0.0 112.009 -169.286 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 87.6 mt-10 -134.45 -176.76 4.32 Favored 'General case' 0 C--O 1.236 0.355 0 N-CA-C 107.438 -1.319 . . . . 0.0 107.438 172.626 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.52 -38.8 75.25 Favored 'General case' 0 CA--C 1.533 0.323 0 O-C-N 121.397 -0.814 . . . . 0.0 111.458 -178.44 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -153.48 -73.85 0.01 OUTLIER Glycine 0 N--CA 1.446 -0.692 0 N-CA-C 108.623 -1.791 . . . . 0.0 108.623 -179.716 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . 58.62 165.14 0.08 OUTLIER Pre-proline 0 CA--C 1.545 0.779 0 C-N-CA 127.193 2.197 . . . . 0.0 112.493 -171.886 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_endo -73.26 118.5 5.55 Favored 'Trans proline' 0 N--CA 1.458 -0.575 0 C-N-CA 121.48 1.453 . . . . 0.0 108.707 172.346 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 62.5 m 44.69 72.43 0.2 Allowed 'General case' 0 C--O 1.235 0.331 0 C-N-CA 125.23 1.412 . . . . 0.0 112.306 177.981 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 18.3 tptt -140.65 -12.57 1.0 Allowed 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 112.678 0.622 . . . . 0.0 112.678 176.377 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 3.0 pm0 -66.13 -4.56 7.69 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 124.196 0.999 . . . . 0.0 113.571 -178.011 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 95.29 -16.45 61.27 Favored Glycine 0 CA--C 1.531 1.062 0 O-C-N 120.373 -1.454 . . . . 0.0 112.894 -177.574 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 20.6 mmtp -77.86 5.28 9.93 Favored 'General case' 0 CA--C 1.531 0.24 0 O-C-N 120.699 -1.471 . . . . 0.0 110.255 158.076 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.491 ' HG3' ' H ' ' A' ' 85' ' ' LYS . 1.6 pt-20 -44.18 -57.32 3.5 Favored 'General case' 0 C--O 1.234 0.245 0 C-N-CA 127.745 2.418 . . . . 0.0 112.075 -160.518 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.491 ' H ' ' HG3' ' A' ' 84' ' ' GLU . 11.8 pttt -123.57 32.37 5.64 Favored 'General case' 0 N--CA 1.45 -0.425 0 C-N-CA 127.694 2.398 . . . . 0.0 109.319 -178.308 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 18.6 pttt 53.66 -163.04 0.11 Allowed 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 124.738 1.215 . . . . 0.0 112.156 -172.245 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 44.78 67.03 0.76 Allowed 'General case' 0 C--O 1.239 0.541 0 C-N-CA 128.045 2.538 . . . . 0.0 112.473 175.927 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 16.6 mtpt -65.87 132.22 48.13 Favored 'General case' 0 C--O 1.238 0.498 0 N-CA-C 108.273 -1.01 . . . . 0.0 108.273 166.823 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -145.56 -176.15 5.01 Favored 'General case' 0 C--N 1.323 -0.562 0 C-N-CA 126.016 1.726 . . . . 0.0 108.104 174.982 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 6.9 tttm -77.2 -167.17 0.84 Allowed 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 119.068 0.849 . . . . 0.0 110.931 -178.031 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 11.8 t -156.26 149.68 24.6 Favored 'General case' 0 C--O 1.238 0.459 0 N-CA-C 107.092 -1.447 . . . . 0.0 107.092 177.116 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 21.7 ttpt . . . . . 0 C--O 1.251 1.142 0 C-N-CA 125.913 1.685 . . . . 0.0 111.186 -176.721 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.603 0 N-CA-C 109.357 -1.497 . . . . 0.0 109.357 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 49.7 m-70 74.3 146.34 0.08 Allowed 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 127.676 2.39 . . . . 0.0 110.251 -176.942 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 77.2 mtp -149.79 -153.57 0.5 Allowed 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 123.538 0.735 . . . . 0.0 109.592 -170.334 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 20.0 pt20 -137.42 -178.04 5.05 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 129.093 2.957 . . . . 0.0 107.772 -176.365 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -78.01 -21.96 50.0 Favored 'General case' 0 CA--C 1.541 0.609 0 O-C-N 121.035 -1.041 . . . . 0.0 111.359 173.528 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.7 m 53.47 18.46 1.38 Allowed 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 124.346 1.058 . . . . 0.0 112.75 -161.225 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 45.6 t80 73.51 116.56 0.05 Allowed 'General case' 0 N--CA 1.446 -0.669 0 C-N-CA 129.797 3.239 . . . . 0.0 112.518 170.16 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 57.2 m -147.03 26.37 1.1 Allowed 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 115.296 -0.865 . . . . 0.0 113.089 -167.904 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 83.0 mt-30 -141.52 -178.48 5.65 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 125.371 1.468 . . . . 0.0 109.264 172.647 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 33.7 m-85 -131.21 166.05 30.66 Favored Pre-proline 0 CA--C 1.538 0.509 0 C-N-CA 127.066 2.146 . . . . 0.0 109.596 -175.489 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_endo -65.68 -171.4 0.21 Allowed 'Trans proline' 0 CA--C 1.537 0.646 0 C-N-CA 122.695 2.263 . . . . 0.0 110.339 164.031 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 61.7 t -104.92 87.29 1.79 Allowed Pre-proline 0 C--N 1.329 -0.304 0 N-CA-C 106.646 -1.612 . . . . 0.0 106.646 171.961 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.408 ' HD2' ' CZ2' ' A' ' 54' ' ' TRP . 96.8 Cg_endo -64.15 156.23 60.41 Favored 'Trans proline' 0 N--CA 1.451 -1.005 0 C-N-CA 122.226 1.951 . . . . 0.0 110.05 -177.547 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -135.12 129.29 33.67 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 123.898 0.879 . . . . 0.0 109.064 177.926 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 9.1 p -63.94 -26.44 40.56 Favored 'Isoleucine or valine' 0 C--O 1.234 0.266 0 C-N-CA 124.586 1.154 . . . . 0.0 111.531 178.758 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 41.5 m -69.6 1.77 3.82 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 119.908 1.231 . . . . 0.0 112.726 -178.103 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 7.0 t -125.9 11.0 7.7 Favored 'General case' 0 CA--C 1.545 0.777 0 O-C-N 120.899 -1.125 . . . . 0.0 111.773 169.757 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 15.0 m-30 -70.02 159.48 33.73 Favored 'General case' 0 C--O 1.24 0.581 0 O-C-N 120.525 -1.359 . . . . 0.0 111.694 172.346 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 54.6 mt-30 -82.59 135.07 35.16 Favored 'General case' 0 C--O 1.225 -0.234 0 N-CA-C 107.1 -1.444 . . . . 0.0 107.1 167.292 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 45.7 t80 -75.81 164.57 26.1 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 118.796 0.726 . . . . 0.0 109.145 160.246 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -143.04 108.82 5.13 Favored 'General case' 0 CA--C 1.51 -0.596 0 N-CA-C 108.868 -0.79 . . . . 0.0 108.868 159.696 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -59.72 -19.81 52.4 Favored 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 113.154 0.798 . . . . 0.0 113.154 174.628 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 1.4 t -55.29 -35.61 65.25 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 123.59 0.756 . . . . 0.0 110.694 -179.964 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 15.8 m -114.21 -28.06 7.42 Favored 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 125.147 1.379 . . . . 0.0 110.663 173.993 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 87.19 25.09 34.89 Favored Glycine 0 CA--C 1.528 0.898 0 N-CA-C 110.318 -1.113 . . . . 0.0 110.318 -173.432 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 6.7 m-85 -117.97 175.25 5.76 Favored 'General case' 0 C--O 1.232 0.176 0 C-N-CA 126.103 1.761 . . . . 0.0 107.776 -170.807 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -110.4 151.19 27.78 Favored 'General case' 0 CA--C 1.521 -0.157 0 N-CA-C 109.084 -0.71 . . . . 0.0 109.084 172.77 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 44.7 t80 -118.81 137.84 53.11 Favored 'General case' 0 N--CA 1.446 -0.633 0 C-N-CA 127.612 2.365 . . . . 0.0 107.79 179.761 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 37.3 t0 -106.95 86.22 2.29 Favored Pre-proline 0 C--N 1.33 -0.268 0 C-N-CA 126.129 1.772 . . . . 0.0 111.28 -175.612 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 22.9 Cg_endo -60.81 -14.25 31.13 Favored 'Trans proline' 0 CA--C 1.537 0.664 0 C-N-CA 121.903 1.735 . . . . 0.0 113.798 177.918 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 4.7 tt0 -67.81 -16.33 64.06 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 119.399 0.999 . . . . 0.0 111.276 176.731 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 40.1 p -131.48 -63.12 0.85 Allowed 'General case' 0 N--CA 1.447 -0.612 0 C-N-CA 125.271 1.428 . . . . 0.0 107.896 177.351 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 124.5 12.61 4.12 Favored Glycine 0 CA--C 1.531 1.05 0 C-N-CA 127.041 2.258 . . . . 0.0 112.025 -167.65 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 32.0 mt -87.22 175.59 7.97 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 126.119 1.768 . . . . 0.0 109.85 176.964 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 42.7 m-85 -117.42 167.41 11.29 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 125.097 1.359 . . . . 0.0 109.617 166.775 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 31.3 t80 -144.66 156.27 44.02 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 128.158 2.583 . . . . 0.0 108.345 -179.565 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 42.6 t0 -126.17 142.33 42.34 Favored Pre-proline 0 N--CA 1.473 0.722 0 N-CA-C 107.716 -1.216 . . . . 0.0 107.716 175.287 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 41.5 Cg_endo -73.15 -38.9 2.45 Favored 'Trans proline' 0 C--N 1.345 0.391 0 CA-C-N 120.952 1.376 . . . . 0.0 112.826 -176.15 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 30.5 m-20 -75.69 -25.66 56.91 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-O 118.533 -0.746 . . . . 0.0 111.383 -178.416 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 67.2 m -131.73 94.38 3.5 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 125.809 1.643 . . . . 0.0 109.434 -174.715 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 12.1 mp0 -59.43 -3.12 0.39 Allowed 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.974 1.31 . . . . 0.0 114.163 -178.119 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 68.4 m-85 -61.25 111.07 1.59 Allowed 'General case' 0 N--CA 1.446 -0.632 0 CA-C-N 119.189 0.904 . . . . 0.0 108.887 171.934 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 30.4 m-85 -62.1 153.63 29.38 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 123.519 0.727 . . . . 0.0 109.45 174.744 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 68.8 t80 -119.69 117.55 28.56 Favored 'General case' 0 N--CA 1.443 -0.811 0 CA-C-O 122.476 1.131 . . . . 0.0 108.802 -179.325 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 21.2 t30 -95.95 89.7 5.32 Favored 'General case' 0 N--CA 1.442 -0.863 0 C-N-CA 125.715 1.606 . . . . 0.0 107.354 175.252 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -48.1 -42.24 28.4 Favored 'General case' 0 CA--C 1.529 0.157 0 C-N-CA 124.838 1.255 . . . . 0.0 112.169 174.819 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -44.49 -48.64 10.11 Favored 'General case' 0 N--CA 1.448 -0.572 0 C-N-CA 126.213 1.805 . . . . 0.0 112.232 -175.621 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -118.43 12.78 13.39 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 125.207 1.403 . . . . 0.0 110.507 -177.052 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 18.5 mt-30 44.24 45.72 7.23 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 128.646 2.778 . . . . 0.0 112.755 -175.925 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -117.24 143.65 45.66 Favored 'General case' 0 N--CA 1.448 -0.557 0 C-N-CA 125.483 1.513 . . . . 0.0 110.233 -171.504 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.647 ' C ' HD23 ' A' ' 52' ' ' LEU . 58.3 m-85 -101.73 132.29 47.53 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 123.441 0.696 . . . . 0.0 111.704 176.432 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.647 HD23 ' C ' ' A' ' 51' ' ' TYR . 1.1 mt -135.87 -177.89 4.89 Favored 'General case' 0 C--N 1.323 -0.555 0 C-N-CA 126.779 2.031 . . . . 0.0 108.739 -165.414 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.474 ' CE2' HG23 ' A' ' 62' ' ' VAL . 25.7 p90 -135.02 164.76 26.91 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 124.179 0.992 . . . . 0.0 109.219 173.182 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' TRP . . . . . 0.408 ' CZ2' ' HD2' ' A' ' 13' ' ' PRO . 21.4 t-105 -109.23 137.82 46.53 Favored 'General case' 0 CA--C 1.504 -0.794 0 C-N-CA 125.955 1.702 . . . . 0.0 108.501 172.982 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 22.7 p-10 -133.56 77.29 1.71 Allowed 'General case' 0 N--CA 1.42 -1.958 0 C-N-CA 126.822 2.049 . . . . 0.0 107.208 -171.163 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -61.03 1.09 0.91 Allowed Glycine 0 CA--C 1.53 1.018 0 C-N-CA 125.025 1.298 . . . . 0.0 114.538 179.288 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 14.9 mt-10 -69.72 -63.32 1.1 Allowed 'General case' 0 N--CA 1.444 -0.754 0 N-CA-C 106.552 -1.647 . . . . 0.0 106.552 171.789 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 82.4 mtt180 -72.91 -23.15 60.67 Favored 'General case' 0 C--O 1.226 -0.146 0 C-N-CA 127.157 2.183 . . . . 0.0 111.323 173.929 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 52.9 mtt85 56.24 69.83 0.7 Allowed 'General case' 0 C--O 1.232 0.151 0 C-N-CA 126.295 1.838 . . . . 0.0 109.456 -162.861 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 6.8 t -144.24 -175.11 4.49 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 118.385 0.539 . . . . 0.0 110.194 170.165 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 91.3 m-85 -120.54 129.1 53.66 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 107.101 -1.444 . . . . 0.0 107.101 164.351 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.474 HG23 ' CE2' ' A' ' 53' ' ' TYR . 0.0 OUTLIER -126.22 154.92 74.49 Favored Pre-proline 0 C--N 1.325 -0.458 0 C-N-CA 125.95 1.7 . . . . 0.0 113.068 -175.763 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.585 ' HA ' HD22 ' A' ' 52' ' ' LEU . 71.5 Cg_endo -80.42 132.15 8.91 Favored 'Trans proline' 0 N--CA 1.443 -1.467 0 C-N-CA 121.355 1.37 . . . . 0.0 112.36 -171.907 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -79.13 48.59 0.87 Allowed 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.832 0.853 . . . . 0.0 113.118 -172.704 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 62.4 mt -69.79 -50.66 40.85 Favored 'General case' 0 C--O 1.226 -0.147 0 C-N-CA 124.488 1.115 . . . . 0.0 110.677 -173.981 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -137.11 -56.54 0.71 Allowed 'General case' 0 C--N 1.333 -0.142 0 C-N-CA 124.766 1.226 . . . . 0.0 108.943 -177.152 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER 65.16 93.74 0.06 Allowed 'General case' 0 CA--C 1.529 0.171 0 C-N-CA 126.208 1.803 . . . . 0.0 108.691 179.886 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 58.7 m -155.33 109.35 2.87 Favored 'General case' 0 C--O 1.236 0.351 0 O-C-N 120.74 -1.225 . . . . 0.0 108.172 -173.266 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 47.38 -157.28 0.05 OUTLIER 'General case' 0 C--O 1.236 0.393 0 C-N-CA 125.278 1.431 . . . . 0.0 111.029 -169.809 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -157.76 -176.72 6.09 Favored 'General case' 0 C--O 1.238 0.497 0 N-CA-C 108.103 -1.073 . . . . 0.0 108.103 179.008 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -172.5 -171.39 37.3 Favored Glycine 0 CA--C 1.524 0.649 0 O-C-N 120.738 -1.226 . . . . 0.0 110.326 173.405 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 11.1 m80 -65.28 -19.82 66.13 Favored 'General case' 0 CA--C 1.542 0.647 0 O-C-N 121.924 -0.751 . . . . 0.0 111.792 162.754 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 19.6 pttp -93.67 -177.74 4.48 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 124.338 1.055 . . . . 0.0 111.089 -179.444 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 21.7 mt-10 -122.9 -178.1 3.85 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 125.116 1.367 . . . . 0.0 108.797 166.044 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -64.46 -31.73 73.07 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 125.791 1.636 . . . . 0.0 112.493 179.427 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -162.23 81.32 0.13 Allowed Glycine 0 CA--C 1.525 0.688 0 C-N-CA 124.69 1.138 . . . . 0.0 110.406 -172.536 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -143.49 85.94 9.16 Favored Pre-proline 0 CA--C 1.545 0.757 0 C-N-CA 125.184 1.394 . . . . 0.0 109.438 177.337 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -78.54 82.66 2.42 Favored 'Trans proline' 0 CA--C 1.549 1.27 0 C-N-CA 124.172 3.248 . . . . 0.0 114.281 -174.806 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 35.0 m 65.03 91.75 0.08 Allowed 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 124.646 1.179 . . . . 0.0 110.979 170.142 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 16.5 mmtt -129.7 -27.42 2.35 Favored 'General case' 0 CA--C 1.52 -0.209 0 CA-C-O 117.673 -1.156 . . . . 0.0 113.743 174.454 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -170.12 -13.47 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.948 0 N-CA-C 116.262 1.949 . . . . 0.0 116.262 -162.131 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -132.67 -80.69 0.18 Allowed Glycine 0 C--N 1.334 0.431 0 N-CA-C 108.444 -1.862 . . . . 0.0 108.444 -178.854 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 15.1 ptpt -60.58 -10.48 5.2 Favored 'General case' 0 N--CA 1.465 0.277 0 N-CA-C 113.585 0.957 . . . . 0.0 113.585 175.586 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -56.93 -29.31 63.0 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 119.488 1.04 . . . . 0.0 111.844 -175.648 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 3.1 mmpt? -126.42 23.37 6.92 Favored 'General case' 0 N--CA 1.463 0.193 0 C-N-CA 125.896 1.679 . . . . 0.0 110.158 178.673 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 52.9 mtpt 51.31 38.33 21.22 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 124.452 1.101 . . . . 0.0 111.18 -175.829 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 53.87 39.02 29.93 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 125.364 1.466 . . . . 0.0 112.509 174.104 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 4.4 mttp -53.24 -70.09 0.1 Allowed 'General case' 0 C--N 1.34 0.152 0 C-N-CA 125.207 1.403 . . . . 0.0 111.319 177.517 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 58.3 t-80 -155.96 160.11 39.8 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 124.399 1.08 . . . . 0.0 108.775 -179.977 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 7.4 mtmp? -138.95 143.14 38.45 Favored 'General case' 0 C--O 1.232 0.156 0 C-N-CA 125.76 1.624 . . . . 0.0 106.716 174.977 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 10.1 m -129.45 69.56 1.42 Allowed 'General case' 0 C--O 1.235 0.341 0 C-N-CA 123.839 0.856 . . . . 0.0 109.503 -172.204 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 43.3 mttt . . . . . 0 C--O 1.244 0.786 0 C-N-CA 126.001 1.72 . . . . 0.0 111.332 -168.194 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.463 0.47 0 N-CA-C 110.644 -0.982 . . . . 0.0 110.644 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 19.8 m170 -130.85 167.22 19.29 Favored 'General case' 0 C--O 1.238 0.472 0 C-N-CA 124.437 1.095 . . . . 0.0 108.116 167.263 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' MET . . . . . 0.418 ' HG3' ' H ' ' A' ' 4' ' ' GLN . 16.5 tpp -132.95 -173.39 3.18 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 125.777 1.631 . . . . 0.0 108.063 175.062 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.418 ' H ' ' HG3' ' A' ' 3' ' ' MET . 0.0 OUTLIER -121.86 122.41 39.38 Favored 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 124.465 1.106 . . . . 0.0 109.379 -170.195 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -90.7 -19.06 24.0 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 123.671 0.788 . . . . 0.0 111.318 175.24 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 18.7 m 47.34 56.3 7.12 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.708 1.203 . . . . 0.0 110.783 -177.181 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -132.7 -178.87 5.14 Favored 'General case' 0 C--O 1.233 0.23 0 C-N-CA 125.758 1.623 . . . . 0.0 109.744 -171.695 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 74.75 95.68 0.07 Allowed 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 125.933 1.693 . . . . 0.0 108.39 178.826 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 66.1 mt-30 -59.65 -25.89 65.08 Favored 'General case' 0 CA--C 1.538 0.487 0 O-C-N 121.87 -0.519 . . . . 0.0 111.638 171.583 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 61.2 m-85 -139.64 164.83 35.6 Favored Pre-proline 0 C--O 1.241 0.637 0 C-N-CA 126.332 1.853 . . . . 0.0 109.371 176.924 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 68.2 Cg_endo -67.67 -175.33 0.71 Allowed 'Trans proline' 0 CA--C 1.538 0.687 0 C-N-CA 123.661 2.908 . . . . 0.0 109.874 161.134 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 18.6 t -116.55 86.09 17.8 Favored Pre-proline 0 CA--C 1.541 0.607 0 C-N-CA 125.222 1.409 . . . . 0.0 107.813 -173.994 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo -73.17 174.87 11.34 Favored 'Trans proline' 0 C--N 1.347 0.456 0 C-N-CA 124.72 3.613 . . . . 0.0 111.667 -177.723 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -142.79 131.95 23.22 Favored 'General case' 0 N--CA 1.445 -0.692 0 C-N-CA 125.935 1.694 . . . . 0.0 110.881 -175.194 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 7.1 p -63.81 -26.39 40.5 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.423 0 O-C-N 121.061 -1.025 . . . . 0.0 112.558 179.549 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 93.1 p -71.64 0.67 8.14 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 120.06 1.3 . . . . 0.0 113.568 178.846 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 32.1 p -111.32 1.79 17.29 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.475 1.11 . . . . 0.0 112.02 172.076 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 11.0 m-30 -69.46 172.46 7.19 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.647 1.179 . . . . 0.0 111.88 -178.808 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 2.8 mm100 -116.11 101.88 9.12 Favored 'General case' 0 N--CA 1.478 0.926 0 N-CA-C 114.663 1.357 . . . . 0.0 114.663 179.03 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 55.1 t80 -63.68 147.84 50.57 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 118.426 0.557 . . . . 0.0 111.621 -175.637 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 8.4 t0 -124.82 84.42 2.28 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 123.289 0.636 . . . . 0.0 109.769 176.809 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.75 -19.48 50.49 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 115.152 1.538 . . . . 0.0 115.152 -172.351 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 5.9 t -49.16 -46.93 46.0 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-O 118.346 -0.835 . . . . 0.0 110.313 166.264 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 64.8 m -130.07 -8.16 4.36 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 114.203 1.186 . . . . 0.0 114.203 -171.625 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 96.87 14.57 42.56 Favored Glycine 0 CA--C 1.526 0.771 0 CA-C-N 119.081 0.855 . . . . 0.0 114.221 155.707 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 16.9 m-85 -110.49 171.69 7.31 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 118.287 1.044 . . . . 0.0 109.027 -176.967 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 35.0 m-85 -113.03 121.81 45.72 Favored 'General case' 0 CA--C 1.529 0.142 0 C-N-CA 124.644 1.177 . . . . 0.0 108.624 -175.353 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 71.9 t80 -91.26 138.45 31.58 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 124.475 1.11 . . . . 0.0 110.694 -177.467 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 32.3 t0 -98.78 86.81 0.53 Allowed Pre-proline 0 N--CA 1.472 0.645 0 C-N-CA 126.233 1.813 . . . . 0.0 111.992 179.497 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_endo -60.9 -11.84 19.74 Favored 'Trans proline' 0 N--CA 1.459 -0.541 0 C-N-CA 122.415 2.077 . . . . 0.0 114.196 178.218 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -63.86 -29.52 70.7 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 119.743 1.156 . . . . 0.0 110.0 173.928 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 38.4 p -133.98 -42.42 0.82 Allowed 'General case' 0 C--O 1.235 0.301 0 CA-C-N 118.867 0.758 . . . . 0.0 112.833 -174.102 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 113.78 19.35 6.52 Favored Glycine 0 CA--C 1.534 1.228 0 C-N-CA 125.605 1.574 . . . . 0.0 112.322 -179.533 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 22.5 mt -93.11 176.21 6.5 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 126.466 1.906 . . . . 0.0 109.306 178.989 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 55.6 m-85 -121.96 165.36 16.09 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 124.678 1.191 . . . . 0.0 110.603 172.936 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 77.0 t80 -147.93 160.06 43.2 Favored 'General case' 0 C--O 1.239 0.534 0 C-N-CA 129.112 2.965 . . . . 0.0 108.475 -175.897 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.4 ' HB3' ' HB2' ' A' ' 40' ' ' SER . 8.8 t0 -129.35 143.74 50.07 Favored Pre-proline 0 CA--C 1.537 0.469 0 N-CA-C 107.358 -1.349 . . . . 0.0 107.358 178.712 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_endo -63.72 -42.68 19.35 Favored 'Trans proline' 0 CA--C 1.537 0.633 0 C-N-CA 122.457 2.105 . . . . 0.0 113.262 -179.842 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 88.4 m-20 -75.07 -43.06 55.35 Favored 'General case' 0 N--CA 1.446 -0.647 0 C-N-CA 124.565 1.146 . . . . 0.0 109.596 176.041 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' SER . . . . . 0.4 ' HB2' ' HB3' ' A' ' 37' ' ' ASP . 14.9 m -103.92 97.89 7.81 Favored 'General case' 0 N--CA 1.456 -0.132 0 C-N-CA 123.727 0.811 . . . . 0.0 109.11 -171.177 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 7.4 mp0 -58.83 -15.61 13.3 Favored 'General case' 0 CA--C 1.541 0.621 0 O-C-N 121.78 -0.575 . . . . 0.0 111.135 173.526 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 32.1 m-85 -61.5 105.44 0.52 Allowed 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 125.94 1.696 . . . . 0.0 109.7 170.163 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 27.1 m-85 -67.99 168.36 12.01 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 124.692 1.197 . . . . 0.0 110.52 175.078 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 75.7 t80 -123.48 121.22 35.13 Favored 'General case' 0 N--CA 1.446 -0.649 0 C-N-CA 125.422 1.489 . . . . 0.0 109.559 176.183 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 28.1 t30 -86.18 88.38 7.59 Favored 'General case' 0 N--CA 1.443 -0.784 0 C-N-CA 127.875 2.47 . . . . 0.0 108.744 173.147 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -52.09 -36.39 50.7 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.498 0.719 . . . . 0.0 111.825 175.524 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -48.01 -57.09 6.22 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 126.393 1.877 . . . . 0.0 112.172 -178.257 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -111.23 18.48 19.27 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 125.037 1.335 . . . . 0.0 111.603 179.317 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 3.0 mt-30 48.4 34.0 4.37 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 125.579 1.551 . . . . 0.0 112.606 -176.516 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -105.76 174.56 5.83 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 126.714 2.006 . . . . 0.0 110.975 -174.02 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 5.6 m-85 -114.44 146.47 40.59 Favored 'General case' 0 C--N 1.332 -0.153 0 N-CA-C 108.387 -0.968 . . . . 0.0 108.387 179.601 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.473 HD23 ' HA ' ' A' ' 63' ' ' PRO . 85.2 mt -137.82 174.76 10.24 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.966 1.306 . . . . 0.0 108.874 -175.503 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 8.7 p90 -139.46 142.96 37.35 Favored 'General case' 0 C--O 1.239 0.543 0 C-N-CA 125.687 1.595 . . . . 0.0 107.917 165.948 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 41.8 t-105 -85.12 100.86 12.0 Favored 'General case' 0 N--CA 1.449 -0.524 0 N-CA-C 105.543 -2.021 . . . . 0.0 105.543 176.907 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 51.4 t0 -88.53 87.08 7.15 Favored 'General case' 0 N--CA 1.447 -0.615 0 N-CA-C 107.61 -1.255 . . . . 0.0 107.61 -178.47 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -58.55 -17.3 32.89 Favored Glycine 0 CA--C 1.53 1.02 0 CA-C-O 118.299 -1.278 . . . . 0.0 112.345 177.599 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 17.6 mt-10 -69.7 -22.27 63.43 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 120.021 1.911 . . . . 0.0 111.282 174.47 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 8.8 mtt180 -120.16 -2.71 10.13 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 125.173 1.389 . . . . 0.0 111.359 -179.516 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 2.1 mpt_? 44.55 56.15 5.29 Favored 'General case' 0 C--O 1.234 0.252 0 C-N-CA 126.664 1.986 . . . . 0.0 110.278 -173.54 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 5.0 t -148.89 153.46 38.06 Favored 'General case' 0 N--CA 1.448 -0.53 0 N-CA-C 108.851 -0.796 . . . . 0.0 108.851 176.513 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 80.3 m-85 -93.08 115.74 28.39 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 106.186 -1.783 . . . . 0.0 106.186 175.641 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -125.26 154.92 71.99 Favored Pre-proline 0 C--N 1.326 -0.425 0 C-N-CA 125.667 1.587 . . . . 0.0 110.274 -171.462 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.473 ' HA ' HD23 ' A' ' 52' ' ' LEU . 56.4 Cg_endo -68.32 130.32 20.96 Favored 'Trans proline' 0 N--CA 1.455 -0.782 0 C-N-CA 122.36 2.04 . . . . 0.0 110.464 -179.032 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -96.47 14.32 24.95 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-O 121.993 0.901 . . . . 0.0 112.764 177.916 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 7.0 mp -68.31 123.9 22.02 Favored 'General case' 0 N--CA 1.437 -1.115 0 N-CA-C 106.688 -1.597 . . . . 0.0 106.688 170.083 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 73.3 tt0 73.39 -60.53 0.53 Allowed 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 126.508 1.923 . . . . 0.0 113.828 163.518 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 14.4 pt20 44.93 34.33 1.21 Allowed 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 127.309 2.244 . . . . 0.0 114.442 178.84 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 5.5 m 75.27 -12.71 0.93 Allowed 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 127.553 2.341 . . . . 0.0 115.55 173.708 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -81.47 95.25 7.03 Favored 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 125.011 1.325 . . . . 0.0 110.58 -174.966 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 27.5 t0 71.95 -37.29 0.39 Allowed 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 128.434 2.694 . . . . 0.0 114.37 165.873 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 166.11 -176.6 41.41 Favored Glycine 0 N--CA 1.447 -0.584 0 N-CA-C 109.818 -1.313 . . . . 0.0 109.818 167.534 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 3.1 p-80 -77.67 -29.28 51.44 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 112.534 0.568 . . . . 0.0 112.534 175.852 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 67.8 mmtt 58.68 -154.85 0.36 Allowed 'General case' 0 C--O 1.237 0.424 0 C-N-CA 123.559 0.744 . . . . 0.0 110.307 177.866 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -64.35 161.59 16.58 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 109.704 -0.48 . . . . 0.0 109.704 167.322 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -54.42 -1.37 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 130.909 3.683 . . . . 0.0 115.499 -178.487 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -135.66 -86.94 0.23 Allowed Glycine 0 N--CA 1.439 -1.162 0 N-CA-C 106.545 -2.622 . . . . 0.0 106.545 -173.602 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . 44.59 71.13 1.6 Allowed Pre-proline 0 CA--C 1.546 0.809 0 C-N-CA 127.096 2.158 . . . . 0.0 113.156 170.531 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_endo -68.97 -17.36 41.19 Favored 'Trans proline' 0 CA--C 1.536 0.583 0 C-N-CA 124.121 3.214 . . . . 0.0 116.693 -158.548 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 1.6 p 44.86 21.19 0.04 OUTLIER 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 129.197 2.999 . . . . 0.0 117.685 173.836 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 7.9 mtpm? -137.15 23.47 3.01 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 124.712 1.205 . . . . 0.0 110.557 179.984 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -153.3 29.38 0.49 Allowed 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 112.642 0.608 . . . . 0.0 112.642 178.019 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 163.02 -85.23 0.11 Allowed Glycine 0 C--N 1.335 0.512 0 O-C-N 120.524 -1.36 . . . . 0.0 111.567 173.984 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 15.8 tttt -92.17 56.41 2.82 Favored 'General case' 0 N--CA 1.455 -0.202 0 CA-C-O 123.284 1.516 . . . . 0.0 108.177 -173.796 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.435 ' HG3' ' H ' ' A' ' 85' ' ' LYS . 7.0 pt-20 -56.96 -53.86 53.27 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 126.078 1.751 . . . . 0.0 110.011 174.25 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.435 ' H ' ' HG3' ' A' ' 84' ' ' GLU . 52.6 pttt -158.12 26.98 0.26 Allowed 'General case' 0 C--O 1.238 0.478 0 C-N-CA 128.669 2.788 . . . . 0.0 109.546 179.565 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.441 ' HA ' ' HE2' ' A' ' 86' ' ' LYS . 7.3 mmpt? -83.94 99.06 10.14 Favored 'General case' 0 C--O 1.231 0.111 0 N-CA-C 107.635 -1.246 . . . . 0.0 107.635 -174.477 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -146.93 -33.35 0.29 Allowed 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 123.983 0.913 . . . . 0.0 111.879 -170.699 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 4.1 mptt -125.41 -174.22 3.01 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 125.116 1.366 . . . . 0.0 110.655 179.571 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 12.4 m80 55.12 98.35 0.02 OUTLIER 'General case' 0 C--O 1.239 0.51 0 C-N-CA 126.633 1.973 . . . . 0.0 113.113 -175.705 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.45 107.08 5.33 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 125.06 1.344 . . . . 0.0 108.638 175.937 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 17.3 m 52.48 69.13 0.72 Allowed 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 125.374 1.469 . . . . 0.0 111.14 178.031 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 1.4 mppt? . . . . . 0 C--O 1.247 0.953 0 N-CA-C 104.454 -2.424 . . . . 0.0 104.454 -127.159 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.113 0 N-CA-C 110.027 -1.229 . . . . 0.0 110.027 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 8.6 t-80 46.9 39.13 6.99 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 125.039 1.336 . . . . 0.0 112.008 -176.525 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 5.3 mpp? 60.3 4.94 0.74 Allowed 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 126.18 1.792 . . . . 0.0 115.075 -178.635 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 12.6 tt0 -47.63 112.7 0.58 Allowed 'General case' 0 C--O 1.236 0.354 0 C-N-CA 126.113 1.765 . . . . 0.0 112.116 -169.431 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 16.4 pt-20 -72.53 -14.85 61.74 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 125.337 1.455 . . . . 0.0 113.295 -177.036 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 67.5 m 53.34 45.59 28.12 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.429 1.092 . . . . 0.0 112.045 176.875 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 20.5 p90 -76.17 -9.41 58.6 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 124.399 1.079 . . . . 0.0 113.545 -174.016 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 44.7 m -77.07 99.02 5.19 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 127.197 2.199 . . . . 0.0 111.856 -169.918 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER 58.88 -60.97 0.04 OUTLIER 'General case' 0 C--O 1.237 0.419 0 C-N-CA 129.88 3.272 . . . . 0.0 114.222 -177.303 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 58.5 m-85 -131.23 154.94 82.1 Favored Pre-proline 0 C--O 1.235 0.329 0 C-N-CA 124.083 0.953 . . . . 0.0 109.542 171.453 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -61.04 169.69 5.73 Favored 'Trans proline' 0 N--CA 1.453 -0.873 0 C-N-CA 121.823 1.682 . . . . 0.0 109.846 161.94 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 59.7 t -104.67 86.69 1.51 Allowed Pre-proline 0 C--O 1.241 0.615 0 N-CA-C 107.073 -1.454 . . . . 0.0 107.073 -173.028 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 69.0 Cg_endo -66.79 169.18 15.13 Favored 'Trans proline' 0 CA--C 1.534 0.48 0 C-N-CA 123.856 3.037 . . . . 0.0 111.525 -168.929 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -146.43 123.15 11.21 Favored 'General case' 0 C--O 1.232 0.164 0 O-C-N 121.535 -0.728 . . . . 0.0 111.057 -175.948 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 13.3 p -58.61 -20.84 17.24 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.671 0 C-N-CA 124.679 1.192 . . . . 0.0 112.695 -178.052 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 38.7 p -64.66 -13.7 55.13 Favored 'General case' 0 N--CA 1.434 -1.229 0 O-C-N 119.856 -1.777 . . . . 0.0 113.705 179.24 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 12.7 t -119.87 8.42 11.1 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 125.185 1.394 . . . . 0.0 110.75 176.669 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 12.9 m-30 -74.68 155.78 37.38 Favored 'General case' 0 C--O 1.238 0.467 0 O-C-N 120.977 -1.077 . . . . 0.0 110.524 170.68 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 25.5 mt-30 -93.47 150.79 20.17 Favored 'General case' 0 C--O 1.224 -0.26 0 CA-C-N 114.915 -1.039 . . . . 0.0 109.79 171.457 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.423 ' CZ ' ' HA2' ' A' ' 25' ' ' GLY . 70.2 t80 -96.46 152.81 18.26 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 124.567 1.147 . . . . 0.0 109.975 167.469 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -132.66 97.28 4.02 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 124.134 0.974 . . . . 0.0 109.415 173.872 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.418 ' HG2' ' H ' ' A' ' 22' ' ' GLU . 1.3 pt-20 -62.22 -20.2 63.95 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 125.307 1.443 . . . . 0.0 113.861 -172.403 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 15.1 t -56.74 -24.8 52.39 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 123.495 0.718 . . . . 0.0 111.617 171.38 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 66.2 m -133.14 -19.92 2.19 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.834 1.254 . . . . 0.0 112.775 179.522 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' GLY . . . . . 0.423 ' HA2' ' CZ ' ' A' ' 20' ' ' TYR . . . 62.77 25.37 67.49 Favored Glycine 0 CA--C 1.531 1.073 0 O-C-N 121.016 -1.052 . . . . 0.0 112.682 -175.516 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 17.8 m-85 -87.98 170.57 11.01 Favored 'General case' 0 C--O 1.238 0.482 0 N-CA-C 107.419 -1.326 . . . . 0.0 107.419 160.966 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 76.9 m-85 -107.04 152.45 23.99 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 124.316 1.046 . . . . 0.0 108.741 166.782 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 46.6 t80 -111.21 137.63 48.67 Favored 'General case' 0 N--CA 1.447 -0.623 0 C-N-CA 126.933 2.093 . . . . 0.0 108.315 179.162 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 6.2 t0 -96.02 86.7 0.37 Allowed Pre-proline 0 CA--C 1.532 0.267 0 C-N-CA 128.609 2.763 . . . . 0.0 107.048 177.335 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -66.91 -10.27 27.8 Favored 'Trans proline' 0 C--N 1.347 0.485 0 C-N-CA 122.424 2.083 . . . . 0.0 111.983 175.982 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 10.0 tt0 -70.1 -18.54 63.25 Favored 'General case' 0 N--CA 1.447 -0.599 0 C-N-CA 124.578 1.151 . . . . 0.0 110.523 -179.151 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 37.0 p -145.57 -53.29 0.27 Allowed 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 126.165 1.786 . . . . 0.0 111.106 178.438 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 135.1 12.23 1.3 Allowed Glycine 0 CA--C 1.531 1.08 0 C-N-CA 126.329 1.919 . . . . 0.0 113.851 178.727 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 10.7 mt -81.1 177.19 9.2 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 118.92 1.36 . . . . 0.0 110.339 178.332 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 59.5 m-85 -121.95 167.52 12.97 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.275 1.03 . . . . 0.0 110.196 168.915 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 33.9 t80 -149.65 139.73 22.08 Favored 'General case' 0 C--O 1.235 0.317 0 C-N-CA 127.518 2.327 . . . . 0.0 107.835 -172.63 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -99.29 143.25 26.06 Favored Pre-proline 0 CA--C 1.538 0.506 0 N-CA-C 106.951 -1.5 . . . . 0.0 106.951 -178.389 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -66.48 -38.43 19.6 Favored 'Trans proline' 0 C--O 1.236 0.417 0 C-N-CA 121.423 1.415 . . . . 0.0 113.735 -178.841 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 11.2 m-80 -99.78 -14.26 18.91 Favored 'General case' 0 CA--C 1.518 -0.264 0 N-CA-C 113.31 0.855 . . . . 0.0 113.31 -172.414 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 24.2 m -127.93 103.33 7.19 Favored 'General case' 0 C--N 1.32 -0.689 0 C-N-CA 125.954 1.702 . . . . 0.0 107.659 178.161 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -65.62 -1.51 2.75 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 123.56 0.744 . . . . 0.0 112.344 -176.832 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 42.1 m-85 -60.98 120.75 10.82 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 119.414 1.007 . . . . 0.0 108.435 164.769 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 32.5 m-85 -74.1 164.36 26.71 Favored 'General case' 0 N--CA 1.442 -0.838 0 C-N-CA 124.482 1.113 . . . . 0.0 109.355 173.611 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 94.4 t80 -119.44 139.52 51.91 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 125.474 1.509 . . . . 0.0 108.674 173.027 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 18.7 t30 -121.17 79.97 1.59 Allowed 'General case' 0 N--CA 1.444 -0.745 0 C-N-CA 128.169 2.588 . . . . 0.0 106.179 -171.986 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -52.15 -33.07 38.63 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 123.629 0.772 . . . . 0.0 111.621 179.97 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -46.19 -38.04 7.83 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 127.369 2.268 . . . . 0.0 113.012 177.097 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.3 m -129.05 13.12 6.22 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 125.141 1.376 . . . . 0.0 110.488 179.127 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 52.4 mt-30 44.02 35.25 1.11 Allowed 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 128.859 2.864 . . . . 0.0 113.7 -169.003 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -108.08 -179.83 4.01 Favored 'General case' 0 N--CA 1.448 -0.54 0 C-N-CA 124.839 1.256 . . . . 0.0 112.145 -176.227 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 55.4 m-85 -123.28 139.7 53.78 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 124.723 1.209 . . . . 0.0 109.221 -178.08 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.412 HD23 ' HA ' ' A' ' 63' ' ' PRO . 64.9 mt -130.97 167.25 19.34 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.865 1.266 . . . . 0.0 107.838 -174.28 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 13.6 p90 -126.05 149.85 48.56 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 107.437 -1.319 . . . . 0.0 107.437 165.835 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 62.9 t-105 -88.03 152.92 21.68 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 106.212 -1.774 . . . . 0.0 106.212 166.805 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 49.0 t0 -145.58 155.25 42.93 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 107.595 -1.261 . . . . 0.0 107.595 166.553 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -100.84 -7.93 49.51 Favored Glycine 0 CA--C 1.526 0.758 0 CA-C-O 118.883 -0.954 . . . . 0.0 112.322 177.95 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 75.6 mt-10 -74.11 -44.29 54.42 Favored 'General case' 0 C--N 1.341 0.201 0 CA-C-N 119.664 1.732 . . . . 0.0 107.824 177.251 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 81.3 mtt180 -102.05 -5.21 24.82 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-O 117.703 -1.142 . . . . 0.0 112.499 -178.499 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 60.6 mtt85 43.95 57.89 3.91 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 126.997 2.119 . . . . 0.0 111.941 177.684 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' THR . . . . . 0.484 HG23 HG13 ' A' ' 62' ' ' VAL . 10.0 t -151.05 156.44 41.11 Favored 'General case' 0 N--CA 1.442 -0.835 0 N-CA-C 107.848 -1.167 . . . . 0.0 107.848 177.174 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 31.3 m-85 -75.27 128.25 35.0 Favored 'General case' 0 C--O 1.238 0.479 0 N-CA-C 106.616 -1.624 . . . . 0.0 106.616 154.499 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.484 HG13 HG23 ' A' ' 60' ' ' THR . 0.0 OUTLIER -126.04 154.46 73.99 Favored Pre-proline 0 C--N 1.325 -0.481 0 C-N-CA 126.81 2.044 . . . . 0.0 111.429 -178.697 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.412 ' HA ' HD23 ' A' ' 52' ' ' LEU . 54.4 Cg_endo -71.78 122.68 8.74 Favored 'Trans proline' 0 N--CA 1.456 -0.686 0 C-N-CA 122.87 2.38 . . . . 0.0 111.782 -176.17 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -91.02 14.54 13.67 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 115.144 1.535 . . . . 0.0 115.144 -174.691 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -79.76 -61.4 2.01 Favored 'General case' 0 N--CA 1.44 -0.954 0 N-CA-C 108.774 -0.824 . . . . 0.0 108.774 -173.54 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.8 mp0 -83.35 -57.62 3.18 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 123.531 0.732 . . . . 0.0 110.406 -177.585 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 19.0 mt-30 59.53 177.08 0.08 Allowed 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 127.572 2.349 . . . . 0.0 112.804 -178.253 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 72.0 m 44.98 57.68 4.51 Favored 'General case' 0 C--O 1.238 0.478 0 C-N-CA 125.597 1.559 . . . . 0.0 112.257 -176.789 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -68.62 98.28 0.87 Allowed 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 124.572 1.149 . . . . 0.0 110.641 -175.996 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -139.48 -44.15 0.45 Allowed 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 123.806 0.843 . . . . 0.0 113.142 -175.919 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -83.82 158.27 34.96 Favored Glycine 0 CA--C 1.524 0.641 0 N-CA-C 108.906 -1.678 . . . . 0.0 108.906 171.449 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 2.2 t-80 -73.75 90.79 1.87 Allowed 'General case' 0 CA--C 1.537 0.442 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 -178.658 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 65.3 mttp -136.04 161.92 34.35 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 124.436 1.094 . . . . 0.0 110.86 -172.689 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -127.36 164.64 21.37 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 125.259 1.423 . . . . 0.0 110.008 -179.725 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 7.1 m -52.79 -29.47 27.62 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 126.515 1.926 . . . . 0.0 112.975 178.454 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -67.91 -21.09 73.14 Favored Glycine 0 CA--C 1.53 1.004 0 CA-C-O 119.165 -0.797 . . . . 0.0 111.539 -178.151 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . 44.18 68.5 3.07 Favored Pre-proline 0 CA--C 1.536 0.418 0 C-N-CA 127.077 2.151 . . . . 0.0 111.965 -178.657 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -67.27 163.36 34.67 Favored 'Trans proline' 0 N--CA 1.455 -0.784 0 C-N-CA 123.144 2.562 . . . . 0.0 111.249 -179.529 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 3.7 m -139.06 48.05 1.89 Allowed 'General case' 0 C--O 1.235 0.333 0 C-N-CA 125.594 1.557 . . . . 0.0 108.661 179.057 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 15.3 pttm -128.3 -10.12 5.23 Favored 'General case' 0 N--CA 1.463 0.218 0 C-N-CA 123.603 0.761 . . . . 0.0 113.014 174.813 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -158.0 51.08 0.43 Allowed 'General case' 0 C--O 1.237 0.396 0 CA-C-O 122.67 1.224 . . . . 0.0 107.87 -164.832 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 160.27 -113.99 0.59 Allowed Glycine 0 N--CA 1.447 -0.588 0 N-CA-C 107.216 -2.353 . . . . 0.0 107.216 -170.146 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.64 32.16 0.3 Allowed 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 125.609 1.564 . . . . 0.0 112.623 -171.058 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 2.2 pp20? -44.48 -55.69 4.87 Favored 'General case' 0 C--O 1.241 0.649 0 C-N-CA 126.364 1.866 . . . . 0.0 111.553 -176.96 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.01 26.43 8.74 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 125.265 1.426 . . . . 0.0 110.844 -179.966 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 68.9 mmtt 57.02 37.99 29.05 Favored 'General case' 0 N--CA 1.468 0.425 0 C-N-CA 123.981 0.913 . . . . 0.0 110.5 -176.363 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 63.07 10.95 4.83 Favored 'General case' 0 C--O 1.234 0.273 0 C-N-CA 125.247 1.419 . . . . 0.0 112.929 174.216 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 44.4 mtpt -73.32 -17.31 61.32 Favored 'General case' 0 C--O 1.224 -0.241 0 CA-C-O 117.297 -1.335 . . . . 0.0 112.053 -172.707 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 68.5 m80 46.01 89.49 0.02 OUTLIER 'General case' 0 C--N 1.343 0.304 0 C-N-CA 126.905 2.082 . . . . 0.0 110.657 -177.608 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . 0.289 21.1 pttp 52.36 -162.49 0.09 Allowed 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 122.54 0.336 . . . . 0.0 110.167 -168.927 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -133.97 159.52 40.48 Favored 'General case' 0 C--O 1.236 0.379 0 N-CA-C 107.128 -1.434 . . . . 0.0 107.128 155.269 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 1.3 tttp . . . . . 0 C--O 1.252 1.21 0 CA-C-O 117.467 -1.254 . . . . 0.0 107.833 -156.434 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 1.305 0 N-CA-C 108.561 -1.816 . . . . 0.0 108.561 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 12.0 p-80 -73.54 155.11 39.5 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 124.387 1.075 . . . . 0.0 110.448 -175.346 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -169.59 -51.19 0.02 OUTLIER 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 124.676 1.19 . . . . 0.0 109.737 168.389 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 10.3 tt0 -76.86 143.03 39.96 Favored 'General case' 0 C--O 1.234 0.286 0 N-CA-C 107.657 -1.238 . . . . 0.0 107.657 166.151 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 25.3 tt0 -84.49 -61.42 1.8 Allowed 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 122.765 0.426 . . . . 0.0 110.069 -177.877 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 27.5 t 45.12 72.69 0.19 Allowed 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 125.861 1.664 . . . . 0.0 110.496 -171.976 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 1.4 m-85 -138.73 144.72 39.63 Favored 'General case' 0 N--CA 1.453 -0.323 0 O-C-N 121.393 -0.817 . . . . 0.0 109.589 173.107 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 3.4 t -150.23 59.36 0.97 Allowed 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 107.078 -1.453 . . . . 0.0 107.078 161.509 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 14.5 pt20 -74.46 -178.74 3.65 Favored 'General case' 0 N--CA 1.446 -0.661 0 C-N-CA 124.392 1.077 . . . . 0.0 109.19 170.055 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 44.0 m-85 -122.4 165.42 21.15 Favored Pre-proline 0 C--O 1.241 0.656 0 C-N-CA 125.74 1.616 . . . . 0.0 109.922 -173.102 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 62.8 Cg_endo -71.82 -169.0 0.4 Allowed 'Trans proline' 0 N--CA 1.46 -0.468 0 C-N-CA 123.598 2.865 . . . . 0.0 110.516 170.497 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 85.9 t -109.38 88.13 5.78 Favored Pre-proline 0 CA--C 1.539 0.544 0 C-N-CA 126.232 1.813 . . . . 0.0 108.341 178.226 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 64.9 Cg_endo -66.4 175.23 5.23 Favored 'Trans proline' 0 CA--C 1.543 0.935 0 C-N-CA 122.957 2.438 . . . . 0.0 112.744 -177.356 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -154.1 147.76 25.26 Favored 'General case' 0 N--CA 1.465 0.295 0 C-N-CA 123.171 0.588 . . . . 0.0 111.144 168.234 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.492 ' HA ' ' CD2' ' A' ' 18' ' ' TYR . 13.0 p -58.01 -22.9 20.01 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.151 0 C-N-CA 125.22 1.408 . . . . 0.0 114.048 178.711 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 8.0 t -64.92 -3.5 3.51 Favored 'General case' 0 CA--C 1.541 0.633 0 O-C-N 121.022 -1.049 . . . . 0.0 112.52 174.476 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 40.9 p -105.48 -7.98 18.36 Favored 'General case' 0 CA--C 1.543 0.707 0 CA-C-N 119.558 1.072 . . . . 0.0 112.369 178.257 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.492 ' CD2' ' HA ' ' A' ' 15' ' ' VAL . 17.8 m-30 -88.99 168.28 12.49 Favored 'General case' 0 C--N 1.342 0.282 0 C-N-CA 124.61 1.164 . . . . 0.0 111.637 -170.226 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 14.5 mt-30 -118.09 116.04 26.05 Favored 'General case' 0 C--O 1.226 -0.181 0 C-N-CA 124.835 1.254 . . . . 0.0 110.099 178.805 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 69.6 t80 -71.27 143.02 50.5 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 118.473 0.578 . . . . 0.0 110.509 172.962 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -131.0 96.75 4.13 Favored 'General case' 0 CA--C 1.515 -0.376 0 C-N-CA 124.425 1.09 . . . . 0.0 110.141 178.529 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.7 pt-20 -53.54 -19.12 3.39 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.86 1.264 . . . . 0.0 113.289 -179.972 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 1.3 t -64.21 -17.92 64.01 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.229 1.412 . . . . 0.0 111.974 178.581 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -143.83 -19.96 0.58 Allowed 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 119.341 0.973 . . . . 0.0 112.467 177.712 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 89.88 10.57 64.63 Favored Glycine 0 CA--C 1.529 0.923 0 CA-C-O 118.331 -1.261 . . . . 0.0 113.433 176.105 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 -110.63 151.08 28.09 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-N 119.257 1.529 . . . . 0.0 108.468 177.602 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 66.0 m-85 -80.29 147.79 31.0 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 106.774 -1.565 . . . . 0.0 106.774 172.764 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 35.9 t80 -105.67 135.32 47.29 Favored 'General case' 0 C--O 1.239 0.515 0 C-N-CA 125.039 1.336 . . . . 0.0 110.223 175.892 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -99.65 85.8 0.51 Allowed Pre-proline 0 N--CA 1.451 -0.403 0 C-N-CA 126.824 2.049 . . . . 0.0 110.771 -178.591 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -65.73 -5.68 12.33 Favored 'Trans proline' 0 N--CA 1.458 -0.58 0 C-N-CA 121.649 1.566 . . . . 0.0 113.994 -179.49 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 36.7 tt0 -77.31 -33.03 55.69 Favored 'General case' 0 N--CA 1.447 -0.594 0 O-C-N 121.263 -0.898 . . . . 0.0 110.46 177.948 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.439 ' HB ' ' CD2' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -135.37 -19.57 1.67 Allowed 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 126.268 1.827 . . . . 0.0 112.988 -162.913 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 94.84 -4.78 68.8 Favored Glycine 0 N--CA 1.445 -0.725 0 CA-C-O 117.678 -1.623 . . . . 0.0 113.623 175.584 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.493 HD13 ' N ' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -76.84 -179.45 5.43 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 119.847 1.824 . . . . 0.0 109.906 178.644 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 41.0 m-85 -116.54 135.34 53.9 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-N 114.672 -1.149 . . . . 0.0 109.688 161.126 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 63.7 t80 -92.18 153.38 19.35 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 126.213 1.805 . . . . 0.0 109.683 168.235 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -128.93 144.28 51.93 Favored Pre-proline 0 CA--C 1.538 0.499 0 O-C-N 121.523 -0.736 . . . . 0.0 110.383 172.461 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 61.9 Cg_endo -72.75 -23.78 18.91 Favored 'Trans proline' 0 N--CA 1.457 -0.654 0 C-N-CA 122.445 2.096 . . . . 0.0 114.573 -176.539 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -84.79 -31.11 24.09 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-N 120.558 1.526 . . . . 0.0 109.935 166.029 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 49.4 m -127.32 92.77 3.57 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-O 122.403 1.096 . . . . 0.0 110.724 -162.924 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 5.5 mp0 -62.7 -5.92 3.14 Favored 'General case' 0 CA--C 1.546 0.825 0 CA-C-N 115.215 -0.902 . . . . 0.0 111.216 168.98 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 24.7 m-85 -62.92 98.0 0.12 Allowed 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 125.829 1.652 . . . . 0.0 107.398 160.395 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 67.9 m-85 -61.69 157.16 18.34 Favored 'General case' 0 C--O 1.232 0.153 0 C-N-CA 126.335 1.854 . . . . 0.0 111.511 177.692 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 10.8 t80 -115.89 108.45 16.3 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 125.029 1.332 . . . . 0.0 108.769 174.812 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 29.7 t30 -90.32 75.74 6.85 Favored 'General case' 0 C--O 1.235 0.299 0 C-N-CA 126.761 2.024 . . . . 0.0 106.111 177.359 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -48.63 -31.07 6.12 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 124.845 1.258 . . . . 0.0 111.413 178.703 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -44.75 -39.25 5.04 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 127.643 2.377 . . . . 0.0 112.594 178.901 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 35.2 m -134.22 20.14 3.72 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.956 1.302 . . . . 0.0 110.101 176.054 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 37.3 mt-30 46.66 17.82 0.06 Allowed 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 128.741 2.817 . . . . 0.0 114.844 -165.995 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 33.7 mm-40 -76.28 166.49 23.37 Favored 'General case' 0 CA--C 1.522 -0.117 0 CA-C-N 119.623 1.101 . . . . 0.0 111.623 -176.027 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 9.6 m-85 -118.98 123.93 45.75 Favored 'General case' 0 N--CA 1.45 -0.448 0 N-CA-C 106.318 -1.734 . . . . 0.0 106.318 -177.788 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.423 HD23 ' HA ' ' A' ' 63' ' ' PRO . 22.6 mt -124.1 167.81 13.72 Favored 'General case' 0 N--CA 1.464 0.252 0 C-N-CA 126.478 1.911 . . . . 0.0 110.495 -177.032 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 9.3 p90 -134.23 148.88 50.92 Favored 'General case' 0 N--CA 1.448 -0.573 0 O-C-N 120.948 -1.095 . . . . 0.0 108.197 164.722 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 39.6 t-105 -70.92 130.49 41.75 Favored 'General case' 0 C--O 1.236 0.365 0 N-CA-C 106.242 -1.762 . . . . 0.0 106.242 167.128 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 18.9 t0 -122.82 92.08 3.63 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-N 119.329 0.968 . . . . 0.0 109.788 174.758 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -59.51 -12.81 20.47 Favored Glycine 0 CA--C 1.529 0.93 0 CA-C-O 117.645 -1.642 . . . . 0.0 113.58 -178.454 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 -69.57 -20.98 63.65 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 120.389 2.094 . . . . 0.0 111.508 174.149 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 78.6 mtt85 -134.58 -0.07 2.95 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 126.771 2.028 . . . . 0.0 111.334 -167.756 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 5.9 mpt_? 44.63 48.3 8.65 Favored 'General case' 0 N--CA 1.463 0.177 0 C-N-CA 129.093 2.957 . . . . 0.0 112.593 174.579 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 13.9 t -143.67 -174.63 4.3 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 107.473 -1.306 . . . . 0.0 107.473 172.052 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 51.6 m-85 -106.05 135.73 46.99 Favored 'General case' 0 C--O 1.234 0.277 0 N-CA-C 106.913 -1.514 . . . . 0.0 106.913 169.77 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -125.87 157.3 69.54 Favored Pre-proline 0 C--N 1.328 -0.359 0 C-N-CA 126.043 1.737 . . . . 0.0 109.176 178.598 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.423 ' HA ' HD23 ' A' ' 52' ' ' LEU . 61.0 Cg_endo -70.77 142.08 42.64 Favored 'Trans proline' 0 N--CA 1.452 -0.932 0 C-N-CA 121.232 1.288 . . . . 0.0 111.331 179.629 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -114.01 38.07 3.11 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 125.589 1.555 . . . . 0.0 111.245 -177.29 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -65.82 -34.73 78.82 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 123.991 0.916 . . . . 0.0 111.977 -173.516 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -172.29 155.61 3.61 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 129.147 2.979 . . . . 0.0 103.96 175.148 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 11.0 mt-30 -155.6 13.77 0.35 Allowed 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 125.763 1.625 . . . . 0.0 112.025 164.175 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -132.94 77.98 1.77 Allowed 'General case' 0 N--CA 1.462 0.134 0 O-C-N 120.795 -1.19 . . . . 0.0 109.4 -177.691 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 60.16 -166.78 0.19 Allowed 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 125.637 1.575 . . . . 0.0 110.172 -166.312 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 6.7 t0 -153.94 115.36 4.15 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 126.814 2.046 . . . . 0.0 106.685 -166.219 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 154.32 -163.77 31.22 Favored Glycine 0 CA--C 1.526 0.73 0 CA-C-N 120.862 1.665 . . . . 0.0 114.57 -176.753 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 6.4 p80 -57.91 -0.87 0.09 Allowed 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 118.056 2.613 . . . . 0.0 118.056 -165.044 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 29.0 mtmm -81.73 -175.43 5.56 Favored 'General case' 0 C--N 1.329 -0.312 0 O-C-N 121.335 -0.853 . . . . 0.0 109.277 179.431 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 4.6 mp0 -62.99 -178.4 0.21 Allowed 'General case' 0 CA--C 1.541 0.61 0 CA-C-O 121.571 0.7 . . . . 0.0 109.546 159.768 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -49.16 -14.02 0.08 Allowed 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 128.982 2.913 . . . . 0.0 114.875 175.8 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -173.07 173.76 45.72 Favored Glycine 0 N--CA 1.437 -1.292 0 O-C-N 121.125 -0.984 . . . . 0.0 111.744 -179.707 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -157.67 165.81 17.91 Favored Pre-proline 0 N--CA 1.451 -0.38 0 C-N-CA 125.847 1.659 . . . . 0.0 108.86 178.911 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -61.2 114.95 2.42 Favored 'Trans proline' 0 CA--C 1.535 0.561 0 C-N-CA 121.962 1.775 . . . . 0.0 110.784 161.435 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 2.5 p -171.38 59.12 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.186 0 C-N-CA 127.773 2.429 . . . . 0.0 107.457 -179.726 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 19.2 tptt -150.57 0.42 0.43 Allowed 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 168.363 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -131.41 79.98 1.91 Allowed 'General case' 0 C--O 1.236 0.358 0 N-CA-C 105.343 -2.095 . . . . 0.0 105.343 172.895 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 105.2 -78.89 0.27 Allowed Glycine 0 C--N 1.335 0.503 0 CA-C-O 122.135 0.853 . . . . 0.0 111.462 167.629 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.98 5.86 0.12 Allowed 'General case' 0 C--O 1.235 0.322 0 C-N-CA 124.566 1.146 . . . . 0.0 113.706 179.554 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 2.7 pt-20 -55.6 -48.32 75.05 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 120.234 1.379 . . . . 0.0 109.524 172.096 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -129.73 -4.16 4.67 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 115.073 1.508 . . . . 0.0 115.073 178.067 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 24.6 mtmt 70.67 170.02 0.31 Allowed 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 126.266 1.826 . . . . 0.0 111.12 172.876 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 17.2 mp0 -81.53 -70.77 0.51 Allowed 'General case' 0 C--O 1.236 0.392 0 N-CA-C 108.483 -0.932 . . . . 0.0 108.483 178.348 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 47.33 -158.32 0.04 OUTLIER 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 124.428 1.091 . . . . 0.0 109.503 -158.506 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 39.5 m-70 46.73 61.87 2.61 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 125.711 1.604 . . . . 0.0 113.274 179.559 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 2.3 ttpt -120.46 0.11 10.45 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 112.733 0.642 . . . . 0.0 112.733 -178.931 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -107.12 173.98 6.09 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.941 0.896 . . . . 0.0 108.805 -174.57 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 92' ' ' LYS . . . . . 0.431 ' O ' ' HE3' ' A' ' 92' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.243 0.752 0 N-CA-C 104.877 -2.268 . . . . 0.0 104.877 162.147 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.877 0 N-CA-C 109.888 -1.285 . . . . 0.0 109.888 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 35.5 t-80 -118.73 98.96 6.48 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 125.155 1.382 . . . . 0.0 107.754 -176.23 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 28.1 ptm -147.27 -0.68 0.67 Allowed 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 125.013 1.325 . . . . 0.0 113.386 -177.012 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 17.0 mt-30 -119.29 155.65 31.43 Favored 'General case' 0 C--O 1.233 0.233 0 N-CA-C 106.301 -1.74 . . . . 0.0 106.301 160.003 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 17.6 pt-20 -141.31 4.92 1.83 Allowed 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 114.308 1.225 . . . . 0.0 114.308 173.578 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 50.77 65.86 1.34 Allowed 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 124.057 0.943 . . . . 0.0 111.968 163.156 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -74.13 -179.81 4.03 Favored 'General case' 0 C--O 1.239 0.542 0 C-N-CA 124.692 1.197 . . . . 0.0 109.841 -170.772 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 63.75 76.7 0.35 Allowed 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 179.752 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -61.72 -70.82 0.17 Allowed 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 126.879 2.072 . . . . 0.0 109.032 -179.888 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 45.6 m-85 -115.61 157.48 44.22 Favored Pre-proline 0 CA--C 1.536 0.433 0 O-C-N 123.878 0.736 . . . . 0.0 111.567 179.089 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 61.9 Cg_endo -73.11 -177.8 3.18 Favored 'Trans proline' 0 CA--C 1.537 0.672 0 C-N-CA 124.747 3.631 . . . . 0.0 112.084 174.686 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 29.7 t -110.88 87.33 6.78 Favored Pre-proline 0 CA--C 1.532 0.284 0 C-N-CA 126.818 2.047 . . . . 0.0 108.697 -176.184 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 41.0 Cg_endo -67.27 162.1 40.11 Favored 'Trans proline' 0 CA--C 1.542 0.89 0 C-N-CA 121.847 1.698 . . . . 0.0 109.955 171.539 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.424 ' C ' ' H ' ' A' ' 16' ' ' SER . 50.8 t0 -159.45 32.94 0.2 Allowed 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 123.12 0.568 . . . . 0.0 111.302 -172.817 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . 0.376 7.5 p 43.78 -22.68 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.552 1.055 1 C-N-CA 133.408 4.683 . . . . 0.0 116.727 -165.94 . . . . . . . . 3 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' SER . . . . . 0.424 ' H ' ' C ' ' A' ' 14' ' ' ASP . 2.8 p -70.18 -18.22 63.19 Favored 'General case' 0 N--CA 1.446 -0.672 0 C-N-CA 128.635 2.774 . . . . 0.0 111.995 -174.086 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 16.5 p -87.62 -13.95 41.37 Favored 'General case' 0 CA--C 1.538 0.501 0 O-C-N 121.139 -0.976 . . . . 0.0 110.712 175.455 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 13.7 m-30 -72.56 148.35 45.04 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-O 122.501 1.143 . . . . 0.0 111.023 -161.014 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 84.7 mt-30 -87.4 101.95 14.06 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 105.921 -1.881 . . . . 0.0 105.921 170.178 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 88.3 t80 -59.05 142.72 50.57 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 107.742 -1.207 . . . . 0.0 107.742 159.817 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -128.13 88.95 2.84 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 104.692 -2.336 . . . . 0.0 104.692 -176.484 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -56.09 -27.89 55.5 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 124.544 1.138 . . . . 0.0 113.699 -171.017 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 10.6 t -45.74 -52.93 10.26 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 126.024 1.73 . . . . 0.0 111.124 177.741 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 22.2 m -93.22 -35.71 12.98 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 118.513 0.597 . . . . 0.0 110.86 169.548 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 80.16 58.36 2.8 Favored Glycine 0 CA--C 1.524 0.61 0 N-CA-C 110.044 -1.222 . . . . 0.0 110.044 -173.198 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 30.3 m-85 -142.23 169.95 16.62 Favored 'General case' 0 C--O 1.24 0.597 0 C-N-CA 130.237 3.415 . . . . 0.0 106.229 173.138 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 82.2 m-85 -101.64 150.89 22.64 Favored 'General case' 0 CA--C 1.522 -0.116 0 O-C-N 121.906 -0.496 . . . . 0.0 111.043 178.709 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 41.6 t80 -119.84 140.92 50.06 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 127.848 2.459 . . . . 0.0 107.886 174.279 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 51.4 t0 -104.92 86.4 1.49 Allowed Pre-proline 0 N--CA 1.467 0.4 0 C-N-CA 127.468 2.307 . . . . 0.0 109.95 -177.134 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo -62.26 -13.77 34.36 Favored 'Trans proline' 0 CA--C 1.533 0.455 0 C-N-CA 122.716 2.278 . . . . 0.0 113.765 -175.924 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -74.32 -14.42 60.89 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 124.169 0.988 . . . . 0.0 111.453 -179.42 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.483 HG21 ' CE2' ' A' ' 61' ' ' TYR . 2.9 p -141.12 -45.77 0.38 Allowed 'General case' 0 C--N 1.332 -0.17 0 C-N-CA 125.519 1.528 . . . . 0.0 110.426 -172.204 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 98.31 46.06 2.25 Favored Glycine 0 N--CA 1.446 -0.654 0 N-CA-C 109.731 -1.348 . . . . 0.0 109.731 -175.719 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 12.7 mt -118.77 173.2 7.01 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 127.111 2.164 . . . . 0.0 107.568 172.535 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 26.4 m-85 -117.86 166.1 12.88 Favored 'General case' 0 C--O 1.238 0.481 0 C-N-CA 123.962 0.905 . . . . 0.0 109.443 168.358 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 69.2 t80 -143.87 158.65 43.55 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 125.995 1.718 . . . . 0.0 109.63 -178.372 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -131.24 143.76 50.66 Favored Pre-proline 0 CA--C 1.538 0.501 0 C-N-CA 125.406 1.482 . . . . 0.0 110.825 175.2 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -74.26 -35.12 4.18 Favored 'Trans proline' 0 CA--C 1.536 0.614 0 C-N-CA 123.465 2.777 . . . . 0.0 114.346 -178.183 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 13.6 m-80 -76.51 -23.32 53.7 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 120.085 1.311 . . . . 0.0 110.851 174.667 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -134.91 85.99 2.22 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 124.135 0.974 . . . . 0.0 108.895 -158.495 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 6.1 mp0 -62.85 -0.08 0.61 Allowed 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 124.598 1.159 . . . . 0.0 114.084 -176.038 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 60.8 m-85 -77.85 110.12 12.46 Favored 'General case' 0 C--O 1.237 0.402 0 O-C-N 120.052 -1.655 . . . . 0.0 108.449 174.525 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 14.5 m-85 -63.03 146.04 54.1 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 125.507 1.523 . . . . 0.0 109.811 -176.094 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 74.7 t80 -102.23 112.81 25.64 Favored 'General case' 0 CA--C 1.516 -0.34 0 CA-C-O 122.735 1.255 . . . . 0.0 108.206 177.785 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 49.3 t30 -84.64 80.88 9.1 Favored 'General case' 0 N--CA 1.44 -0.944 0 C-N-CA 125.266 1.427 . . . . 0.0 108.728 175.785 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -44.42 -37.17 3.25 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 125.182 1.393 . . . . 0.0 111.817 175.737 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 3.2 tt0 -44.35 -43.11 7.3 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 127.842 2.457 . . . . 0.0 112.766 179.927 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 17.9 m -131.78 21.04 4.6 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 125.438 1.495 . . . . 0.0 110.835 177.878 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 43.4 mt-30 48.27 27.99 1.47 Allowed 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 126.153 1.781 . . . . 0.0 112.571 -173.433 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.1 tp-100 -94.09 169.8 10.0 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 124.638 1.175 . . . . 0.0 110.594 -170.422 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 3.4 m-85 -108.29 144.57 35.62 Favored 'General case' 0 C--O 1.236 0.386 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 169.461 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 83.4 mt -142.6 179.93 6.68 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 127.197 2.199 . . . . 0.0 107.663 -178.991 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 17.8 p90 -135.83 146.09 47.13 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 124.435 1.094 . . . . 0.0 108.817 167.75 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 64.8 t-105 -73.43 132.95 43.54 Favored 'General case' 0 C--O 1.236 0.379 0 N-CA-C 105.676 -1.972 . . . . 0.0 105.676 164.961 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 58.9 t0 -129.63 76.6 1.73 Allowed 'General case' 0 CA--C 1.514 -0.412 0 C-N-CA 123.921 0.888 . . . . 0.0 109.004 -174.46 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -57.48 -7.16 2.78 Favored Glycine 0 CA--C 1.534 1.268 0 C-N-CA 124.692 1.139 . . . . 0.0 113.074 -176.079 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 34.3 mm-40 -65.2 -32.68 74.49 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 119.157 1.479 . . . . 0.0 109.414 169.461 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 62.5 mtt180 -118.67 -13.37 9.62 Favored 'General case' 0 C--O 1.231 0.093 0 C-N-CA 127.11 2.164 . . . . 0.0 113.466 -174.732 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 81.9 mtt180 56.58 59.72 3.44 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 124.702 1.201 . . . . 0.0 110.705 -173.8 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 4.7 t -153.94 -179.23 7.67 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 123.515 0.726 . . . . 0.0 109.051 174.475 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' TYR . . . . . 0.483 ' CE2' HG21 ' A' ' 32' ' ' THR . 98.7 m-85 -116.73 123.0 46.11 Favored 'General case' 0 C--O 1.233 0.207 0 N-CA-C 108.587 -0.894 . . . . 0.0 108.587 172.239 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -124.31 157.26 65.24 Favored Pre-proline 0 C--N 1.328 -0.357 0 C-N-CA 126.029 1.731 . . . . 0.0 110.29 -168.689 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo -72.0 130.87 17.25 Favored 'Trans proline' 0 N--CA 1.454 -0.852 0 C-N-CA 122.013 1.809 . . . . 0.0 110.933 -171.909 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -108.01 37.57 2.42 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-O 122.156 0.979 . . . . 0.0 111.089 -176.551 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.21 -28.87 68.33 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 116.061 1.874 . . . . 0.0 116.061 169.878 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -169.16 -55.3 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 119.528 1.058 . . . . 0.0 109.012 -161.307 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER 44.08 76.57 0.08 Allowed 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 128.528 2.731 . . . . 0.0 112.855 -176.762 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 5.9 t -127.84 37.7 4.15 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.3 1.44 . . . . 0.0 109.757 -178.625 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 44.16 71.86 0.23 Allowed 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 126.83 2.052 . . . . 0.0 111.48 178.232 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 51.3 t0 -103.53 75.16 1.31 Allowed 'General case' 0 N--CA 1.445 -0.712 0 N-CA-C 107.301 -1.37 . . . . 0.0 107.301 -167.451 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 76.92 10.7 86.05 Favored Glycine 0 N--CA 1.439 -1.118 0 C-N-CA 118.602 -1.761 . . . . 0.0 115.022 155.298 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 54.7 m80 56.26 21.19 5.13 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 125.086 1.354 . . . . 0.0 112.49 -163.659 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 78.0 mttt -97.53 120.64 38.27 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 106.679 -1.6 . . . . 0.0 106.679 171.885 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -64.31 104.73 0.8 Allowed 'General case' 0 CA--C 1.51 -0.565 0 N-CA-C 104.234 -2.506 . . . . 0.0 104.234 147.406 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER 44.96 -70.68 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 130.045 3.338 . . . . 0.0 114.425 162.89 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 66.75 26.16 73.02 Favored Glycine 0 N--CA 1.443 -0.851 0 N-CA-C 110.439 -1.064 . . . . 0.0 110.439 178.35 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -150.86 85.92 5.06 Favored Pre-proline 0 N--CA 1.446 -0.648 0 C-N-CA 125.891 1.676 . . . . 0.0 108.237 -173.692 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_endo -70.98 94.15 0.63 Allowed 'Trans proline' 0 CA--C 1.536 0.586 0 C-N-CA 123.055 2.503 . . . . 0.0 109.341 175.43 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 11.0 t -112.41 81.08 1.42 Allowed 'General case' 0 CA--C 1.533 0.312 0 O-C-N 121.056 -1.027 . . . . 0.0 109.07 -177.954 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -129.35 16.8 6.02 Favored 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 123.965 0.906 . . . . 0.0 109.433 172.596 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 49.1 mm-40 68.68 120.15 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 126.246 1.818 . . . . 0.0 109.415 -166.293 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 145.19 -49.02 0.68 Allowed Glycine 0 CA--C 1.53 0.97 0 C-N-CA 127.884 2.659 . . . . 0.0 110.52 -175.773 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 9.5 ttmm -148.77 16.99 0.99 Allowed 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 125.054 1.341 . . . . 0.0 111.517 -167.984 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -57.85 -46.0 85.42 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 124.78 1.232 . . . . 0.0 110.393 -167.422 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 17.1 pttm -136.4 -35.52 0.74 Allowed 'General case' 0 CA--C 1.53 0.175 0 CA-C-O 117.113 -1.422 . . . . 0.0 112.303 -178.618 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 18.1 mtmt -76.73 170.34 16.63 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 119.916 1.234 . . . . 0.0 110.472 178.924 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 72.7 mm-40 45.26 61.71 2.45 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 127.212 2.205 . . . . 0.0 111.703 174.21 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 3.7 ptpp? -124.04 49.66 1.74 Allowed 'General case' 0 C--O 1.237 0.436 0 C-N-CA 126.17 1.788 . . . . 0.0 108.785 169.269 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 28.7 m-70 -72.4 175.9 5.81 Favored 'General case' 0 CA--C 1.539 0.532 0 O-C-N 121.741 -0.599 . . . . 0.0 111.729 -178.459 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 57.8 mtpt -119.96 -29.22 4.99 Favored 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 112.868 0.692 . . . . 0.0 112.868 -166.208 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 6.9 t -156.35 42.27 0.38 Allowed 'General case' 0 C--N 1.321 -0.635 0 C-N-CA 127.315 2.246 . . . . 0.0 105.8 -179.889 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 29.2 mtpp . . . . . 0 C--O 1.25 1.098 0 CA-C-O 116.691 -1.623 . . . . 0.0 110.742 -135.973 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.546 0 N-CA-C 110.663 -0.975 . . . . 0.0 110.663 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 22.6 p80 -117.65 -172.76 2.3 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 125.719 1.608 . . . . 0.0 108.572 179.122 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 27.2 ptt? -117.05 161.23 19.74 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 108.639 -0.875 . . . . 0.0 108.639 169.851 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -151.14 171.19 17.76 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 124.581 1.152 . . . . 0.0 108.419 173.243 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -118.13 -87.09 0.63 Allowed 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 106.504 -1.665 . . . . 0.0 106.504 173.173 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 4.7 t -153.1 35.4 0.47 Allowed 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 129.028 2.931 . . . . 0.0 106.71 168.405 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 9.2 p90 -77.48 -11.79 59.89 Favored 'General case' 0 C--O 1.236 0.349 0 O-C-N 120.985 -1.072 . . . . 0.0 112.228 -174.593 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 5.3 t -63.55 171.1 2.75 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-O 122.001 0.905 . . . . 0.0 110.822 178.263 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 1.1 pt20 -62.72 175.17 0.86 Allowed 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 124.993 1.317 . . . . 0.0 110.523 170.581 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 -75.61 158.29 83.3 Favored Pre-proline 0 C--O 1.239 0.53 0 O-C-N 121.815 -0.553 . . . . 0.0 110.96 -175.361 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_endo -75.79 -178.07 4.07 Favored 'Trans proline' 0 N--CA 1.455 -0.757 0 C-N-CA 123.571 2.847 . . . . 0.0 110.288 168.93 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 13.8 t -109.81 87.64 5.83 Favored Pre-proline 0 CA--C 1.544 0.719 0 C-N-CA 126.95 2.1 . . . . 0.0 108.58 -170.38 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 25.1 Cg_endo -77.1 -178.25 4.44 Favored 'Trans proline' 0 CA--C 1.539 0.769 0 C-N-CA 124.552 3.501 . . . . 0.0 111.726 -173.76 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 22.7 t0 -152.5 142.48 22.19 Favored 'General case' 0 N--CA 1.468 0.437 0 O-C-N 121.473 -0.767 . . . . 0.0 110.102 166.417 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 12.5 p -62.65 -19.95 24.02 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.64 0 O-C-N 121.336 -0.853 . . . . 0.0 110.971 174.089 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 17.4 m -59.41 -10.55 3.3 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.804 1.242 . . . . 0.0 113.914 173.276 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.4 t -115.97 9.26 14.85 Favored 'General case' 0 CA--C 1.545 0.767 0 CA-C-N 120.159 1.345 . . . . 0.0 111.199 177.729 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 11.4 m-30 -89.01 167.68 12.97 Favored 'General case' 0 C--O 1.236 0.36 0 O-C-N 120.837 -1.165 . . . . 0.0 111.756 -178.224 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 43.9 mt-30 -98.54 129.69 45.1 Favored 'General case' 0 C--O 1.224 -0.268 0 N-CA-C 107.455 -1.313 . . . . 0.0 107.455 170.652 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 69.2 t80 -73.62 150.25 41.49 Favored 'General case' 0 C--O 1.24 0.577 0 CA-C-N 119.239 0.927 . . . . 0.0 108.742 161.281 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -126.25 93.83 3.92 Favored 'General case' 0 C--O 1.233 0.206 0 N-CA-C 107.513 -1.292 . . . . 0.0 107.513 175.541 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.82 -27.46 51.47 Favored 'General case' 0 N--CA 1.462 0.141 0 C-N-CA 124.864 1.265 . . . . 0.0 112.676 -179.677 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 13.5 t -50.95 -30.67 15.54 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 126.084 1.754 . . . . 0.0 112.385 173.43 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 31.0 m -139.18 -13.11 1.19 Allowed 'General case' 0 CA--C 1.532 0.255 0 N-CA-C 114.004 1.113 . . . . 0.0 114.004 -172.759 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 77.11 39.65 26.79 Favored Glycine 0 CA--C 1.527 0.841 0 CA-C-N 119.623 1.101 . . . . 0.0 111.651 174.181 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 4.8 m-85 -129.0 171.56 12.23 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 126.833 2.053 . . . . 0.0 107.317 170.691 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 84.2 m-85 -102.79 151.35 22.51 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 124.851 1.261 . . . . 0.0 107.717 163.92 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 37.4 t80 -117.59 139.98 50.24 Favored 'General case' 0 N--CA 1.45 -0.446 0 C-N-CA 126.801 2.04 . . . . 0.0 107.977 174.824 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -113.91 84.06 8.29 Favored Pre-proline 0 N--CA 1.439 -1.014 0 C-N-CA 125.705 1.602 . . . . 0.0 108.939 -162.184 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_endo -64.83 -14.42 44.88 Favored 'Trans proline' 0 C--N 1.349 0.587 0 C-N-CA 123.143 2.562 . . . . 0.0 113.176 -176.881 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 26.9 tt0 -69.38 -20.29 63.82 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 126.349 1.859 . . . . 0.0 111.495 -178.786 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -146.69 -33.63 0.3 Allowed 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 125.235 1.414 . . . . 0.0 112.391 -166.732 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 91.98 39.3 5.51 Favored Glycine 0 CA--C 1.527 0.831 0 C-N-CA 125.079 1.323 . . . . 0.0 111.648 -176.89 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 10.0 mt -122.66 -179.2 4.14 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 125.707 1.603 . . . . 0.0 108.012 177.546 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 47.2 m-85 -123.14 154.98 37.91 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 123.447 0.699 . . . . 0.0 109.369 166.61 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 39.7 t80 -124.41 158.38 32.87 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 127.376 2.27 . . . . 0.0 110.195 177.081 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 15.5 t0 -132.42 142.05 43.5 Favored Pre-proline 0 N--CA 1.468 0.461 0 C-N-CA 126.124 1.77 . . . . 0.0 108.253 -179.414 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo -81.1 -30.18 1.74 Allowed 'Trans proline' 0 C--O 1.239 0.572 0 C-N-CA 122.345 2.03 . . . . 0.0 114.18 -174.577 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -76.74 -30.4 56.58 Favored 'General case' 0 N--CA 1.453 -0.309 0 O-C-N 121.141 -0.974 . . . . 0.0 110.833 173.365 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 48.9 m -136.92 98.08 3.68 Favored 'General case' 0 C--O 1.219 -0.527 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 -168.82 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 26.9 mp0 -56.97 -6.68 0.37 Allowed 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 125.942 1.697 . . . . 0.0 113.782 -178.985 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 25.4 m-85 -66.26 103.51 1.01 Allowed 'General case' 0 N--CA 1.446 -0.643 0 C-N-CA 126.049 1.74 . . . . 0.0 107.803 173.549 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 50.2 m-85 -59.56 156.94 12.42 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 125.056 1.342 . . . . 0.0 109.771 178.235 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 66.7 t80 -111.57 112.76 24.71 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 125.169 1.388 . . . . 0.0 108.042 177.579 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 50.3 t30 -84.15 81.41 8.82 Favored 'General case' 0 N--CA 1.446 -0.651 0 C-N-CA 125.875 1.67 . . . . 0.0 109.098 178.096 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -50.21 -30.83 12.36 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 124.82 1.248 . . . . 0.0 112.354 178.425 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -53.65 -36.61 62.27 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 127.182 2.193 . . . . 0.0 113.68 -179.35 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 60.5 m -128.59 -1.0 5.52 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.656 1.182 . . . . 0.0 112.543 -179.505 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 20.6 mt-30 65.7 35.97 6.6 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.799 1.639 . . . . 0.0 110.166 -169.494 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -103.78 170.39 7.95 Favored 'General case' 0 N--CA 1.468 0.451 0 O-C-N 120.435 -1.416 . . . . 0.0 110.822 -175.331 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 4.2 m-85 -117.98 133.02 56.32 Favored 'General case' 0 C--O 1.234 0.245 0 C-N-CA 124.888 1.275 . . . . 0.0 107.898 177.771 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.455 ' HA ' ' HA ' ' A' ' 63' ' ' PRO . 41.9 mt -132.9 177.84 7.34 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 125.777 1.631 . . . . 0.0 109.135 -175.136 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 32.5 p90 -139.16 153.15 47.89 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 125.457 1.503 . . . . 0.0 108.697 168.611 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 57.2 t-105 -85.71 128.6 34.83 Favored 'General case' 0 C--O 1.233 0.227 0 N-CA-C 106.806 -1.554 . . . . 0.0 106.806 168.927 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 61.8 t0 -121.16 100.01 6.81 Favored 'General case' 0 N--CA 1.446 -0.657 0 N-CA-C 108.444 -0.946 . . . . 0.0 108.444 -174.743 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -71.23 -15.79 74.89 Favored Glycine 0 CA--C 1.526 0.732 0 CA-C-O 118.317 -1.268 . . . . 0.0 112.835 176.95 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -62.99 -43.96 97.35 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 119.615 1.708 . . . . 0.0 107.028 173.389 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 5.6 mtt180 -107.1 -6.44 17.39 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 125.097 1.359 . . . . 0.0 113.288 -170.494 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 86.1 mtt180 43.88 60.81 2.55 Favored 'General case' 0 CA--C 1.52 -0.205 0 C-N-CA 127.989 2.515 . . . . 0.0 109.753 -169.874 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 6.2 t -150.2 172.2 15.71 Favored 'General case' 0 N--CA 1.447 -0.594 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 -179.831 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 74.0 m-85 -104.43 129.16 52.41 Favored 'General case' 0 C--O 1.236 0.363 0 N-CA-C 108.701 -0.852 . . . . 0.0 108.701 166.223 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -126.16 154.98 74.32 Favored Pre-proline 0 C--N 1.327 -0.388 0 C-N-CA 127.272 2.229 . . . . 0.0 108.815 -177.142 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.455 ' HA ' ' HA ' ' A' ' 52' ' ' LEU . 68.5 Cg_endo -75.39 137.73 21.24 Favored 'Trans proline' 0 N--CA 1.456 -0.691 0 C-N-CA 122.104 1.869 . . . . 0.0 111.726 -176.986 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -107.65 29.11 7.51 Favored 'General case' 0 N--CA 1.461 0.113 0 C-N-CA 124.847 1.259 . . . . 0.0 111.703 -178.047 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 7.6 mp -56.72 -63.2 1.28 Allowed 'General case' 0 N--CA 1.448 -0.571 0 N-CA-C 107.553 -1.277 . . . . 0.0 107.553 161.239 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 17.7 tp10 -124.35 -52.65 1.72 Allowed 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 112.961 0.726 . . . . 0.0 112.961 -161.551 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . 0.265 17.0 pt20 47.69 18.63 0.13 Allowed 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 126.49 1.916 . . . . 0.0 116.148 -176.442 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 1.8 t -120.71 14.83 11.8 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 125.089 1.356 . . . . 0.0 113.524 -166.993 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 62.06 53.87 2.88 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 124.816 1.246 . . . . 0.0 111.671 179.372 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -82.36 -68.93 0.66 Allowed 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 115.831 -0.622 . . . . 0.0 109.998 174.158 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 173.53 -156.41 24.09 Favored Glycine 0 CA--C 1.528 0.899 0 C-N-CA 125.92 1.724 . . . . 0.0 109.542 -171.299 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 40.9 t-80 -123.75 19.77 9.4 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 126.407 1.883 . . . . 0.0 110.998 -179.185 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 89.4 mttt -68.5 100.69 1.13 Allowed 'General case' 0 C--O 1.225 -0.193 0 C-N-CA 124.885 1.274 . . . . 0.0 110.704 -165.523 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 44.99 74.67 0.12 Allowed 'General case' 0 CA--C 1.517 -0.295 0 C-N-CA 124.857 1.263 . . . . 0.0 109.594 -165.885 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 1.8 m 75.48 -37.52 0.33 Allowed 'General case' 0 CA--C 1.537 0.454 0 O-C-N 121.492 -0.755 . . . . 0.0 111.268 167.135 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 164.75 174.31 34.34 Favored Glycine 0 CA--C 1.527 0.791 0 C-N-CA 124.781 1.181 . . . . 0.0 110.931 -168.71 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -108.51 158.07 34.89 Favored Pre-proline 0 CA--C 1.537 0.446 0 C-N-CA 123.895 0.878 . . . . 0.0 110.63 -174.132 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_endo -73.19 125.03 9.95 Favored 'Trans proline' 0 N--CA 1.456 -0.735 0 C-N-CA 122.486 2.124 . . . . 0.0 109.363 171.16 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 1.7 m -136.06 84.53 2.09 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 107.874 -1.158 . . . . 0.0 107.874 171.901 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 7.9 tptm -155.49 -16.97 0.11 Allowed 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 125.448 1.499 . . . . 0.0 112.524 177.212 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 80.1 mt-10 -74.25 9.05 1.81 Allowed 'General case' 0 CA--C 1.547 0.845 0 O-C-N 120.233 -1.542 . . . . 0.0 112.628 -177.949 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 102.19 -24.73 30.16 Favored Glycine 0 C--N 1.335 0.497 0 C-N-CA 124.996 1.284 . . . . 0.0 112.208 170.508 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 5.1 mptt -84.28 12.11 7.19 Favored 'General case' 0 C--O 1.215 -0.726 0 CA-C-O 116.868 -1.539 . . . . 0.0 111.353 168.716 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 18.0 pt-20 -45.57 19.67 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.043 1 C-N-CA 134.779 5.232 . . . . 0.0 118.329 -176.534 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 1.8 tmtp? -178.83 -21.86 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 128.493 2.717 . . . . 0.0 111.288 -155.946 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -145.54 22.04 1.48 Allowed 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 127.357 2.263 . . . . 0.0 110.809 -160.949 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.532 ' H ' ' CD ' ' A' ' 87' ' ' GLU . 0.2 OUTLIER -66.25 48.67 0.03 OUTLIER 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 128.972 2.909 . . . . 0.0 112.594 176.293 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 46.1 mttp -113.98 110.48 20.13 Favored 'General case' 0 N--CA 1.449 -0.517 0 N-CA-C 106.145 -1.798 . . . . 0.0 106.145 173.052 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 41.5 m80 -66.13 153.87 41.21 Favored 'General case' 0 C--O 1.238 0.49 0 N-CA-C 107.847 -1.168 . . . . 0.0 107.847 167.58 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 7.0 mmtp -78.01 96.07 4.99 Favored 'General case' 0 N--CA 1.462 0.144 0 N-CA-C 106.491 -1.67 . . . . 0.0 106.491 164.525 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -144.83 149.07 34.77 Favored 'General case' 0 C--O 1.237 0.402 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 176.953 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 3.3 ttpp . . . . . 0 C--O 1.247 0.969 0 CA-C-O 117.156 -1.402 . . . . 0.0 109.691 -162.67 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.733 0 N-CA-C 108.28 -1.928 . . . . 0.0 108.28 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 97.2 m-70 -130.69 146.52 52.19 Favored 'General case' 0 C--O 1.234 0.282 0 N-CA-C 108.277 -1.008 . . . . 0.0 108.277 -177.191 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 7.8 ptt? -161.33 -169.3 2.27 Favored 'General case' 0 N--CA 1.45 -0.444 0 C-N-CA 127.103 2.161 . . . . 0.0 107.335 168.179 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 46.6 mt-30 -59.7 165.16 3.18 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 123.892 0.877 . . . . 0.0 110.768 171.774 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 1.8 pt-20 -147.54 -86.74 0.09 Allowed 'General case' 0 C--O 1.233 0.194 0 O-C-N 121.628 -0.67 . . . . 0.0 109.348 -175.777 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -161.61 11.71 0.08 Allowed 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 123.26 0.624 . . . . 0.0 111.789 -174.256 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 38.3 p90 -73.61 -28.68 61.94 Favored 'General case' 0 C--O 1.232 0.17 0 O-C-N 121.155 -0.966 . . . . 0.0 110.726 -166.581 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER 60.42 150.95 0.02 OUTLIER 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 129.448 3.099 . . . . 0.0 113.386 178.212 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -153.54 -178.67 7.16 Favored 'General case' 0 N--CA 1.45 -0.473 0 O-C-N 121.248 -0.908 . . . . 0.0 110.344 -177.914 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 27.9 m-85 -82.93 164.33 46.99 Favored Pre-proline 0 CA--C 1.536 0.432 0 C-N-CA 124.643 1.177 . . . . 0.0 111.52 -167.842 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -65.67 170.09 11.83 Favored 'Trans proline' 0 CA--C 1.536 0.582 0 C-N-CA 123.819 3.012 . . . . 0.0 109.842 165.313 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 42.4 t -109.23 86.19 3.96 Favored Pre-proline 0 CA--C 1.536 0.428 0 C-N-CA 125.277 1.431 . . . . 0.0 108.539 -170.479 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 42.1 Cg_endo -75.93 166.78 27.44 Favored 'Trans proline' 0 N--CA 1.449 -1.103 0 C-N-CA 121.74 1.627 . . . . 0.0 110.34 -174.366 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 61.5 t0 -142.61 129.38 20.47 Favored 'General case' 0 C--O 1.237 0.412 0 N-CA-C 107.08 -1.452 . . . . 0.0 107.08 173.838 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.476 HG21 ' CE1' ' A' ' 36' ' ' TYR . 12.3 p -53.85 -24.55 10.57 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.352 0 C-N-CA 124.626 1.17 . . . . 0.0 111.995 176.039 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 38.7 t -45.54 -29.54 1.2 Allowed 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.74 1.616 . . . . 0.0 112.389 170.267 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 49.0 p -109.68 2.22 20.03 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 125.149 1.38 . . . . 0.0 112.879 -171.557 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 15.7 m-30 -77.37 175.49 9.72 Favored 'General case' 0 C--O 1.236 0.382 0 O-C-N 121.302 -0.873 . . . . 0.0 110.605 -178.973 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 80.9 mt-30 -116.85 106.59 13.62 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 125.263 1.425 . . . . 0.0 107.473 -176.313 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 49.4 t80 -66.34 147.11 53.78 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.826 -0.435 . . . . 0.0 109.826 176.371 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -135.08 86.0 2.22 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 125.319 1.448 . . . . 0.0 107.203 176.709 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -49.86 -32.22 13.86 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 126.946 2.098 . . . . 0.0 113.635 179.415 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 7.1 t -60.54 -18.65 53.61 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 125.035 1.334 . . . . 0.0 112.503 179.165 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 58.6 m -107.17 -50.3 3.11 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 118.965 0.802 . . . . 0.0 109.582 153.967 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 117.27 9.56 10.38 Favored Glycine 0 CA--C 1.522 0.499 0 C-N-CA 125.452 1.501 . . . . 0.0 112.05 -172.048 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -105.63 168.94 8.77 Favored 'General case' 0 CA--C 1.519 -0.236 0 CA-C-N 118.576 1.188 . . . . 0.0 109.011 -175.443 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 94.8 m-85 -93.33 147.37 22.99 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 107.602 -1.258 . . . . 0.0 107.602 167.884 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 14.9 t80 -111.96 136.11 51.72 Favored 'General case' 0 N--CA 1.442 -0.871 0 C-N-CA 126.35 1.86 . . . . 0.0 107.027 171.57 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -119.69 77.71 21.29 Favored Pre-proline 0 N--CA 1.437 -1.091 0 C-N-CA 125.407 1.483 . . . . 0.0 108.773 -162.874 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 22.6 Cg_endo -62.9 -12.13 27.82 Favored 'Trans proline' 0 C--N 1.348 0.518 0 C-N-CA 122.83 2.354 . . . . 0.0 113.445 -176.861 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 21.0 mm-40 -62.71 -19.92 64.38 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.68 0.792 . . . . 0.0 111.111 174.459 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 5.8 p -141.74 -23.58 0.71 Allowed 'General case' 0 C--O 1.234 0.286 0 N-CA-C 113.834 1.049 . . . . 0.0 113.834 178.569 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 79.03 43.2 11.08 Favored Glycine 0 CA--C 1.531 1.034 0 N-CA-C 109.905 -1.278 . . . . 0.0 109.905 -166.301 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 42.3 mt -111.84 178.55 4.28 Favored 'General case' 0 C--O 1.234 0.282 0 C-N-CA 124.712 1.205 . . . . 0.0 108.175 165.659 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 36.9 m-85 -123.65 154.63 39.09 Favored 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 124.883 1.273 . . . . 0.0 107.605 166.304 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.476 ' CE1' HG21 ' A' ' 15' ' ' VAL . 24.3 t80 -131.02 156.06 45.79 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 125.414 1.485 . . . . 0.0 109.358 -178.217 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -127.22 144.15 49.62 Favored Pre-proline 0 CA--C 1.536 0.436 0 C-N-CA 123.649 0.78 . . . . 0.0 110.359 175.529 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -74.28 -31.75 7.21 Favored 'Trans proline' 0 CA--C 1.535 0.54 0 C-N-CA 122.894 2.396 . . . . 0.0 113.849 -176.758 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 8.5 m-80 -75.38 -29.62 59.91 Favored 'General case' 0 N--CA 1.462 0.144 0 CA-C-N 119.346 0.976 . . . . 0.0 109.925 170.395 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -129.64 89.73 2.88 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 123.881 0.873 . . . . 0.0 109.841 -158.267 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -68.15 9.94 0.27 Allowed 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 124.49 1.116 . . . . 0.0 112.913 -177.627 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 56.6 m-85 -81.78 112.77 19.24 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 126.589 1.956 . . . . 0.0 106.947 170.314 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 23.1 m-85 -77.96 124.49 28.07 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 124.255 1.022 . . . . 0.0 111.036 -177.681 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 92.1 t80 -77.2 118.85 20.12 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 125.153 1.381 . . . . 0.0 108.983 178.925 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 26.4 t30 -90.41 83.96 5.96 Favored 'General case' 0 CA--C 1.512 -0.489 0 C-N-CA 125.432 1.493 . . . . 0.0 109.565 -178.558 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -53.26 -26.03 16.64 Favored 'General case' 0 CA--C 1.538 0.504 0 N-CA-C 114.37 1.248 . . . . 0.0 114.37 -173.734 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -52.67 -66.01 0.46 Allowed 'General case' 0 C--O 1.236 0.343 0 C-N-CA 125.898 1.679 . . . . 0.0 109.084 178.178 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 19.2 m -112.69 22.67 14.3 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 124.922 1.289 . . . . 0.0 111.258 -171.272 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . 0.337 5.3 pt20 44.65 34.14 1.08 Allowed 'General case' 0 CA--C 1.554 1.11 0 C-N-CA 126.72 2.008 . . . . 0.0 113.312 -178.525 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 7.0 mm-40 -97.47 152.69 18.73 Favored 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 126.483 1.913 . . . . 0.0 112.26 178.844 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 3.4 m-30 -95.57 139.72 31.42 Favored 'General case' 0 N--CA 1.47 0.566 0 O-C-N 120.833 -1.167 . . . . 0.0 108.762 172.862 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.486 ' HA ' ' H ' ' A' ' 64' ' ' ALA . 41.4 mt -131.33 174.29 10.21 Favored 'General case' 0 N--CA 1.465 0.279 0 C-N-CA 126.749 2.02 . . . . 0.0 110.267 -176.478 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 31.2 p90 -143.53 149.14 37.03 Favored 'General case' 0 C--O 1.238 0.493 0 C-N-CA 124.107 0.963 . . . . 0.0 110.361 168.077 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 50.1 t-105 -93.16 92.6 7.84 Favored 'General case' 0 CA--C 1.516 -0.36 0 N-CA-C 105.075 -2.195 . . . . 0.0 105.075 -176.53 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 43.8 t0 -87.52 96.45 10.4 Favored 'General case' 0 N--CA 1.446 -0.669 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 -177.691 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -59.44 -15.37 31.55 Favored Glycine 0 CA--C 1.53 0.971 0 CA-C-O 118.414 -1.215 . . . . 0.0 112.694 178.754 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 22.7 mt-10 -66.92 -34.84 78.65 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 119.987 1.894 . . . . 0.0 110.1 175.4 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 21.1 mtt180 -109.58 -4.97 15.86 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 125.541 1.536 . . . . 0.0 111.453 -177.05 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 76.1 mtm180 44.21 49.16 7.77 Favored 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 126.374 1.87 . . . . 0.0 110.169 -174.697 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 3.2 t -147.13 178.81 8.09 Favored 'General case' 0 N--CA 1.443 -0.798 0 N-CA-C 108.909 -0.775 . . . . 0.0 108.909 -177.451 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 89.3 m-85 -109.76 131.72 54.8 Favored 'General case' 0 C--O 1.24 0.572 0 N-CA-C 108.146 -1.057 . . . . 0.0 108.146 178.1 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -125.88 154.43 73.56 Favored Pre-proline 0 C--N 1.325 -0.484 0 C-N-CA 125.788 1.635 . . . . 0.0 108.907 176.092 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.42 ' HA ' HD23 ' A' ' 52' ' ' LEU . 72.0 Cg_endo -75.43 124.03 8.06 Favored 'Trans proline' 0 N--CA 1.453 -0.871 0 C-N-CA 122.562 2.174 . . . . 0.0 111.105 179.497 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.486 ' H ' ' HA ' ' A' ' 52' ' ' LEU . . . -85.97 56.9 4.18 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-O 122.531 1.158 . . . . 0.0 109.379 166.674 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -63.8 176.97 0.81 Allowed 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 115.106 -0.952 . . . . 0.0 110.553 153.885 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -52.81 -33.26 48.34 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 124.064 0.946 . . . . 0.0 112.683 -175.982 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 8.5 pt20 50.32 11.03 0.06 Allowed 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 129.251 3.02 . . . . 0.0 115.151 175.252 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 13.3 t -140.24 17.5 2.42 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 125.782 1.633 . . . . 0.0 110.452 -178.668 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -149.51 164.24 35.61 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 119.266 0.939 . . . . 0.0 111.35 177.179 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 56.0 t0 65.67 -83.65 0.03 OUTLIER 'General case' 0 C--O 1.236 0.39 0 C-N-CA 130.754 3.622 . . . . 0.0 109.69 172.576 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 173.61 -162.6 33.59 Favored Glycine 0 N--CA 1.437 -1.263 0 N-CA-C 108.829 -1.708 . . . . 0.0 108.829 171.062 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 12.4 m80 -65.48 83.53 0.06 Allowed 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 118.408 1.104 . . . . 0.0 108.687 165.242 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 37.8 mttm -150.3 -167.35 2.8 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 125.205 1.402 . . . . 0.0 109.77 -173.085 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -64.56 -43.88 92.52 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 124.425 1.09 . . . . 0.0 111.087 179.39 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER 53.61 -10.45 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 127.867 2.467 . . . . 0.0 116.995 -164.925 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -85.55 92.53 1.78 Allowed Glycine 0 N--CA 1.434 -1.446 0 N-CA-C 107.823 -2.111 . . . . 0.0 107.823 -160.515 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -137.73 82.35 26.88 Favored Pre-proline 0 C--O 1.24 0.603 0 N-CA-C 107.388 -1.338 . . . . 0.0 107.388 170.97 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -84.46 64.16 6.71 Favored 'Trans proline' 0 N--CA 1.457 -0.622 0 C-N-CA 124.079 3.186 . . . . 0.0 110.182 -168.762 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 1.8 p -128.41 57.06 1.6 Allowed 'General case' 0 C--N 1.328 -0.352 0 O-C-N 121.06 -1.025 . . . . 0.0 111.06 -165.202 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 4.1 tmtt? -81.25 53.62 2.08 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 120.828 -1.17 . . . . 0.0 111.172 176.424 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . 0.302 0.1 OUTLIER 51.9 6.08 0.04 OUTLIER 'General case' 0 N--CA 1.47 0.558 1 C-N-CA 132.389 4.276 . . . . 0.0 118.403 158.064 . . . . . . . . 4 3 . 1 . 015 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -179.52 -20.61 0.03 OUTLIER Glycine 0 CA--C 1.526 0.751 0 C-N-CA 127.971 2.7 . . . . 0.0 110.412 178.866 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 37.6 tttt -79.54 -16.24 56.3 Favored 'General case' 0 C--N 1.349 0.567 0 CA-C-N 119.544 1.672 . . . . 0.0 110.701 168.095 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.48 ' HG3' ' H ' ' A' ' 85' ' ' LYS . 2.2 pt-20 -42.01 -71.68 0.08 Allowed 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 125.998 1.719 . . . . 0.0 110.358 -135.938 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.48 ' H ' ' HG3' ' A' ' 84' ' ' GLU . 2.3 ptmt -117.29 10.26 13.67 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 127.821 2.448 . . . . 0.0 110.751 174.78 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 84.2 tttt -80.37 -36.71 33.62 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 124.033 0.933 . . . . 0.0 112.062 -162.451 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 21.2 tp10 51.5 40.14 26.21 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 124.812 1.245 . . . . 0.0 112.617 173.059 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 36.4 mtpt 56.15 -65.29 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 129.858 3.263 . . . . 0.0 116.36 176.997 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 57.7 m80 49.48 70.29 0.5 Allowed 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 126.54 1.936 . . . . 0.0 112.326 -174.364 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 1.6 pptp? -93.11 118.15 30.89 Favored 'General case' 0 CA--C 1.529 0.144 0 C-N-CA 124.187 0.995 . . . . 0.0 109.457 -177.864 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 9.1 m -81.77 71.38 8.79 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-O 121.578 0.704 . . . . 0.0 109.406 175.607 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 1.3 mptm? . . . . . 0 C--O 1.249 1.053 0 N-CA-C 101.093 -3.669 . . . . 0.0 101.093 161.73 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.553 0 N-CA-C 109.873 -1.291 . . . . 0.0 109.873 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER 61.79 -178.15 0.12 Allowed 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 125.333 1.453 . . . . 0.0 109.873 -168.521 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 44.8 ttm -69.4 -33.88 73.67 Favored 'General case' 0 N--CA 1.463 0.198 0 O-C-N 121.209 -0.932 . . . . 0.0 110.176 -179.944 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 10.7 pt20 -139.97 158.0 44.78 Favored 'General case' 0 N--CA 1.449 -0.503 0 C-N-CA 123.421 0.688 . . . . 0.0 110.237 -154.697 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -84.84 -82.75 0.17 Allowed 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 106.99 -1.485 . . . . 0.0 106.99 167.508 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 5.4 p -171.74 15.73 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 124.498 1.119 . . . . 0.0 111.152 -165.164 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 22.5 t80 -85.37 120.24 26.62 Favored 'General case' 0 N--CA 1.434 -1.242 0 N-CA-C 107.901 -1.148 . . . . 0.0 107.901 -164.756 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 25.8 p -157.87 -62.66 0.09 Allowed 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 108.456 -0.942 . . . . 0.0 108.456 -178.601 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 11.8 mm100 -130.54 -85.07 0.53 Allowed 'General case' 0 N--CA 1.437 -1.088 0 C-N-CA 126.951 2.101 . . . . 0.0 109.507 176.898 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 68.6 m-85 -97.19 159.1 32.09 Favored Pre-proline 0 CA--C 1.537 0.457 0 CA-C-N 118.757 0.708 . . . . 0.0 111.208 -179.763 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -71.7 178.47 5.71 Favored 'Trans proline' 0 N--CA 1.459 -0.514 0 C-N-CA 123.964 3.109 . . . . 0.0 110.848 167.498 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 37.1 t -104.6 85.85 1.26 Allowed Pre-proline 0 CA--C 1.541 0.609 0 C-N-CA 127.009 2.123 . . . . 0.0 108.987 -171.494 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_endo -69.91 171.71 14.14 Favored 'Trans proline' 0 C--O 1.237 0.462 0 C-N-CA 123.142 2.561 . . . . 0.0 111.045 179.845 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 14.0 t0 -144.61 139.94 28.41 Favored 'General case' 0 C--O 1.224 -0.238 0 N-CA-C 107.412 -1.329 . . . . 0.0 107.412 178.401 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 6.5 p -65.61 -19.89 26.46 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.599 0 CA-C-N 119.291 0.951 . . . . 0.0 111.22 175.382 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 10.6 t -60.42 -17.83 46.87 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-O 117.334 -1.317 . . . . 0.0 112.092 173.079 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 29.7 p -100.15 -6.13 26.7 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 121.577 1.989 . . . . 0.0 113.028 176.005 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 13.3 m-30 -70.74 173.67 6.96 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 119.531 1.06 . . . . 0.0 112.472 -174.322 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 77.0 mt-30 -114.79 109.28 17.94 Favored 'General case' 0 CA--C 1.528 0.122 0 C-N-CA 126.142 1.777 . . . . 0.0 108.949 176.745 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 81.8 t80 -68.64 142.08 55.2 Favored 'General case' 0 C--O 1.238 0.491 0 CA-C-N 119.343 0.974 . . . . 0.0 110.674 169.708 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 3.6 t0 -119.71 111.42 18.0 Favored 'General case' 0 CA--C 1.504 -0.822 0 N-CA-C 106.686 -1.598 . . . . 0.0 106.686 170.817 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -64.2 -21.94 66.75 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 118.155 -0.926 . . . . 0.0 112.927 178.082 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 1.3 t -61.34 -38.76 88.1 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 118.327 0.512 . . . . 0.0 110.555 -171.82 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 7.8 m -113.36 -19.34 11.77 Favored 'General case' 0 C--O 1.233 0.219 0 C-N-CA 124.703 1.201 . . . . 0.0 111.018 173.87 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 81.46 34.49 25.51 Favored Glycine 0 C--N 1.337 0.599 0 N-CA-C 110.74 -0.944 . . . . 0.0 110.74 174.692 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 4.4 m-85 -119.69 171.05 8.66 Favored 'General case' 0 N--CA 1.463 0.213 0 C-N-CA 126.482 1.913 . . . . 0.0 108.352 178.475 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 67.5 m-85 -103.76 141.01 36.83 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 107.701 -1.222 . . . . 0.0 107.701 171.929 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 52.3 t80 -102.2 136.91 41.21 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 125.868 1.667 . . . . 0.0 106.574 169.91 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 16.7 t0 -97.82 87.45 0.53 Allowed Pre-proline 0 C--N 1.327 -0.387 0 C-N-CA 126.458 1.903 . . . . 0.0 110.332 179.826 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -61.51 -10.54 16.63 Favored 'Trans proline' 0 CA--C 1.537 0.647 0 C-N-CA 121.618 1.546 . . . . 0.0 113.236 176.22 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -80.88 -13.52 58.85 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 124.643 1.177 . . . . 0.0 112.219 -177.784 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 69.8 p -146.48 -23.81 0.43 Allowed 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 113.98 1.104 . . . . 0.0 113.98 168.2 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 108.14 3.27 33.7 Favored Glycine 0 CA--C 1.53 1.009 0 C-N-CA 124.881 1.229 . . . . 0.0 113.936 -179.272 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 39.4 mt -71.38 178.19 3.55 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 125.562 1.545 . . . . 0.0 110.587 173.983 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 54.3 m-85 -116.7 167.19 11.31 Favored 'General case' 0 C--O 1.237 0.424 0 C-N-CA 124.682 1.193 . . . . 0.0 108.333 158.295 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 80.3 t80 -141.4 163.06 33.97 Favored 'General case' 0 C--O 1.237 0.431 0 C-N-CA 126.376 1.87 . . . . 0.0 108.916 176.808 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -133.11 143.9 50.39 Favored Pre-proline 0 CA--C 1.536 0.406 0 C-N-CA 124.189 0.996 . . . . 0.0 110.503 177.971 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -73.71 -38.65 2.27 Favored 'Trans proline' 0 N--CA 1.454 -0.84 0 C-N-CA 123.236 2.624 . . . . 0.0 112.656 -176.017 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 27.0 m-80 -78.13 -35.97 48.38 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-N 119.091 0.86 . . . . 0.0 110.414 -178.272 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 48.8 p -130.86 91.95 3.14 Favored 'General case' 0 C--O 1.223 -0.301 0 N-CA-C 108.379 -0.971 . . . . 0.0 108.379 -159.886 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -60.79 0.17 0.23 Allowed 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 126.311 1.844 . . . . 0.0 115.549 -163.828 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 38.2 m-85 -68.53 123.98 22.33 Favored 'General case' 0 N--CA 1.448 -0.575 0 C-N-CA 125.134 1.374 . . . . 0.0 108.927 174.271 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 25.6 m-85 -75.92 141.64 42.25 Favored 'General case' 0 N--CA 1.448 -0.54 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 175.789 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 56.9 t80 -102.51 115.32 30.34 Favored 'General case' 0 C--N 1.33 -0.242 0 C-N-CA 123.949 0.899 . . . . 0.0 109.288 176.318 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 26.4 t30 -88.29 87.16 7.21 Favored 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 106.992 -1.484 . . . . 0.0 106.992 172.43 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -48.62 -39.6 24.59 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 124.618 1.167 . . . . 0.0 110.112 175.858 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -55.95 -11.34 1.02 Allowed 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 127.673 2.389 . . . . 0.0 116.409 -177.807 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -145.02 6.56 1.16 Allowed 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 119.728 1.149 . . . . 0.0 111.268 160.847 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 50.4 mt-30 64.94 15.78 10.14 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 129.345 3.058 . . . . 0.0 113.273 -168.045 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.92 148.64 49.89 Favored 'General case' 0 N--CA 1.466 0.334 0 O-C-N 121.096 -1.003 . . . . 0.0 111.19 -179.399 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 8.8 m-85 -106.34 132.31 52.53 Favored 'General case' 0 C--O 1.234 0.262 0 N-CA-C 108.165 -1.05 . . . . 0.0 108.165 168.037 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 78.5 mt -135.17 -176.03 4.12 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 127.136 2.174 . . . . 0.0 107.511 -172.741 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 19.6 p90 -146.7 160.24 42.47 Favored 'General case' 0 C--O 1.235 0.316 0 O-C-N 120.758 -1.213 . . . . 0.0 109.527 163.871 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 45.9 t-105 -82.39 105.07 13.15 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 125.15 1.38 . . . . 0.0 108.068 173.104 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 23.1 t0 -89.94 96.86 10.87 Favored 'General case' 0 C--O 1.235 0.339 0 N-CA-C 105.986 -1.857 . . . . 0.0 105.986 170.858 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -76.49 -7.38 85.35 Favored Glycine 0 CA--C 1.531 1.075 0 CA-C-O 118.235 -1.314 . . . . 0.0 112.804 -179.989 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 25.3 mt-10 -73.58 -48.6 31.55 Favored 'General case' 0 C--N 1.341 0.236 0 CA-C-N 119.853 1.827 . . . . 0.0 108.808 172.158 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -81.02 -14.62 57.74 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.631 1.172 . . . . 0.0 112.449 174.01 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.9 mpt_? 46.91 61.42 2.85 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 125.436 1.495 . . . . 0.0 109.913 -164.339 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 5.6 t -150.38 174.85 12.42 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-O 121.543 0.687 . . . . 0.0 109.978 174.059 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 93.6 m-85 -108.63 121.25 44.63 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 125.158 1.383 . . . . 0.0 108.106 179.028 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -125.21 154.31 71.82 Favored Pre-proline 0 C--N 1.324 -0.514 0 C-N-CA 125.403 1.481 . . . . 0.0 110.25 -170.263 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_endo -70.0 126.57 13.3 Favored 'Trans proline' 0 N--CA 1.454 -0.843 0 C-N-CA 122.479 2.119 . . . . 0.0 110.527 178.937 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -86.62 12.74 9.88 Favored 'General case' 0 C--N 1.332 -0.158 0 N-CA-C 114.235 1.198 . . . . 0.0 114.235 -173.621 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 5.1 mp -144.37 -85.13 0.14 Allowed 'General case' 0 N--CA 1.444 -0.73 0 C-N-CA 126.995 2.118 . . . . 0.0 108.011 -166.91 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -155.29 -63.84 0.12 Allowed 'General case' 0 N--CA 1.446 -0.664 0 C-N-CA 128.943 2.897 . . . . 0.0 104.911 176.188 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 48.31 173.79 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 130.231 3.412 . . . . 0.0 115.224 170.595 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 1.8 t 67.09 145.89 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 126.324 1.849 . . . . 0.0 110.559 -168.791 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 54.11 49.46 18.72 Favored 'General case' 0 C--O 1.239 0.523 0 C-N-CA 125.917 1.687 . . . . 0.0 112.704 179.443 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -60.36 137.0 58.21 Favored 'General case' 0 N--CA 1.447 -0.591 0 N-CA-C 106.764 -1.569 . . . . 0.0 106.764 168.45 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -154.75 -108.09 0.3 Allowed Glycine 0 N--CA 1.444 -0.775 0 N-CA-C 110.299 -1.12 . . . . 0.0 110.299 -163.643 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 1.4 m80 -134.02 56.22 1.86 Allowed 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 128.497 2.719 . . . . 0.0 106.369 170.691 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' LYS . . . . . 0.67 ' HD3' ' HB3' ' A' ' 77' ' ' ALA . 48.5 mttt -142.59 -176.72 4.97 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 126.544 1.938 . . . . 0.0 107.881 -166.336 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -67.85 -75.24 0.1 Allowed 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 119.202 0.91 . . . . 0.0 109.364 177.844 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -125.75 -49.43 1.62 Allowed 'General case' 0 CA--C 1.516 -0.344 0 C-N-CA 124.873 1.269 . . . . 0.0 111.083 -179.015 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -142.63 162.18 27.37 Favored Glycine 0 N--CA 1.446 -0.684 0 N-CA-C 108.374 -1.89 . . . . 0.0 108.374 179.448 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' ALA . . . . . 0.67 ' HB3' ' HD3' ' A' ' 73' ' ' LYS . . . 174.02 160.99 0.33 Allowed Pre-proline 0 CA--C 1.537 0.463 0 C-N-CA 126.576 1.951 . . . . 0.0 109.922 164.351 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 78' ' ' PRO . . . . . 0.528 ' HD2' ' HB1' ' A' ' 77' ' ' ALA . 86.5 Cg_endo -71.83 -176.59 2.12 Favored 'Trans proline' 0 CA--C 1.536 0.576 0 C-N-CA 124.535 3.49 . . . . 0.0 112.528 177.586 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 38.0 m -45.37 114.35 0.73 Allowed 'General case' 0 C--O 1.242 0.677 0 C-N-CA 125.114 1.365 . . . . 0.0 109.133 162.874 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 9.0 tmtt? -134.47 28.13 3.69 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 126.377 1.871 . . . . 0.0 107.664 -174.614 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 23.5 tt0 67.59 134.55 0.03 OUTLIER 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 127.821 2.448 . . . . 0.0 110.078 -168.943 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 95.24 -0.72 64.08 Favored Glycine 0 N--CA 1.466 0.68 0 O-C-N 120.91 -1.119 . . . . 0.0 112.485 159.344 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -149.84 16.61 0.87 Allowed 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 126.655 1.982 . . . . 0.0 108.994 172.108 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -59.88 132.76 54.94 Favored 'General case' 0 C--O 1.232 0.144 0 O-C-N 120.954 -1.091 . . . . 0.0 108.948 -172.004 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 50.39 18.66 0.46 Allowed 'General case' 0 CA--C 1.545 0.757 0 N-CA-C 114.386 1.254 . . . . 0.0 114.386 -177.262 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 72.0 mmtt 47.66 56.38 7.18 Favored 'General case' 0 N--CA 1.461 0.099 0 C-N-CA 124.734 1.214 . . . . 0.0 110.526 -171.264 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.23 97.91 0.1 Allowed 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 108.326 -0.99 . . . . 0.0 108.326 154.709 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 25.6 ttmt -114.51 129.01 56.63 Favored 'General case' 0 N--CA 1.464 0.271 0 N-CA-C 107.064 -1.458 . . . . 0.0 107.064 -178.037 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 27.4 m170 -131.61 162.37 30.5 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 123.236 0.614 . . . . 0.0 110.469 178.411 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 8.0 ttpp -97.09 119.49 35.67 Favored 'General case' 0 CA--C 1.515 -0.368 0 N-CA-C 106.803 -1.554 . . . . 0.0 106.803 175.296 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 3.3 p -130.51 152.86 49.43 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 108.049 -1.093 . . . . 0.0 108.049 168.982 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 27.6 mttm . . . . . 0 C--O 1.248 0.989 0 N-CA-C 105.524 -2.028 . . . . 0.0 105.524 -151.921 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.268 0 N-CA-C 110.485 -1.046 . . . . 0.0 110.485 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 77.8 m80 -143.58 105.52 4.36 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 118.41 1.105 . . . . 0.0 109.758 -178.913 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 78.7 mtm -141.72 144.1 33.87 Favored 'General case' 0 C--N 1.333 -0.123 0 C-N-CA 124.085 0.954 . . . . 0.0 108.674 165.876 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 8.3 mt-30 44.68 74.38 0.13 Allowed 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 128.092 2.557 . . . . 0.0 112.672 179.193 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 27.1 tt0 -64.64 -12.41 45.68 Favored 'General case' 0 CA--C 1.55 0.955 0 O-C-N 121.565 -0.709 . . . . 0.0 112.819 179.131 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 18.9 m 48.67 81.89 0.05 OUTLIER 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 126.732 2.013 . . . . 0.0 112.8 162.733 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 32.3 p90 -122.29 115.08 21.71 Favored 'General case' 0 N--CA 1.45 -0.443 0 O-C-N 121.347 -0.846 . . . . 0.0 110.755 -157.363 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 89.5 p -152.49 -31.01 0.14 Allowed 'General case' 0 C--N 1.326 -0.43 0 C-N-CA 124.407 1.083 . . . . 0.0 111.302 174.474 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -66.0 -172.76 0.15 Allowed 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.767 1.627 . . . . 0.0 111.473 173.79 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 49.9 m-85 -95.0 161.11 29.38 Favored Pre-proline 0 CA--C 1.547 0.837 0 O-C-N 121.267 -0.895 . . . . 0.0 112.579 -170.532 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -69.08 -176.51 1.32 Allowed 'Trans proline' 0 CA--C 1.539 0.742 0 C-N-CA 124.672 3.582 . . . . 0.0 110.699 164.336 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 45.9 t -107.89 86.79 3.26 Favored Pre-proline 0 CA--C 1.541 0.625 0 C-N-CA 125.612 1.565 . . . . 0.0 109.351 -178.881 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 94.3 Cg_endo -67.76 154.81 72.17 Favored 'Trans proline' 0 C--N 1.348 0.523 0 C-N-CA 123.276 2.651 . . . . 0.0 111.772 175.513 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -127.13 129.17 47.41 Favored 'General case' 0 N--CA 1.433 -1.277 0 C-N-CA 126.003 1.721 . . . . 0.0 109.723 -175.254 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 11.8 p -60.03 -24.44 30.02 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 O-C-N 121.776 -0.577 . . . . 0.0 111.41 173.452 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -49.84 -53.73 23.74 Favored 'General case' 0 N--CA 1.438 -1.044 0 C-N-CA 125.818 1.647 . . . . 0.0 112.213 173.507 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 4.4 t -77.91 -4.22 45.71 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-O 117.897 -1.049 . . . . 0.0 112.716 -178.985 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 11.9 m-30 -64.6 156.51 29.75 Favored 'General case' 0 C--O 1.238 0.479 0 CA-C-N 121.412 1.915 . . . . 0.0 111.018 178.888 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 63.0 mt-30 -92.74 121.67 34.37 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 124.332 1.053 . . . . 0.0 108.219 169.148 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 33.8 t80 -63.28 158.67 19.64 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 118.653 0.661 . . . . 0.0 110.639 163.085 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -135.32 108.05 7.49 Favored 'General case' 0 CA--C 1.513 -0.465 0 C-N-CA 123.992 0.917 . . . . 0.0 109.375 160.158 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 1.9 pt-20 -61.34 -25.24 67.01 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 124.636 1.174 . . . . 0.0 112.675 177.912 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 1.4 t -62.73 -50.46 71.0 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 119.388 0.995 . . . . 0.0 109.587 -177.245 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 74.2 m -78.03 -47.76 17.69 Favored 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 124.651 1.18 . . . . 0.0 109.315 173.671 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 102.43 13.51 30.36 Favored Glycine 0 CA--C 1.53 1.027 0 C-N-CA 125.153 1.359 . . . . 0.0 111.004 -168.834 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 3.8 m-85 -111.53 178.28 4.38 Favored 'General case' 0 C--O 1.227 -0.129 0 C-N-CA 126.713 2.005 . . . . 0.0 109.347 -168.635 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 72.1 m-85 -117.13 156.28 27.89 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 108.521 -0.918 . . . . 0.0 108.521 170.889 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 42.3 t80 -114.33 134.95 54.6 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 127.213 2.205 . . . . 0.0 108.78 175.866 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 56.3 t0 -98.56 87.13 0.54 Allowed Pre-proline 0 C--O 1.237 0.404 0 C-N-CA 127.366 2.266 . . . . 0.0 110.381 -178.593 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 61.7 Cg_endo -62.28 -8.55 12.7 Favored 'Trans proline' 0 N--CA 1.457 -0.671 0 C-N-CA 122.085 1.857 . . . . 0.0 114.254 -178.565 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -74.14 -28.2 61.21 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 119.473 1.033 . . . . 0.0 110.703 178.907 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.593 HG21 ' CE2' ' A' ' 61' ' ' TYR . 0.1 OUTLIER -142.35 -22.78 0.68 Allowed 'General case' 0 C--O 1.238 0.48 0 C-N-CA 124.238 1.015 . . . . 0.0 113.317 -164.901 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 103.0 -3.41 48.32 Favored Glycine 0 N--CA 1.444 -0.784 0 C-N-CA 125.091 1.329 . . . . 0.0 112.841 169.593 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.512 HD21 ' HB ' ' A' ' 32' ' ' THR . 0.0 OUTLIER -74.86 173.86 10.02 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 118.807 1.304 . . . . 0.0 108.298 -178.721 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 37.2 m-85 -107.14 165.05 11.65 Favored 'General case' 0 C--N 1.321 -0.639 0 C-N-CA 124.389 1.075 . . . . 0.0 108.609 162.509 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 71.2 t80 -144.0 144.69 31.78 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 126.618 1.967 . . . . 0.0 108.092 -172.672 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -113.26 143.08 28.57 Favored Pre-proline 0 C--O 1.236 0.378 0 C-N-CA 124.952 1.301 . . . . 0.0 108.513 175.706 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 91.2 Cg_endo -77.64 -29.33 4.66 Favored 'Trans proline' 0 N--CA 1.456 -0.729 0 C-N-CA 121.917 1.744 . . . . 0.0 112.423 -178.519 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -73.97 -34.6 64.32 Favored 'General case' 0 C--O 1.234 0.279 0 C-N-CA 123.983 0.913 . . . . 0.0 110.734 174.488 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 1.1 m -131.64 93.5 3.34 Favored 'General case' 0 C--O 1.222 -0.381 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 -157.471 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 8.2 mp0 -64.88 6.68 0.21 Allowed 'General case' 0 CA--C 1.549 0.922 0 O-C-N 121.083 -1.011 . . . . 0.0 113.487 -178.013 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 24.3 m-85 -77.13 104.42 7.62 Favored 'General case' 0 C--O 1.235 0.333 0 O-C-N 120.626 -1.296 . . . . 0.0 108.668 166.893 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 29.0 m-85 -64.3 162.89 13.94 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 126.955 2.102 . . . . 0.0 110.784 179.727 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 64.2 t80 -120.25 110.25 16.36 Favored 'General case' 0 CA--C 1.521 -0.143 0 C-N-CA 125.934 1.694 . . . . 0.0 109.038 179.19 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 41.9 t30 -85.29 86.6 7.36 Favored 'General case' 0 C--N 1.32 -0.716 0 C-N-CA 125.082 1.353 . . . . 0.0 109.142 175.985 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -58.37 -15.55 11.07 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 125.401 1.48 . . . . 0.0 114.049 -176.356 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -54.63 -76.5 0.03 OUTLIER 'General case' 0 CA--C 1.528 0.111 0 C-N-CA 125.027 1.331 . . . . 0.0 108.923 170.475 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 10.3 m -94.59 13.69 23.35 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.243 0.617 . . . . 0.0 110.624 -174.342 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 49.4 mt-30 56.28 24.61 8.41 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 127.3 2.24 . . . . 0.0 112.802 -173.049 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -92.75 166.84 12.25 Favored 'General case' 0 CA--C 1.532 0.285 0 O-C-N 121.269 -0.894 . . . . 0.0 111.629 -167.103 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 4.8 m-85 -109.79 138.64 45.87 Favored 'General case' 0 N--CA 1.467 0.401 0 O-C-N 121.4 -0.812 . . . . 0.0 109.117 -179.996 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.42 HD23 ' HA ' ' A' ' 63' ' ' PRO . 32.8 mt -134.48 179.69 6.13 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 124.82 1.248 . . . . 0.0 110.294 -177.172 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 14.1 p90 -145.75 154.35 41.95 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 124.545 1.138 . . . . 0.0 109.113 161.019 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 53.7 t-105 -80.43 120.26 24.21 Favored 'General case' 0 C--O 1.24 0.558 0 N-CA-C 107.181 -1.415 . . . . 0.0 107.181 167.714 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 42.3 t0 -114.76 95.36 5.19 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 123.926 0.89 . . . . 0.0 108.975 174.552 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -66.67 -15.94 64.96 Favored Glycine 0 N--CA 1.444 -0.796 0 CA-C-O 117.492 -1.727 . . . . 0.0 112.564 174.244 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -64.54 -23.83 67.4 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 120.681 2.24 . . . . 0.0 109.551 171.324 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 4.5 mtt-85 -120.11 -2.3 10.22 Favored 'General case' 0 C--O 1.233 0.208 0 C-N-CA 126.062 1.745 . . . . 0.0 112.677 -177.537 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 81.3 mtp180 44.07 50.28 7.38 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 125.643 1.577 . . . . 0.0 110.607 -171.919 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 4.9 t -151.31 174.85 12.81 Favored 'General case' 0 N--CA 1.45 -0.437 0 O-C-N 121.691 -0.631 . . . . 0.0 110.49 179.399 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' TYR . . . . . 0.593 ' CE2' HG21 ' A' ' 32' ' ' THR . 97.4 m-85 -100.11 135.23 41.84 Favored 'General case' 0 C--O 1.238 0.467 0 N-CA-C 108.547 -0.909 . . . . 0.0 108.547 171.181 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -126.06 153.81 74.02 Favored Pre-proline 0 C--N 1.321 -0.645 0 C-N-CA 125.081 1.353 . . . . 0.0 107.431 -178.86 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.42 ' HA ' HD23 ' A' ' 52' ' ' LEU . 88.2 Cg_endo -84.43 131.28 4.76 Favored 'Trans proline' 0 N--CA 1.457 -0.672 0 C-N-CA 122.257 1.971 . . . . 0.0 109.99 -177.591 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -92.48 16.74 11.23 Favored 'General case' 0 N--CA 1.469 0.497 0 N-CA-C 115.87 1.804 . . . . 0.0 115.87 -167.08 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.454 ' H ' ' CD2' ' A' ' 65' ' ' LEU . 1.2 pt? -72.33 161.14 31.25 Favored 'General case' 0 C--O 1.238 0.488 0 N-CA-C 112.21 0.448 . . . . 0.0 112.21 175.766 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . 0.28 41.5 mt-10 68.04 -57.41 0.47 Allowed 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 129.714 3.206 . . . . 0.0 112.767 163.997 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? 65.59 -163.12 0.25 Allowed 'General case' 0 CA--C 1.545 0.761 0 N-CA-C 108.165 -1.05 . . . . 0.0 108.165 177.445 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 63.9 m 64.88 4.13 2.33 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 117.944 2.572 . . . . 0.0 117.944 162.97 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 54.01 44.6 29.09 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 126.576 1.951 . . . . 0.0 111.938 179.477 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 14.0 p30 -103.04 -32.53 9.66 Favored 'General case' 0 C--O 1.237 0.429 0 C-N-CA 127.604 2.361 . . . . 0.0 113.715 -171.585 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 79.74 -61.72 4.24 Favored Glycine 0 N--CA 1.443 -0.852 0 C-N-CA 126.06 1.79 . . . . 0.0 113.889 178.099 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 71.3 m-70 -154.03 34.55 0.43 Allowed 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 125.909 1.684 . . . . 0.0 109.112 -170.034 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 33.4 mtmm -140.96 122.68 15.26 Favored 'General case' 0 CA--C 1.52 -0.179 0 O-C-N 120.973 -1.08 . . . . 0.0 108.225 -165.564 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' GLU . . . . . 0.641 ' HG2' ' HB2' ' A' ' 77' ' ' ALA . 4.7 tp10 75.55 -39.82 0.4 Allowed 'General case' 0 CA--C 1.486 -1.502 0 C-N-CA 130.428 3.491 . . . . 0.0 113.108 -177.642 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 65.71 -1.33 1.07 Allowed 'General case' 0 N--CA 1.428 -1.547 0 O-C-N 124.6 1.187 . . . . 0.0 112.775 -176.54 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 161.72 78.86 0.03 OUTLIER Glycine 0 N--CA 1.445 -0.717 0 C-N-CA 120.344 -0.931 . . . . 0.0 112.89 -164.375 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' ALA . . . . . 0.641 ' HB2' ' HG2' ' A' ' 74' ' ' GLU . . . -109.43 161.66 23.14 Favored Pre-proline 0 CA--C 1.537 0.444 0 CA-C-N 117.977 0.888 . . . . 0.0 109.6 157.659 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_endo -62.2 111.43 1.26 Allowed 'Trans proline' 0 N--CA 1.455 -0.741 0 C-N-CA 123.363 2.708 . . . . 0.0 110.281 172.892 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 36.1 t -156.5 124.17 5.49 Favored 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 127.642 2.377 . . . . 0.0 104.675 168.621 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -153.02 43.08 0.62 Allowed 'General case' 0 C--O 1.231 0.127 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 171.437 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 50.6 tt0 49.07 94.88 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 128.524 2.73 . . . . 0.0 111.978 -174.189 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 98.38 36.53 4.59 Favored Glycine 0 CA--C 1.528 0.883 0 O-C-N 120.86 -1.15 . . . . 0.0 112.648 -171.173 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 176.51 50.35 0.0 OUTLIER 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 129.8 3.24 . . . . 0.0 108.309 173.941 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 1.6 pt-20 -126.71 -179.89 5.02 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.305 1.042 . . . . 0.0 111.395 178.892 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 27.2 mmmt -73.51 34.1 0.08 Allowed 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 126.337 1.855 . . . . 0.0 112.999 169.945 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 4.4 ptpt 47.38 27.5 0.92 Allowed 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 128.316 2.646 . . . . 0.0 115.102 -178.008 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 17.7 tt0 -91.9 37.28 0.97 Allowed 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 126.605 1.962 . . . . 0.0 113.169 -158.14 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 5.6 ptmt -111.57 8.64 21.02 Favored 'General case' 0 N--CA 1.47 0.551 0 O-C-N 120.192 -1.567 . . . . 0.0 113.511 -174.61 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 66.8 m80 -91.73 88.16 6.58 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 119.381 0.991 . . . . 0.0 110.587 -168.364 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 62.0 pttt -157.14 148.1 21.7 Favored 'General case' 0 C--O 1.232 0.145 0 C-N-CA 123.581 0.752 . . . . 0.0 110.445 167.664 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -152.35 -169.48 3.36 Favored 'General case' 0 C--O 1.238 0.498 0 C-N-CA 125.634 1.573 . . . . 0.0 107.584 179.022 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 11.1 tmtt? . . . . . 0 C--O 1.242 0.658 0 N-CA-C 105.11 -2.182 . . . . 0.0 105.11 165.951 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.609 0 N-CA-C 109.536 -1.426 . . . . 0.0 109.536 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 25.7 m-70 44.66 45.74 8.15 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 126.702 2.001 . . . . 0.0 112.722 177.748 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 39.5 mtm -94.49 -170.74 2.32 Favored 'General case' 0 CA--C 1.536 0.438 0 N-CA-C 107.773 -1.195 . . . . 0.0 107.773 166.211 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 87.7 mm-40 -80.2 111.78 16.9 Favored 'General case' 0 C--N 1.331 -0.235 0 O-C-N 120.985 -1.072 . . . . 0.0 108.451 166.104 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -115.32 -26.44 7.6 Favored 'General case' 0 N--CA 1.469 0.486 0 N-CA-C 114.1 1.148 . . . . 0.0 114.1 179.231 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 75.5 m 49.01 76.65 0.12 Allowed 'General case' 0 CA--C 1.541 0.597 0 CA-C-N 119.574 1.079 . . . . 0.0 111.511 -167.673 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -135.43 166.88 22.15 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 126.098 1.759 . . . . 0.0 108.017 173.922 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 13.7 m 58.13 60.24 2.76 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 125.377 1.471 . . . . 0.0 112.091 -178.876 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 1.1 mm100 -67.2 -24.73 65.88 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 126.385 1.874 . . . . 0.0 114.455 178.55 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 27.6 m-85 -133.3 164.84 41.14 Favored Pre-proline 0 CA--C 1.54 0.586 0 C-N-CA 126.027 1.731 . . . . 0.0 110.163 -179.166 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -72.19 -173.12 1.01 Allowed 'Trans proline' 0 CA--C 1.534 0.482 0 C-N-CA 124.4 3.4 . . . . 0.0 110.415 166.82 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 61.1 t -113.56 85.66 9.38 Favored Pre-proline 0 CA--C 1.539 0.55 0 N-CA-C 106.204 -1.776 . . . . 0.0 106.204 172.739 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 69.7 Cg_endo -72.86 161.85 42.62 Favored 'Trans proline' 0 CA--C 1.539 0.751 0 C-N-CA 122.399 2.066 . . . . 0.0 110.572 -177.816 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -136.13 137.14 40.69 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 123.773 0.829 . . . . 0.0 110.627 -175.161 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.457 ' HA ' ' CD2' ' A' ' 18' ' ' TYR . 11.9 p -61.2 -22.01 26.21 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.664 0 N-CA-C 112.992 0.738 . . . . 0.0 112.992 179.479 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 3.0 t -68.98 8.35 0.55 Allowed 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 125.145 1.378 . . . . 0.0 112.586 171.748 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.3 t -126.3 4.85 7.02 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 120.598 1.545 . . . . 0.0 111.358 169.174 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.457 ' CD2' ' HA ' ' A' ' 15' ' ' VAL . 16.0 m-30 -82.78 150.49 26.61 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 118.921 0.782 . . . . 0.0 109.719 179.768 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 37.2 mt-30 -95.42 103.92 15.8 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 127.17 2.188 . . . . 0.0 111.035 177.477 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 88.0 t80 -58.12 151.48 18.85 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 120.271 1.396 . . . . 0.0 110.376 -179.991 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -129.61 93.58 3.57 Favored 'General case' 0 CA--C 1.516 -0.354 0 N-CA-C 106.091 -1.818 . . . . 0.0 106.091 177.345 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 1.9 pt-20 -51.99 -33.09 36.52 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-O 118.528 -0.748 . . . . 0.0 112.291 176.487 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 1.3 t -68.82 -5.68 22.32 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 123.297 0.639 . . . . 0.0 111.645 -174.408 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 50.7 m -137.1 -12.91 1.64 Allowed 'General case' 0 CA--C 1.53 0.204 0 O-C-N 120.185 -1.572 . . . . 0.0 112.463 167.874 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 88.39 18.77 54.59 Favored Glycine 0 C--N 1.338 0.64 0 CA-C-N 118.983 0.81 . . . . 0.0 112.124 169.936 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 7.1 m-85 -125.04 175.16 7.53 Favored 'General case' 0 C--N 1.332 -0.195 0 C-N-CA 126.88 2.072 . . . . 0.0 108.122 -171.725 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 58.8 m-85 -99.26 135.35 40.8 Favored 'General case' 0 N--CA 1.448 -0.529 0 N-CA-C 106.892 -1.522 . . . . 0.0 106.892 176.114 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 25.3 t80 -99.41 141.24 32.46 Favored 'General case' 0 C--O 1.238 0.472 0 N-CA-C 107.047 -1.464 . . . . 0.0 107.047 168.026 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 29.5 m-20 -118.45 76.44 12.96 Favored Pre-proline 0 CA--C 1.535 0.389 0 N-CA-C 108.935 -0.765 . . . . 0.0 108.935 -159.088 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -65.05 -10.64 26.36 Favored 'Trans proline' 0 CA--C 1.534 0.486 0 C-N-CA 124.326 3.35 . . . . 0.0 114.722 -167.644 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 33.7 tt0 -76.58 -25.73 54.29 Favored 'General case' 0 CA--C 1.537 0.474 0 O-C-N 121.504 -0.747 . . . . 0.0 110.979 175.985 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.599 ' HB ' HD23 ' A' ' 34' ' ' LEU . 0.8 OUTLIER -136.34 -26.32 1.13 Allowed 'General case' 0 C--O 1.234 0.278 0 C-N-CA 124.215 1.006 . . . . 0.0 112.495 -165.642 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 108.12 -3.77 33.5 Favored Glycine 0 CA--C 1.527 0.811 0 C-N-CA 124.069 0.843 . . . . 0.0 115.074 169.924 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.599 HD23 ' HB ' ' A' ' 32' ' ' THR . 0.9 OUTLIER -84.36 -177.11 6.54 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 126.591 1.957 . . . . 0.0 109.975 -172.739 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 25.0 m-85 -115.95 139.04 50.63 Favored 'General case' 0 C--O 1.238 0.459 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 155.569 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 62.4 t80 -104.25 154.43 19.79 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 125.426 1.49 . . . . 0.0 108.246 178.911 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 37.0 t70 -127.4 143.57 47.76 Favored Pre-proline 0 N--CA 1.467 0.388 0 N-CA-C 112.157 0.428 . . . . 0.0 112.157 167.184 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -67.61 -31.01 34.16 Favored 'Trans proline' 0 N--CA 1.455 -0.771 0 C-N-CA 122.953 2.435 . . . . 0.0 114.205 -179.555 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 4.2 m-80 -87.19 -17.57 32.36 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 119.58 1.082 . . . . 0.0 111.626 172.692 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -138.85 81.57 1.85 Allowed 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 -162.52 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -60.5 5.91 0.04 OUTLIER 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.146 1.378 . . . . 0.0 113.709 177.171 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 24.3 m-85 -75.64 93.56 3.08 Favored 'General case' 0 N--CA 1.444 -0.74 0 C-N-CA 125.302 1.441 . . . . 0.0 107.766 171.598 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 43.8 m-85 -58.54 123.97 18.07 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 124.378 1.071 . . . . 0.0 108.675 -179.74 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 8.0 t80 -86.22 108.22 18.27 Favored 'General case' 0 N--CA 1.447 -0.609 0 C-N-CA 125.243 1.417 . . . . 0.0 107.219 -176.65 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 33.6 t30 -82.62 79.42 9.04 Favored 'General case' 0 N--CA 1.446 -0.655 0 N-CA-C 107.997 -1.112 . . . . 0.0 107.997 171.326 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -53.28 -33.12 51.92 Favored 'General case' 0 C--N 1.341 0.213 0 C-N-CA 123.553 0.741 . . . . 0.0 112.129 -178.783 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -44.3 -62.23 1.24 Allowed 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 128.261 2.625 . . . . 0.0 109.904 177.379 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.1 t -106.97 11.22 30.05 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.634 1.173 . . . . 0.0 110.578 -175.233 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 34.0 mt-30 46.98 40.81 9.98 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 127.011 2.125 . . . . 0.0 110.67 -176.433 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 17.4 mm-40 -103.95 159.73 15.41 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 126.238 1.815 . . . . 0.0 109.017 174.66 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -112.09 129.42 56.23 Favored 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 106.679 -1.6 . . . . 0.0 106.679 170.987 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.445 HD12 HD11 ' A' ' 34' ' ' LEU . 50.8 mt -118.4 177.51 4.79 Favored 'General case' 0 N--CA 1.442 -0.875 0 C-N-CA 126.124 1.769 . . . . 0.0 107.352 -179.748 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 14.0 p90 -141.71 154.2 45.15 Favored 'General case' 0 N--CA 1.441 -0.889 0 N-CA-C 106.786 -1.561 . . . . 0.0 106.786 158.751 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 20.3 t-105 -76.22 136.78 39.71 Favored 'General case' 0 N--CA 1.445 -0.687 0 N-CA-C 106.195 -1.78 . . . . 0.0 106.195 169.453 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 6.6 t0 -131.92 99.43 4.75 Favored 'General case' 0 CA--C 1.507 -0.695 0 CA-C-O 122.442 1.115 . . . . 0.0 109.719 175.102 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -65.89 -8.26 40.6 Favored Glycine 0 N--CA 1.442 -0.913 0 CA-C-O 117.256 -1.858 . . . . 0.0 113.221 -174.449 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.464 ' HG3' ' H ' ' A' ' 58' ' ' ARG . 1.8 pt-20 -72.67 -64.82 0.88 Allowed 'General case' 0 C--N 1.338 0.108 0 CA-C-N 120.363 2.082 . . . . 0.0 107.47 177.342 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 58' ' ' ARG . . . . . 0.464 ' H ' ' HG3' ' A' ' 57' ' ' GLU . 82.3 mtt180 -74.85 -7.12 52.5 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 125.181 1.392 . . . . 0.0 111.817 179.059 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 90.5 mtt180 44.79 56.25 5.39 Favored 'General case' 0 C--O 1.231 0.128 0 C-N-CA 126.51 1.924 . . . . 0.0 110.55 -172.595 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 7.4 t -146.62 164.0 34.05 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 109.217 -0.66 . . . . 0.0 109.217 167.781 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 27.4 m-85 -81.66 135.93 35.52 Favored 'General case' 0 C--O 1.237 0.426 0 N-CA-C 107.216 -1.402 . . . . 0.0 107.216 166.877 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -126.01 154.77 73.93 Favored Pre-proline 0 C--N 1.323 -0.587 0 C-N-CA 125.806 1.642 . . . . 0.0 108.863 176.585 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -67.98 135.67 35.75 Favored 'Trans proline' 0 N--CA 1.451 -1.012 0 C-N-CA 121.949 1.766 . . . . 0.0 109.715 171.791 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -97.57 23.14 8.05 Favored 'General case' 0 N--CA 1.463 0.187 0 C-N-CA 124.154 0.982 . . . . 0.0 112.698 -178.316 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -54.02 -9.04 0.22 Allowed 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 127.164 2.186 . . . . 0.0 116.403 -174.602 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -145.77 -77.74 0.19 Allowed 'General case' 0 N--CA 1.441 -0.906 0 N-CA-C 104.865 -2.272 . . . . 0.0 104.865 -174.892 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 5.3 tm0? 56.95 12.65 1.25 Allowed 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 125.658 1.583 . . . . 0.0 113.381 178.439 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 22.0 m -153.89 99.87 2.31 Favored 'General case' 0 C--O 1.239 0.522 0 O-C-N 119.939 -1.726 . . . . 0.0 106.936 172.092 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -87.83 71.92 9.46 Favored 'General case' 0 N--CA 1.464 0.241 0 N-CA-C 108.498 -0.927 . . . . 0.0 108.498 179.96 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 75.7 m-20 -123.49 18.8 9.67 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 125.478 1.511 . . . . 0.0 109.706 -175.935 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -117.28 -17.67 5.66 Favored Glycine 0 CA--C 1.528 0.866 0 CA-C-O 117.192 -1.893 . . . . 0.0 114.759 -164.826 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 63.1 m80 48.83 40.01 15.41 Favored 'General case' 0 CA--C 1.545 0.773 0 CA-C-N 119.682 1.741 . . . . 0.0 114.58 175.053 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 37.0 mttt -143.18 -166.74 2.38 Favored 'General case' 0 N--CA 1.472 0.63 0 O-C-N 120.724 -1.235 . . . . 0.0 109.424 -178.297 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 14.9 mm-40 -70.64 164.99 23.82 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 123.68 0.792 . . . . 0.0 110.368 164.94 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -49.08 -44.87 42.41 Favored 'General case' 0 N--CA 1.451 -0.425 0 C-N-CA 126.371 1.868 . . . . 0.0 109.891 168.509 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -138.35 -107.08 0.76 Allowed Glycine 0 N--CA 1.446 -0.642 0 N-CA-C 109.438 -1.465 . . . . 0.0 109.438 179.029 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . 55.34 159.98 0.06 OUTLIER Pre-proline 0 CA--C 1.548 0.873 0 C-N-CA 127.131 2.172 . . . . 0.0 112.907 -167.197 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 64.8 Cg_endo -69.43 173.6 10.44 Favored 'Trans proline' 0 CA--C 1.54 0.818 0 C-N-CA 122.705 2.27 . . . . 0.0 111.164 169.285 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 52.9 p -161.19 -177.82 6.31 Favored 'General case' 0 CA--C 1.535 0.375 0 O-C-N 121.07 -1.019 . . . . 0.0 112.626 174.398 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 56.1 mttt 58.15 18.41 5.27 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 127.251 2.22 . . . . 0.0 113.925 161.677 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -145.32 21.62 1.53 Allowed 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.087 1.755 . . . . 0.0 109.543 -167.809 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 74.67 20.2 79.61 Favored Glycine 0 CA--C 1.534 1.248 0 O-C-N 120.451 -1.405 . . . . 0.0 111.321 -168.116 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 29.9 mmtp -122.51 -9.42 8.49 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 126.932 2.093 . . . . 0.0 110.971 -168.237 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -77.21 174.81 10.31 Favored 'General case' 0 N--CA 1.446 -0.63 0 C-N-CA 124.849 1.26 . . . . 0.0 109.859 -178.207 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 6.6 ptmt -65.4 30.12 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 125.564 1.546 . . . . 0.0 114.609 171.666 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 27.3 pttt 44.95 42.9 6.71 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 125.534 1.534 . . . . 0.0 111.686 -171.55 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 70.5 tt0 -69.73 -40.84 75.97 Favored 'General case' 0 C--O 1.235 0.305 0 O-C-N 121.378 -0.826 . . . . 0.0 109.1 176.763 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 1.4 ptpm? -139.83 176.54 8.66 Favored 'General case' 0 CA--C 1.528 0.122 0 C-N-CA 124.695 1.198 . . . . 0.0 110.09 176.099 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 22.1 t-80 -127.15 114.89 18.3 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 104.962 -2.236 . . . . 0.0 104.962 170.62 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 77.6 tttt -154.15 53.17 0.69 Allowed 'General case' 0 N--CA 1.462 0.168 0 N-CA-C 108.132 -1.062 . . . . 0.0 108.132 -178.727 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 2.2 p -147.8 91.15 1.91 Allowed 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 106.496 -1.668 . . . . 0.0 106.496 -166.647 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 2.5 tmtt? . . . . . 0 C--O 1.252 1.212 0 N-CA-C 102.803 -3.036 . . . . 0.0 102.803 166.842 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.462 0.374 0 N-CA-C 110.96 -0.856 . . . . 0.0 110.96 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 54.6 m-70 63.01 70.17 0.56 Allowed 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 127.631 2.372 . . . . 0.0 109.813 -167.272 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 53.2 mtt -132.1 156.72 45.84 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 124.973 1.309 . . . . 0.0 107.579 166.943 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 7.7 tp-100 -166.56 124.7 1.4 Allowed 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 104.415 -2.439 . . . . 0.0 104.415 172.24 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -150.67 -86.28 0.08 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 118.816 0.735 . . . . 0.0 109.117 -176.162 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 72.3 m -161.56 12.97 0.09 Allowed 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 125.02 1.328 . . . . 0.0 113.004 178.07 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 34.4 t80 -96.45 106.51 18.76 Favored 'General case' 0 C--O 1.234 0.255 0 C-N-CA 124.303 1.041 . . . . 0.0 108.51 -173.818 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 26.7 t -161.09 79.21 0.6 Allowed 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 115.134 -0.939 . . . . 0.0 109.25 -172.094 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 18.5 pm0 -70.78 -12.51 61.59 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 125.026 1.33 . . . . 0.0 113.662 178.661 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 51.7 m-85 -125.62 163.1 40.91 Favored Pre-proline 0 C--O 1.239 0.514 0 C-N-CA 124.131 0.972 . . . . 0.0 109.43 162.156 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -70.62 -175.12 1.25 Allowed 'Trans proline' 0 CA--C 1.537 0.646 0 C-N-CA 124.489 3.459 . . . . 0.0 111.239 167.277 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 38.8 t -104.97 88.12 2.21 Favored Pre-proline 0 CA--C 1.543 0.709 0 C-N-CA 125.991 1.717 . . . . 0.0 109.478 -178.744 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 19.8 Cg_endo -70.55 173.66 11.35 Favored 'Trans proline' 0 CA--C 1.546 1.079 0 C-N-CA 123.087 2.525 . . . . 0.0 110.856 173.549 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -156.62 133.61 10.4 Favored 'General case' 0 N--CA 1.468 0.439 0 O-C-N 121.272 -0.893 . . . . 0.0 110.053 171.932 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.439 ' HA ' ' CD2' ' A' ' 18' ' ' TYR . 12.5 p -54.24 -25.14 12.97 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.42 0 N-CA-C 113.604 0.964 . . . . 0.0 113.604 177.928 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 14.0 m -62.02 -14.07 32.08 Favored 'General case' 0 C--O 1.237 0.406 0 O-C-N 120.943 -1.098 . . . . 0.0 112.96 179.987 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 5.5 t -120.55 9.94 10.98 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 124.012 0.925 . . . . 0.0 111.85 176.187 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.439 ' CD2' ' HA ' ' A' ' 15' ' ' VAL . 17.0 m-30 -73.4 152.6 40.76 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-N 119.708 1.14 . . . . 0.0 109.719 168.858 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 51.6 mt-30 -87.38 115.58 24.9 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 108.529 -0.915 . . . . 0.0 108.529 174.236 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 85.4 t80 -66.32 147.89 52.65 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 118.224 0.465 . . . . 0.0 110.233 168.693 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -119.13 112.58 19.7 Favored 'General case' 0 N--CA 1.442 -0.871 0 C-N-CA 127.681 2.393 . . . . 0.0 106.517 177.829 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -81.6 -15.85 53.39 Favored 'General case' 0 CA--C 1.533 0.314 0 O-C-N 121.396 -0.815 . . . . 0.0 113.087 178.178 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 5.2 t -67.09 -31.77 72.49 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.533 1.133 . . . . 0.0 111.335 179.619 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 69.2 m -128.26 -26.16 2.86 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 119.883 1.22 . . . . 0.0 112.889 171.386 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 104.24 25.3 7.12 Favored Glycine 0 CA--C 1.527 0.806 0 CA-C-O 117.889 -1.506 . . . . 0.0 113.674 172.651 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 2.7 m-85 -110.91 -179.58 3.78 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 120.206 2.003 . . . . 0.0 108.821 -179.84 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 68.2 m-85 -120.88 123.35 42.33 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 124.636 1.174 . . . . 0.0 108.239 178.055 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 23.5 t80 -91.14 134.77 34.26 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 125.571 1.548 . . . . 0.0 110.76 -179.642 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 12.6 t0 -101.11 88.06 0.99 Allowed Pre-proline 0 CA--C 1.533 0.319 0 C-N-CA 128.034 2.534 . . . . 0.0 112.429 178.543 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -64.81 -6.84 13.33 Favored 'Trans proline' 0 CA--C 1.533 0.47 0 C-N-CA 121.656 1.571 . . . . 0.0 115.332 172.002 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 3.3 tm0? -64.92 -52.03 58.66 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 119.852 1.206 . . . . 0.0 108.297 176.032 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 77.7 p -99.97 -51.96 3.56 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-N 118.295 0.498 . . . . 0.0 111.081 174.461 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 125.98 5.82 6.13 Favored Glycine 0 CA--C 1.535 1.341 0 C-N-CA 126.818 2.151 . . . . 0.0 112.135 -166.257 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 84.5 mt -74.21 174.36 8.86 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 119.126 1.463 . . . . 0.0 110.935 176.476 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 27.0 m-85 -120.38 169.77 9.99 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 125.902 1.681 . . . . 0.0 108.294 161.604 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 28.3 t80 -145.52 153.57 41.26 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 128.913 2.885 . . . . 0.0 107.67 -174.935 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 8.9 t0 -121.32 142.51 35.42 Favored Pre-proline 0 CA--C 1.532 0.267 0 C-N-CA 124.968 1.307 . . . . 0.0 107.89 179.419 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -74.74 -32.95 5.37 Favored 'Trans proline' 0 N--CA 1.453 -0.887 0 C-N-CA 121.635 1.557 . . . . 0.0 115.279 -174.101 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -73.32 -35.6 66.08 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 120.508 1.503 . . . . 0.0 108.45 172.072 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 69.4 m -126.43 93.52 3.82 Favored 'General case' 0 N--CA 1.449 -0.494 0 C-N-CA 123.493 0.717 . . . . 0.0 110.246 -157.349 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 25.6 mp0 -55.72 -0.92 0.04 OUTLIER 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 127.34 2.256 . . . . 0.0 114.597 179.531 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 49.3 m-85 -70.9 106.19 3.53 Favored 'General case' 0 N--CA 1.442 -0.839 0 C-N-CA 125.595 1.558 . . . . 0.0 108.194 170.351 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 40.7 m-85 -65.75 153.82 40.72 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 125.613 1.565 . . . . 0.0 109.972 179.01 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 74.9 t80 -108.58 133.95 52.01 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 125.668 1.587 . . . . 0.0 107.983 175.41 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 43.1 t30 -110.8 73.9 0.85 Allowed 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 128.944 2.898 . . . . 0.0 109.619 -173.305 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -49.53 -26.4 3.44 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 125.651 1.58 . . . . 0.0 114.036 -172.014 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 3.1 tt0 -53.95 -31.18 49.62 Favored 'General case' 0 N--CA 1.446 -0.656 0 C-N-CA 128.989 2.915 . . . . 0.0 113.315 174.858 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 4.1 m -143.9 9.6 1.52 Allowed 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 124.894 1.277 . . . . 0.0 111.479 -168.537 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 52.0 mt-30 47.39 30.43 1.57 Allowed 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 126.415 1.886 . . . . 0.0 113.623 -173.907 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -104.22 161.48 14.0 Favored 'General case' 0 C--O 1.233 0.213 0 C-N-CA 125.083 1.353 . . . . 0.0 112.653 -175.995 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -103.26 134.86 45.95 Favored 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 124.7 1.2 . . . . 0.0 110.783 178.336 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 53.8 mt -133.34 179.8 5.98 Favored 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 125.943 1.697 . . . . 0.0 109.193 -177.091 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 14.1 p90 -148.52 155.21 40.85 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 125.103 1.361 . . . . 0.0 108.684 164.518 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 68.9 t-105 -77.42 119.29 20.83 Favored 'General case' 0 C--O 1.233 0.232 0 N-CA-C 107.333 -1.358 . . . . 0.0 107.333 167.878 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 39.7 t0 -98.68 94.44 6.64 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 107.88 -1.155 . . . . 0.0 107.88 167.505 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -62.7 -14.98 53.27 Favored Glycine 0 CA--C 1.531 1.091 0 CA-C-O 119.081 -0.844 . . . . 0.0 113.394 178.13 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -74.6 -17.29 60.74 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 119.228 1.514 . . . . 0.0 110.667 174.941 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 83.9 mtt85 -123.34 -4.49 8.35 Favored 'General case' 0 C--O 1.223 -0.299 0 C-N-CA 125.342 1.457 . . . . 0.0 111.799 178.711 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 97.2 mtt180 44.34 59.36 3.31 Favored 'General case' 0 C--O 1.233 0.209 0 C-N-CA 125.389 1.476 . . . . 0.0 110.335 -173.096 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 5.8 t -152.95 173.67 15.1 Favored 'General case' 0 N--CA 1.448 -0.551 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 177.681 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 82.2 m-85 -104.96 134.34 48.23 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 107.624 -1.25 . . . . 0.0 107.624 173.185 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -126.12 154.6 74.21 Favored Pre-proline 0 C--N 1.324 -0.527 0 C-N-CA 125.327 1.451 . . . . 0.0 109.492 -178.223 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -74.16 125.68 9.95 Favored 'Trans proline' 0 N--CA 1.458 -0.581 0 C-N-CA 123.413 2.742 . . . . 0.0 111.08 -178.916 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -85.43 14.61 5.26 Favored 'General case' 0 N--CA 1.463 0.187 0 N-CA-C 114.607 1.336 . . . . 0.0 114.607 -173.25 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -61.37 -33.91 74.44 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 125.068 1.347 . . . . 0.0 112.037 -167.514 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 31.0 mt-10 -101.58 -30.16 11.54 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-O 118.548 -0.739 . . . . 0.0 112.43 175.16 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . 0.269 1.7 pt20 44.02 30.22 0.4 Allowed 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 126.701 2.0 . . . . 0.0 115.173 -179.085 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 1.5 t 63.0 136.94 0.02 OUTLIER 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 127.465 2.306 . . . . 0.0 112.155 -176.753 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 54.54 -167.34 0.08 Allowed 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 124.943 1.297 . . . . 0.0 110.979 -165.902 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 15.9 t0 -147.28 169.07 20.18 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 107.471 -1.307 . . . . 0.0 107.471 -175.698 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 73.91 -68.74 1.6 Allowed Glycine 0 C--O 1.22 -0.764 0 C-N-CA 124.562 1.077 . . . . 0.0 111.869 179.021 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 2.3 m80 -65.06 -5.01 5.41 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 125.017 1.327 . . . . 0.0 113.936 179.702 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 34.2 pttt -58.22 123.1 14.88 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 107.181 -1.415 . . . . 0.0 107.181 164.469 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 87.3 mt-10 -72.06 -47.34 52.29 Favored 'General case' 0 CA--C 1.511 -0.542 0 N-CA-C 107.522 -1.288 . . . . 0.0 107.522 173.563 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER 57.53 -24.59 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 127.541 2.337 . . . . 0.0 114.306 -169.883 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 173.83 67.46 0.05 OUTLIER Glycine 0 CA--C 1.524 0.642 0 N-CA-C 106.64 -2.584 . . . . 0.0 106.64 -160.724 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -160.2 155.3 21.29 Favored Pre-proline 0 CA--C 1.538 0.51 0 C-N-CA 127.335 2.254 . . . . 0.0 107.27 170.604 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 12.2 Cg_endo -65.87 134.43 37.42 Favored 'Trans proline' 0 C--O 1.237 0.445 0 C-N-CA 122.509 2.14 . . . . 0.0 110.673 171.446 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 14.6 m -78.23 74.13 4.77 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 125.125 1.37 . . . . 0.0 110.888 179.242 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -143.77 -13.48 0.65 Allowed 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 125.447 1.499 . . . . 0.0 112.187 177.441 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 6.6 pt-20 -76.63 17.53 0.39 Allowed 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 125.731 1.612 . . . . 0.0 113.427 -171.609 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 76.67 4.97 82.63 Favored Glycine 0 CA--C 1.534 1.247 0 CA-C-O 122.328 0.96 . . . . 0.0 112.833 -178.039 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 92.7 mttt -110.46 9.34 23.31 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 125.015 1.326 . . . . 0.0 109.256 170.401 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -46.01 -51.98 12.62 Favored 'General case' 0 CA--C 1.517 -0.301 0 C-N-CA 129.214 3.005 . . . . 0.0 110.574 -166.932 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -141.7 41.29 1.71 Allowed 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 125.496 1.519 . . . . 0.0 108.331 179.103 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 19.6 mttt 45.33 73.39 0.16 Allowed 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 126.975 2.11 . . . . 0.0 113.257 167.31 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -62.63 5.88 0.11 Allowed 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 127.626 2.371 . . . . 0.0 115.516 176.647 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 24.6 mttt 56.86 88.15 0.05 Allowed 'General case' 0 N--CA 1.467 0.381 0 C-N-CA 126.363 1.865 . . . . 0.0 109.77 -171.133 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 35.2 t-80 -61.92 -31.21 71.51 Favored 'General case' 0 CA--C 1.535 0.372 0 O-C-N 121.792 -0.567 . . . . 0.0 111.478 178.713 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 43.7 pttt -136.35 162.56 32.68 Favored 'General case' 0 C--O 1.238 0.457 0 C-N-CA 124.721 1.209 . . . . 0.0 109.884 176.103 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 1.7 p -96.37 179.69 4.94 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 125.886 1.675 . . . . 0.0 110.377 172.569 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 6.4 ttpm? . . . . . 0 C--O 1.246 0.883 0 N-CA-C 105.507 -2.034 . . . . 0.0 105.507 157.213 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.564 0 N-CA-C 108.639 -1.784 . . . . 0.0 108.639 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 6.2 m170 56.73 -164.36 0.16 Allowed 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 124.333 1.053 . . . . 0.0 110.32 -174.509 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 2.5 mpt? -124.9 -65.42 1.03 Allowed 'General case' 0 N--CA 1.453 -0.317 0 N-CA-C 108.181 -1.044 . . . . 0.0 108.181 178.689 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 10.9 pt20 -150.05 137.4 19.73 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 124.203 1.001 . . . . 0.0 109.491 -172.709 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -65.01 -38.97 92.7 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 174.837 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 37.5 m 52.75 37.49 23.95 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 124.233 1.013 . . . . 0.0 111.189 -162.03 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER 58.16 -60.36 0.03 OUTLIER 'General case' 0 C--N 1.342 0.262 1 C-N-CA 133.984 4.914 . . . . 0.0 113.583 170.432 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 7.2 t 60.49 -0.11 0.29 Allowed 'General case' 0 N--CA 1.445 -0.724 0 C-N-CA 128.919 2.888 . . . . 0.0 114.232 177.861 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 15.7 mm100 -140.54 -169.8 2.86 Favored 'General case' 0 N--CA 1.445 -0.689 0 C-N-CA 126.72 2.008 . . . . 0.0 111.539 -163.058 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 82.0 m-85 -67.48 163.35 48.27 Favored Pre-proline 0 CA--C 1.543 0.706 0 C-N-CA 126.04 1.736 . . . . 0.0 110.865 178.39 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_endo -72.71 -167.44 0.34 Allowed 'Trans proline' 0 CA--C 1.536 0.578 0 C-N-CA 123.991 3.128 . . . . 0.0 109.891 166.255 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 43.2 t -106.99 86.5 2.43 Favored Pre-proline 0 CA--C 1.541 0.634 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 174.016 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 91.8 Cg_endo -65.08 164.6 24.51 Favored 'Trans proline' 0 CA--C 1.536 0.604 0 C-N-CA 123.577 2.852 . . . . 0.0 110.252 178.205 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -152.94 142.97 22.28 Favored 'General case' 0 N--CA 1.475 0.776 0 O-C-N 120.608 -1.307 . . . . 0.0 113.236 -179.64 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 14.4 p -60.13 -19.82 18.75 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.287 0 C-N-CA 124.906 1.282 . . . . 0.0 112.885 171.494 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.4 t -57.59 -5.59 0.38 Allowed 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 124.632 1.173 . . . . 0.0 113.079 170.267 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.4 t -137.11 12.67 3.07 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-N 119.617 1.099 . . . . 0.0 113.74 176.468 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 16.4 m-30 -72.42 164.18 26.78 Favored 'General case' 0 C--O 1.236 0.363 0 O-C-N 120.476 -1.39 . . . . 0.0 111.295 175.028 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 19.2 mt-30 -108.08 129.22 55.16 Favored 'General case' 0 CA--C 1.519 -0.217 0 C-N-CA 125.179 1.392 . . . . 0.0 108.794 169.726 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 49.8 t80 -77.94 150.71 33.97 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 118.357 0.526 . . . . 0.0 110.073 170.017 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -128.58 88.08 2.68 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 107.504 -1.295 . . . . 0.0 107.504 173.846 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.7 pt-20 -52.77 -19.89 2.8 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 127.831 2.452 . . . . 0.0 113.589 175.057 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 6.7 t -51.33 -36.72 44.15 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 124.137 0.975 . . . . 0.0 111.413 168.344 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 54.3 m -138.61 -8.07 1.46 Allowed 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 124.7 1.2 . . . . 0.0 113.834 -178.05 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 88.47 19.96 50.2 Favored Glycine 0 CA--C 1.528 0.859 0 O-C-N 120.198 -1.564 . . . . 0.0 113.723 167.798 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 32.7 m-85 -110.37 174.88 5.65 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 125.673 1.589 . . . . 0.0 109.381 -179.025 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 83.8 m-85 -120.56 151.45 39.4 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 124.675 1.19 . . . . 0.0 109.098 177.117 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 55.3 t80 -125.6 137.08 53.88 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 125.412 1.485 . . . . 0.0 110.715 -175.511 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -97.75 88.74 0.65 Allowed Pre-proline 0 N--CA 1.463 0.182 0 C-N-CA 128.088 2.555 . . . . 0.0 112.418 -179.817 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo -58.09 -10.51 8.2 Favored 'Trans proline' 0 CA--C 1.536 0.614 0 CA-C-N 121.19 1.461 . . . . 0.0 115.012 175.265 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -66.81 -41.55 87.38 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 120.058 1.299 . . . . 0.0 109.786 176.295 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 22.4 p -137.34 -11.09 1.66 Allowed 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 116.156 1.909 . . . . 0.0 116.156 -173.819 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 95.14 6.68 60.04 Favored Glycine 0 CA--C 1.528 0.904 0 O-C-N 121.21 -0.931 . . . . 0.0 113.329 171.921 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 15.2 mt -82.1 163.15 22.21 Favored 'General case' 0 C--O 1.237 0.426 0 CA-C-N 118.169 0.985 . . . . 0.0 109.196 174.901 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 57.6 m-85 -108.9 157.44 18.62 Favored 'General case' 0 C--O 1.234 0.274 0 C-N-CA 123.141 0.576 . . . . 0.0 109.954 171.07 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 56.0 t80 -127.93 151.37 49.19 Favored 'General case' 0 C--O 1.238 0.448 0 C-N-CA 128.918 2.887 . . . . 0.0 107.865 -178.995 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -130.14 144.02 51.47 Favored Pre-proline 0 C--N 1.331 -0.213 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 173.345 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -64.99 -24.43 60.28 Favored 'Trans proline' 0 N--CA 1.455 -0.769 0 C-N-CA 122.539 2.159 . . . . 0.0 114.038 -175.427 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 17.7 m-80 -104.07 -19.04 14.31 Favored 'General case' 0 C--O 1.237 0.417 0 C-N-CA 123.721 0.808 . . . . 0.0 112.002 176.527 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 33.6 t -120.77 84.52 2.24 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 125.278 1.431 . . . . 0.0 109.163 177.63 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 24.9 mp0 -58.61 -8.16 1.18 Allowed 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 124.459 1.104 . . . . 0.0 111.657 162.443 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 26.8 m-85 -70.3 99.56 1.57 Allowed 'General case' 0 N--CA 1.45 -0.452 0 N-CA-C 107.357 -1.349 . . . . 0.0 107.357 164.732 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 54.3 m-85 -59.92 146.4 42.43 Favored 'General case' 0 C--O 1.237 0.432 0 C-N-CA 125.877 1.671 . . . . 0.0 109.974 -174.722 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 73.9 t80 -96.81 118.77 33.97 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-O 122.417 1.103 . . . . 0.0 109.748 173.634 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' ASN . . . . . 0.402 ' HB3' ' HG2' ' A' ' 50' ' ' GLN . 21.0 t-20 -88.07 79.57 7.92 Favored 'General case' 0 N--CA 1.443 -0.806 0 C-N-CA 127.108 2.163 . . . . 0.0 107.557 -179.273 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -53.64 -32.65 52.29 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 123.684 0.794 . . . . 0.0 111.034 177.652 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.7 tt0 -51.01 -28.09 9.26 Favored 'General case' 0 N--CA 1.449 -0.496 0 C-N-CA 127.454 2.302 . . . . 0.0 114.365 -176.8 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -144.95 4.75 1.12 Allowed 'General case' 0 CA--C 1.535 0.39 0 N-CA-C 112.697 0.629 . . . . 0.0 112.697 174.692 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 26.8 mt-30 68.16 60.68 0.41 Allowed 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 125.968 1.707 . . . . 0.0 109.997 -177.461 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.402 ' HG2' ' HB3' ' A' ' 45' ' ' ASN . 0.0 OUTLIER -124.89 168.18 13.64 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 125.929 1.692 . . . . 0.0 114.871 174.715 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 4.4 m-85 -107.14 149.82 27.25 Favored 'General case' 0 C--O 1.233 0.202 0 N-CA-C 107.898 -1.149 . . . . 0.0 107.898 162.246 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 90.9 mt -145.99 -176.78 5.28 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 127.279 2.232 . . . . 0.0 107.025 -178.607 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 4.4 p90 -127.68 179.81 5.33 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 125.165 1.386 . . . . 0.0 108.278 162.726 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 27.5 t-105 -105.08 135.71 45.91 Favored 'General case' 0 C--O 1.238 0.499 0 N-CA-C 105.055 -2.202 . . . . 0.0 105.055 160.685 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -124.01 115.97 22.08 Favored 'General case' 0 N--CA 1.446 -0.628 0 C-N-CA 124.742 1.217 . . . . 0.0 108.013 177.886 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -77.27 -15.93 81.04 Favored Glycine 0 N--CA 1.445 -0.758 0 CA-C-O 117.407 -1.774 . . . . 0.0 112.361 177.316 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -65.7 -47.85 74.0 Favored 'General case' 0 C--N 1.345 0.388 0 CA-C-N 121.308 2.554 . . . . 0.0 108.241 -177.167 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 5.4 mtt85 -102.19 5.0 39.98 Favored 'General case' 0 CA--C 1.529 0.149 0 C-N-CA 125.805 1.642 . . . . 0.0 111.293 -179.051 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 3.2 mtt180 44.78 60.34 2.97 Favored 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 126.601 1.96 . . . . 0.0 109.798 -178.174 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 5.5 t -149.85 173.05 14.19 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-O 121.763 0.792 . . . . 0.0 110.193 -168.551 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 82.2 m-85 -113.74 116.39 29.33 Favored 'General case' 0 C--O 1.234 0.283 0 C-N-CA 124.906 1.283 . . . . 0.0 108.246 172.802 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -125.58 158.98 62.86 Favored Pre-proline 0 C--N 1.327 -0.382 0 C-N-CA 126.831 2.052 . . . . 0.0 110.409 -168.941 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -72.89 124.14 9.44 Favored 'Trans proline' 0 N--CA 1.458 -0.602 0 C-N-CA 122.931 2.421 . . . . 0.0 111.924 -175.986 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -89.96 22.72 3.06 Favored 'General case' 0 N--CA 1.464 0.245 0 C-N-CA 123.737 0.815 . . . . 0.0 112.713 179.855 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 5.8 mp -79.08 -85.0 0.08 Allowed 'General case' 0 N--CA 1.45 -0.438 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 -172.257 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 64.0 mt-10 -75.9 -23.66 55.55 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 118.438 0.563 . . . . 0.0 110.166 167.775 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER 52.52 30.81 8.93 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 126.152 1.781 . . . . 0.0 112.614 -168.126 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 58.4 p -143.47 123.55 13.64 Favored 'General case' 0 C--O 1.24 0.562 0 O-C-N 121.063 -1.023 . . . . 0.0 109.943 165.582 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 55.36 -179.16 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 128.42 2.688 . . . . 0.0 114.625 176.125 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -93.87 75.37 4.21 Favored 'General case' 0 C--O 1.236 0.354 0 C-N-CA 125.474 1.51 . . . . 0.0 108.131 -172.232 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -78.61 -29.76 51.23 Favored Glycine 0 CA--C 1.525 0.661 0 CA-C-O 118.949 -0.917 . . . . 0.0 111.57 171.621 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 7.4 t-80 74.7 1.04 3.72 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 127.807 2.443 . . . . 0.0 113.481 170.728 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 39.6 mttm -110.28 175.74 5.32 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 126.664 1.986 . . . . 0.0 111.312 -165.362 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 14.9 mt-10 -99.88 178.81 4.71 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 124.702 1.201 . . . . 0.0 110.029 174.113 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -58.79 -44.53 90.76 Favored 'General case' 0 N--CA 1.463 0.191 0 C-N-CA 124.704 1.201 . . . . 0.0 111.317 178.116 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -143.23 151.44 23.23 Favored Glycine 0 N--CA 1.44 -1.042 0 N-CA-C 106.943 -2.463 . . . . 0.0 106.943 179.372 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -162.61 157.9 19.1 Favored Pre-proline 0 C--O 1.241 0.649 0 C-N-CA 125.333 1.453 . . . . 0.0 108.305 -164.814 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -75.31 168.46 24.57 Favored 'Trans proline' 0 N--CA 1.45 -1.085 0 C-N-CA 122.178 1.919 . . . . 0.0 109.636 173.691 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 22.0 m 69.14 -66.42 0.25 Allowed 'General case' 0 C--N 1.333 -0.117 0 CA-C-O 116.045 -1.931 . . . . 0.0 111.262 176.101 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 19.6 tttm -63.16 29.61 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 127.227 2.211 . . . . 0.0 113.808 178.984 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 6.9 tt0 -144.65 -4.13 0.78 Allowed 'General case' 0 CA--C 1.539 0.535 0 O-C-N 119.663 -1.898 . . . . 0.0 112.572 170.834 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 164.55 -46.05 0.3 Allowed Glycine 0 C--N 1.345 1.079 0 C-N-CA 118.781 -1.676 . . . . 0.0 116.45 -176.001 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 7.5 mtpm? -76.39 6.05 6.24 Favored 'General case' 0 C--O 1.219 -0.548 0 O-C-N 120.849 -1.383 . . . . 0.0 109.83 175.824 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 12.0 tt0 -44.82 -60.56 1.97 Allowed 'General case' 0 N--CA 1.443 -0.794 0 C-N-CA 130.535 3.534 . . . . 0.0 112.527 -167.98 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.26 -5.49 58.92 Favored 'General case' 0 C--N 1.331 -0.201 0 C-N-CA 124.086 0.954 . . . . 0.0 110.858 -174.55 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 8.2 ptpt -128.78 22.06 5.87 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 124.453 1.101 . . . . 0.0 110.222 -167.603 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 22.8 tt0 -62.78 -63.62 1.16 Allowed 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 125.57 1.548 . . . . 0.0 109.888 -168.803 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 88' ' ' LYS . . . . . 0.466 ' HE2' ' HA ' ' A' ' 88' ' ' LYS . 0.2 OUTLIER 61.58 103.1 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 126.94 2.096 . . . . 0.0 111.088 178.828 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -52.9 161.07 0.83 Allowed 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 124.443 1.097 . . . . 0.0 111.932 170.328 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 10.2 mptt -122.13 160.74 24.46 Favored 'General case' 0 C--O 1.238 0.499 0 N-CA-C 104.892 -2.262 . . . . 0.0 104.892 168.617 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 1.3 t -93.9 5.78 50.58 Favored 'General case' 0 CA--C 1.546 0.817 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 175.954 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 72.8 mmtt . . . . . 0 C--O 1.248 0.979 0 CA-C-O 114.456 -2.688 . . . . 0.0 104.681 -137.344 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 17.7 m-85 . . . . . 0 CA--C 1.54 0.59 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 96.2 Cg_endo -65.36 -176.06 0.48 Allowed 'Trans proline' 0 CA--C 1.537 0.644 0 C-N-CA 123.623 2.882 . . . . 0.0 111.594 169.404 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 48.8 t -113.95 85.82 10.4 Favored Pre-proline 0 CA--C 1.541 0.609 0 N-CA-C 106.987 -1.486 . . . . 0.0 106.987 178.09 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -67.0 175.53 5.47 Favored 'Trans proline' 0 C--N 1.35 0.614 0 C-N-CA 123.39 2.726 . . . . 0.0 112.121 -176.881 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 63.3 t0 -142.46 125.23 15.99 Favored 'General case' 0 C--O 1.237 0.445 0 N-CA-C 105.154 -2.165 . . . . 0.0 105.154 166.429 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 5.3 p -55.33 -23.05 13.0 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.433 0 C-N-CA 123.816 0.846 . . . . 0.0 111.499 175.531 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 31.6 t -67.65 2.29 1.96 Allowed 'General case' 0 CA--C 1.54 0.573 0 O-C-N 120.895 -1.128 . . . . 0.0 112.248 175.565 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 47.3 p -114.65 3.22 14.72 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 125.272 1.429 . . . . 0.0 110.878 174.608 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 14.7 m-30 -85.57 175.79 8.58 Favored 'General case' 0 C--O 1.236 0.391 0 O-C-N 121.03 -1.044 . . . . 0.0 109.579 -179.362 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 15.7 mt-30 -120.14 114.27 21.7 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 124.271 1.029 . . . . 0.0 110.119 -178.348 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 69.0 t80 -72.79 135.74 45.31 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 123.344 0.658 . . . . 0.0 110.407 175.116 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -118.98 75.81 1.06 Allowed 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 125.421 1.488 . . . . 0.0 108.649 -173.543 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -56.52 -19.49 15.82 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 125.343 1.457 . . . . 0.0 114.662 -167.528 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 1.3 t -54.67 -30.76 56.32 Favored 'General case' 0 CA--C 1.554 1.111 0 C-N-CA 124.705 1.202 . . . . 0.0 110.234 170.427 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 47.1 m -132.12 -16.94 2.77 Favored 'General case' 0 C--N 1.346 0.439 0 N-CA-C 115.61 1.707 . . . . 0.0 115.61 -178.854 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 99.78 2.39 56.25 Favored Glycine 0 CA--C 1.535 1.326 0 CA-C-N 120.865 1.666 . . . . 0.0 114.297 172.223 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 80.4 m-85 -95.32 169.3 10.17 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 125.106 1.363 . . . . 0.0 110.657 178.083 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 71.3 m-85 -102.09 151.91 21.6 Favored 'General case' 0 N--CA 1.453 -0.319 0 N-CA-C 106.335 -1.728 . . . . 0.0 106.335 160.411 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 40.6 t80 -115.68 140.4 49.23 Favored 'General case' 0 C--O 1.241 0.625 0 C-N-CA 125.926 1.69 . . . . 0.0 107.457 175.525 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -121.96 76.34 39.65 Favored Pre-proline 0 N--CA 1.444 -0.763 0 N-CA-C 106.636 -1.616 . . . . 0.0 106.636 -158.561 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 27.2 Cg_endo -60.9 -19.49 62.53 Favored 'Trans proline' 0 CA--C 1.537 0.665 0 C-N-CA 122.415 2.077 . . . . 0.0 114.353 -168.536 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 14.8 tt0 -68.09 -22.79 64.9 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.539 1.135 . . . . 0.0 111.33 178.956 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.492 ' CB ' HD22 ' A' ' 34' ' ' LEU . 0.5 OUTLIER -116.13 -58.21 2.12 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 127.725 2.41 . . . . 0.0 107.091 -178.309 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 113.88 -7.59 23.71 Favored Glycine 0 CA--C 1.53 1.005 0 C-N-CA 127.443 2.449 . . . . 0.0 110.861 -169.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.492 HD22 ' CB ' ' A' ' 32' ' ' THR . 0.0 OUTLIER -59.5 168.71 1.49 Allowed 'General case' 0 N--CA 1.434 -1.237 0 C-N-CA 129.118 2.967 . . . . 0.0 111.086 170.95 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 63.4 m-85 -116.1 140.46 49.26 Favored 'General case' 0 C--O 1.238 0.478 0 CA-C-N 114.45 -1.25 . . . . 0.0 108.658 158.934 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 58.6 t80 -105.41 153.9 21.04 Favored 'General case' 0 C--N 1.325 -0.493 0 C-N-CA 125.387 1.475 . . . . 0.0 108.093 171.345 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 6.9 t0 -119.76 142.77 33.64 Favored Pre-proline 0 C--N 1.329 -0.31 0 N-CA-C 105.898 -1.89 . . . . 0.0 105.898 171.255 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -73.48 -28.68 11.84 Favored 'Trans proline' 0 N--CA 1.455 -0.779 0 C-N-CA 121.369 1.38 . . . . 0.0 113.01 -174.35 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 52.3 m-80 -95.24 -25.41 16.37 Favored 'General case' 0 N--CA 1.448 -0.528 0 C-N-CA 125.986 1.714 . . . . 0.0 110.467 -177.603 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 4.1 m -121.03 95.65 4.78 Favored 'General case' 0 C--O 1.223 -0.317 0 C-N-CA 124.536 1.135 . . . . 0.0 108.733 -178.654 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 20.7 mp0 -64.06 1.15 0.74 Allowed 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 125.665 1.586 . . . . 0.0 114.121 179.417 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 26.4 m-85 -77.29 109.04 10.86 Favored 'General case' 0 C--O 1.234 0.26 0 C-N-CA 126.024 1.73 . . . . 0.0 108.97 169.657 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 18.8 m-85 -67.23 157.38 33.97 Favored 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 125.472 1.509 . . . . 0.0 109.442 179.872 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . 0.425 ' CZ ' ' HA ' ' A' ' 46' ' ' ALA . 7.8 t80 -118.86 105.17 11.24 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 125.443 1.497 . . . . 0.0 107.885 178.875 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 30.1 t30 -79.25 92.18 5.09 Favored 'General case' 0 N--CA 1.445 -0.7 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 168.152 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.425 ' HA ' ' CZ ' ' A' ' 44' ' ' TYR . . . -56.54 -35.18 67.81 Favored 'General case' 0 N--CA 1.456 -0.144 0 C-N-CA 124.046 0.938 . . . . 0.0 112.482 179.743 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -45.76 -55.78 6.11 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 126.157 1.783 . . . . 0.0 111.606 -176.941 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.9 m -109.99 -1.84 17.42 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 123.736 0.814 . . . . 0.0 111.36 -172.827 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 40.9 mt-30 50.46 60.59 3.74 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 126.302 1.841 . . . . 0.0 109.442 -163.741 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -106.85 149.29 27.57 Favored 'General case' 0 C--O 1.233 0.198 0 N-CA-C 107.992 -1.114 . . . . 0.0 107.992 167.237 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 3.8 m-85 -104.79 131.03 52.75 Favored 'General case' 0 CA--C 1.515 -0.397 0 N-CA-C 105.475 -2.046 . . . . 0.0 105.475 168.498 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.403 HD23 ' HA ' ' A' ' 63' ' ' PRO . 49.9 mt -127.08 177.89 6.36 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 125.521 1.528 . . . . 0.0 108.164 -171.709 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 26.1 p90 -142.94 156.3 44.86 Favored 'General case' 0 N--CA 1.447 -0.618 0 N-CA-C 108.845 -0.798 . . . . 0.0 108.845 160.89 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 26.6 t-105 -82.52 118.95 23.63 Favored 'General case' 0 N--CA 1.448 -0.562 0 N-CA-C 106.937 -1.505 . . . . 0.0 106.937 171.288 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 20.9 t0 -109.39 93.58 4.58 Favored 'General case' 0 CA--C 1.516 -0.365 0 N-CA-C 107.918 -1.141 . . . . 0.0 107.918 171.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -62.89 -12.4 42.29 Favored Glycine 0 CA--C 1.53 1.029 0 CA-C-O 117.947 -1.474 . . . . 0.0 113.641 179.846 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 11.7 mt-10 -75.77 -32.95 60.14 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 121.228 2.514 . . . . 0.0 109.363 173.911 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 51.0 mtt85 -104.43 -5.06 22.02 Favored 'General case' 0 CA--C 1.529 0.137 0 C-N-CA 125.201 1.4 . . . . 0.0 111.727 -177.807 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 38.9 mtp180 44.28 43.75 6.16 Favored 'General case' 0 CA--C 1.514 -0.436 0 C-N-CA 128.604 2.762 . . . . 0.0 110.836 178.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 4.9 t -145.43 172.18 13.57 Favored 'General case' 0 N--CA 1.444 -0.737 0 N-CA-C 106.573 -1.639 . . . . 0.0 106.573 177.874 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 71.0 m-85 -94.58 140.42 29.88 Favored 'General case' 0 C--O 1.242 0.71 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 170.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -125.79 154.45 73.35 Favored Pre-proline 0 C--N 1.321 -0.661 0 C-N-CA 126.161 1.784 . . . . 0.0 107.182 173.124 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . 0.403 ' HA ' HD23 ' A' ' 52' ' ' LEU . 39.9 Cg_endo -68.33 145.52 65.96 Favored 'Trans proline' 0 N--CA 1.45 -1.081 0 C-N-CA 122.132 1.888 . . . . 0.0 109.62 172.974 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 0.322 0 C-N-CA 124.207 1.003 . . . . 0.0 111.411 173.872 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 28.5 m-85 . . . . . 0 C--O 1.239 0.544 0 CA-C-O 119.346 -0.359 . . . . 0.0 111.49 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 68.5 Cg_endo -74.51 -178.98 4.38 Favored 'Trans proline' 0 C--N 1.349 0.586 0 C-N-CA 122.957 2.438 . . . . 0.0 110.207 171.896 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 25.0 t -104.73 86.46 1.46 Allowed Pre-proline 0 CA--C 1.538 0.506 0 N-CA-C 106.05 -1.833 . . . . 0.0 106.05 176.422 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -68.67 170.62 14.81 Favored 'Trans proline' 0 N--CA 1.457 -0.639 0 C-N-CA 123.125 2.55 . . . . 0.0 109.134 -176.616 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 12.0 t0 -144.53 138.28 27.43 Favored 'General case' 0 CA--C 1.511 -0.532 0 N-CA-C 107.342 -1.355 . . . . 0.0 107.342 176.011 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.539 ' HA ' ' CD2' ' A' ' 18' ' ' TYR . 1.5 t -69.1 -19.27 23.6 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 N-CA-C 107.902 -1.147 . . . . 0.0 107.902 178.399 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 86.7 p -61.66 -15.66 41.87 Favored 'General case' 0 N--CA 1.43 -1.446 0 N-CA-C 113.606 0.965 . . . . 0.0 113.606 -179.384 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 14.0 t -124.08 9.92 8.73 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 126.308 1.843 . . . . 0.0 112.807 177.836 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . 0.539 ' CD2' ' HA ' ' A' ' 15' ' ' VAL . 18.3 m-30 -68.86 170.59 9.35 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-N 120.393 1.451 . . . . 0.0 108.488 166.577 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 14.3 mt-30 -118.1 106.25 12.67 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 124.521 1.128 . . . . 0.0 110.028 177.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 84.8 t80 -56.03 141.76 38.78 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 124.599 1.16 . . . . 0.0 111.456 170.879 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -126.04 95.09 4.28 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 124.158 0.983 . . . . 0.0 109.312 179.727 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -57.35 -23.21 47.51 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 125.176 1.39 . . . . 0.0 113.285 -177.637 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 5.2 t -48.59 -35.58 13.82 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 127.128 2.171 . . . . 0.0 109.659 172.983 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -120.68 -55.76 1.99 Allowed 'General case' 0 N--CA 1.445 -0.719 0 C-N-CA 124.167 0.987 . . . . 0.0 108.538 -177.768 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 117.0 28.71 2.36 Favored Glycine 0 CA--C 1.527 0.833 0 C-N-CA 123.965 0.793 . . . . 0.0 114.424 -174.904 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 39.4 m-85 -130.82 165.33 23.24 Favored 'General case' 0 C--O 1.239 0.504 0 C-N-CA 126.244 1.817 . . . . 0.0 106.804 -176.261 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 79.6 m-85 -90.41 140.17 29.97 Favored 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 124.554 1.141 . . . . 0.0 108.037 173.265 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 31.3 t80 -102.34 134.86 44.95 Favored 'General case' 0 C--O 1.237 0.433 0 N-CA-C 107.459 -1.311 . . . . 0.0 107.459 170.039 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -112.69 77.0 2.28 Favored Pre-proline 0 N--CA 1.447 -0.587 0 C-N-CA 125.89 1.676 . . . . 0.0 109.429 -166.347 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -67.22 -6.27 15.81 Favored 'Trans proline' 0 N--CA 1.46 -0.465 0 C-N-CA 122.929 2.42 . . . . 0.0 114.145 -170.82 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 3.9 tt0 -63.29 -26.11 68.62 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 118.516 0.598 . . . . 0.0 110.408 174.314 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 7.3 p -139.98 -21.15 0.88 Allowed 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 124.78 1.232 . . . . 0.0 113.474 179.453 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 97.45 14.81 39.95 Favored Glycine 0 CA--C 1.529 0.963 0 CA-C-N 119.054 0.843 . . . . 0.0 112.764 -178.463 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 24.3 mt -86.51 -178.33 6.39 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 118.634 1.217 . . . . 0.0 109.18 175.664 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 39.0 m-85 -126.63 146.42 50.18 Favored 'General case' 0 C--O 1.238 0.461 0 C-N-CA 124.507 1.123 . . . . 0.0 109.825 166.374 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 85.9 t80 -117.83 154.79 31.21 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.932 1.693 . . . . 0.0 109.348 177.878 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -124.95 143.81 45.11 Favored Pre-proline 0 CA--C 1.535 0.383 0 C-N-CA 126.248 1.819 . . . . 0.0 109.151 171.927 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 70.7 Cg_endo -79.33 -31.92 1.93 Allowed 'Trans proline' 0 N--CA 1.459 -0.516 0 C-N-CA 123.691 2.927 . . . . 0.0 113.853 -176.238 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 8.2 m-80 -81.98 -22.04 36.82 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 124.049 0.939 . . . . 0.0 109.592 176.656 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 38.4 m -137.6 98.1 3.61 Favored 'General case' 0 CA--C 1.513 -0.477 0 C-N-CA 125.501 1.521 . . . . 0.0 108.94 -170.554 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 19.7 mp0 -67.35 24.33 0.02 OUTLIER 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 127.733 2.413 . . . . 0.0 113.203 -179.278 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 33.2 m-85 -99.25 101.44 12.76 Favored 'General case' 0 CA--C 1.536 0.42 0 O-C-N 120.202 -1.561 . . . . 0.0 108.261 177.501 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 29.6 m-85 -65.69 111.83 3.38 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 128.554 2.741 . . . . 0.0 110.604 -179.747 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 63.8 t80 -75.33 127.29 32.81 Favored 'General case' 0 C--N 1.326 -0.452 0 C-N-CA 125.618 1.567 . . . . 0.0 110.448 -176.495 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 45.0 t30 -99.3 81.33 2.53 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 126.886 2.074 . . . . 0.0 109.54 175.364 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -46.08 -36.79 6.08 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 124.749 1.22 . . . . 0.0 111.992 176.936 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.7 tt0 -49.78 -31.07 10.75 Favored 'General case' 0 N--CA 1.447 -0.611 0 C-N-CA 127.573 2.349 . . . . 0.0 114.121 -178.425 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 40.2 m -134.04 17.13 3.81 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 123.52 0.728 . . . . 0.0 111.223 172.146 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 40.8 mt-30 44.99 32.31 0.83 Allowed 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 125.519 1.528 . . . . 0.0 112.006 -163.376 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -93.6 168.33 11.1 Favored 'General case' 0 N--CA 1.452 -0.345 0 O-C-N 120.9 -1.125 . . . . 0.0 109.848 -176.167 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 5.7 m-85 -116.57 128.07 55.08 Favored 'General case' 0 N--CA 1.446 -0.633 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 -174.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.436 HD23 ' HA ' ' A' ' 63' ' ' PRO . 22.6 mt -124.02 178.24 5.39 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 127.326 2.25 . . . . 0.0 109.885 179.686 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 5.1 p90 -145.69 152.44 39.62 Favored 'General case' 0 C--O 1.235 0.318 0 C-N-CA 127.788 2.435 . . . . 0.0 106.943 168.441 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 69.2 t-105 -77.1 142.98 39.53 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 107.316 -1.364 . . . . 0.0 107.316 164.569 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 63.9 t0 -131.85 104.53 6.93 Favored 'General case' 0 C--O 1.234 0.272 0 N-CA-C 108.876 -0.786 . . . . 0.0 108.876 169.708 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -75.81 -7.63 83.82 Favored Glycine 0 CA--C 1.533 1.163 0 C-N-CA 124.362 0.982 . . . . 0.0 113.345 -178.935 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 73.7 mt-10 -75.04 -31.57 61.34 Favored 'General case' 0 CA--C 1.531 0.222 0 O-C-N 121.066 -1.255 . . . . 0.0 109.933 170.342 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 63.9 mtt180 -110.04 -7.31 14.95 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 125.502 1.521 . . . . 0.0 112.668 -177.115 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 61.3 mtt85 44.98 55.66 5.97 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 128.294 2.638 . . . . 0.0 110.752 -174.02 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 11.3 t -150.72 169.46 21.56 Favored 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 123.268 0.627 . . . . 0.0 109.833 174.051 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 93.4 m-85 -92.43 134.88 34.52 Favored 'General case' 0 C--O 1.238 0.458 0 N-CA-C 107.23 -1.396 . . . . 0.0 107.23 164.071 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -126.95 157.7 71.02 Favored Pre-proline 0 C--N 1.322 -0.608 0 C-N-CA 127.026 2.13 . . . . 0.0 111.113 178.362 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . 0.436 ' HA ' HD23 ' A' ' 52' ' ' LEU . 42.8 Cg_endo -75.23 123.41 7.74 Favored 'Trans proline' 0 CA--C 1.533 0.471 0 C-N-CA 123.925 3.083 . . . . 0.0 112.568 -177.939 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.298 0 N-CA-C 115.831 1.789 . . . . 0.0 115.831 -169.091 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 61.4 m-85 . . . . . 0 C--O 1.242 0.708 0 N-CA-C 112.013 0.375 . . . . 0.0 112.013 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 92.3 Cg_endo -68.62 179.28 3.2 Favored 'Trans proline' 0 N--CA 1.456 -0.713 0 C-N-CA 123.541 2.827 . . . . 0.0 109.976 167.639 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 10.7 t -105.1 88.39 2.41 Favored Pre-proline 0 N--CA 1.45 -0.445 0 N-CA-C 106.748 -1.575 . . . . 0.0 106.748 176.403 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_endo -58.67 170.89 2.26 Favored 'Trans proline' 0 CA--C 1.545 1.048 0 CA-C-N 120.248 1.124 . . . . 0.0 110.397 171.703 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 15.3 t0 -132.84 129.25 38.22 Favored 'General case' 0 N--CA 1.447 -0.621 0 N-CA-C 106.139 -1.8 . . . . 0.0 106.139 164.524 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.671 HG11 ' CE2' ' A' ' 36' ' ' TYR . 1.7 t -59.0 -26.6 33.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 114.515 -1.221 . . . . 0.0 108.149 173.545 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 36.4 p -60.34 -38.22 83.1 Favored 'General case' 0 N--CA 1.437 -1.114 0 C-N-CA 118.033 -1.467 . . . . 0.0 109.047 -172.42 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 16.4 p -87.68 18.33 4.09 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 126.436 1.894 . . . . 0.0 111.778 179.374 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . 0.586 ' CE2' HG13 ' A' ' 15' ' ' VAL . 13.3 m-30 -79.96 160.6 25.88 Favored 'General case' 0 C--O 1.234 0.258 0 O-C-N 119.903 -1.748 . . . . 0.0 110.049 170.518 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 25.6 mt-30 -100.56 109.6 21.71 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 107.975 -1.12 . . . . 0.0 107.975 -178.429 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 66.9 t80 -63.45 152.68 37.68 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 124.081 0.953 . . . . 0.0 110.421 176.042 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -128.73 105.3 8.16 Favored 'General case' 0 CA--C 1.512 -0.505 0 C-N-CA 125.139 1.376 . . . . 0.0 108.498 168.135 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -61.09 -27.47 68.39 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 119.172 -0.442 . . . . 0.0 112.109 169.917 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 15.1 t -66.08 -4.98 8.36 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.347 1.059 . . . . 0.0 113.184 -178.132 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 12.5 t -140.75 -47.8 0.42 Allowed 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 123.301 0.641 . . . . 0.0 109.555 172.619 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 112.0 43.66 0.92 Allowed Glycine 0 CA--C 1.526 0.743 0 C-N-CA 124.921 1.248 . . . . 0.0 111.929 -177.75 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 68.8 m-85 -136.13 170.28 16.27 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 119.401 1.601 . . . . 0.0 111.161 -177.785 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 79.4 m-85 -110.91 125.96 54.22 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 124.76 1.224 . . . . 0.0 107.707 173.685 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 34.8 t80 -88.56 139.48 30.43 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 124.368 1.067 . . . . 0.0 108.396 177.962 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 27.7 t0 -97.4 86.54 0.42 Allowed Pre-proline 0 CA--C 1.529 0.145 0 C-N-CA 126.946 2.098 . . . . 0.0 109.247 177.796 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -70.37 -5.08 15.77 Favored 'Trans proline' 0 N--CA 1.456 -0.702 0 C-N-CA 122.592 2.195 . . . . 0.0 113.685 175.798 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 2.4 mm-40 -73.77 -28.26 61.57 Favored 'General case' 0 CA--C 1.533 0.309 0 O-C-N 121.328 -0.858 . . . . 0.0 109.368 175.284 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 23.7 p -140.31 -24.11 0.81 Allowed 'General case' 0 C--O 1.238 0.453 0 N-CA-C 115.079 1.511 . . . . 0.0 115.079 -169.404 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 104.13 9.95 35.49 Favored Glycine 0 CA--C 1.53 1.021 0 C-N-CA 124.135 0.874 . . . . 0.0 112.986 177.426 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 19.8 mt -89.84 179.99 5.86 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 125.544 1.538 . . . . 0.0 109.07 178.253 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 57.4 m-85 -124.3 171.37 9.94 Favored 'General case' 0 C--O 1.234 0.282 0 C-N-CA 124.474 1.11 . . . . 0.0 108.843 162.368 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.671 ' CE2' HG11 ' A' ' 15' ' ' VAL . 68.1 t80 -143.21 159.36 42.46 Favored 'General case' 0 C--O 1.238 0.467 0 C-N-CA 128.224 2.609 . . . . 0.0 108.337 179.24 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -127.66 144.35 50.82 Favored Pre-proline 0 C--O 1.235 0.321 0 C-N-CA 124.576 1.15 . . . . 0.0 108.373 174.229 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 61.9 Cg_endo -75.07 -35.07 3.3 Favored 'Trans proline' 0 N--CA 1.45 -1.057 0 C-N-CA 121.944 1.763 . . . . 0.0 113.324 -173.036 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 3.6 m-80 -83.08 -21.72 33.64 Favored 'General case' 0 CA--C 1.524 -0.056 0 CA-C-N 119.152 0.887 . . . . 0.0 110.91 175.807 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 42.7 t -130.89 89.36 2.74 Favored 'General case' 0 N--CA 1.45 -0.472 0 N-CA-C 107.449 -1.315 . . . . 0.0 107.449 -166.85 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -55.92 -9.25 0.55 Allowed 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.873 1.269 . . . . 0.0 113.255 -177.792 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 11.5 m-85 -62.95 107.04 0.91 Allowed 'General case' 0 N--CA 1.449 -0.486 0 C-N-CA 124.951 1.3 . . . . 0.0 108.807 170.566 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 28.2 m-85 -59.89 156.75 13.76 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 124.756 1.222 . . . . 0.0 109.28 170.915 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 83.0 t80 -117.35 124.45 48.96 Favored 'General case' 0 N--CA 1.447 -0.602 0 C-N-CA 124.508 1.123 . . . . 0.0 108.116 177.74 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 27.1 t30 -98.15 84.65 3.3 Favored 'General case' 0 N--CA 1.446 -0.654 0 C-N-CA 126.754 2.022 . . . . 0.0 107.824 176.084 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -53.85 -26.52 24.89 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 124.324 1.049 . . . . 0.0 112.181 175.639 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -52.49 -41.64 63.58 Favored 'General case' 0 N--CA 1.446 -0.637 0 C-N-CA 124.496 1.118 . . . . 0.0 112.113 176.861 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 14.6 m -128.43 15.91 6.57 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 125.15 1.38 . . . . 0.0 111.726 -179.766 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 40.2 mt-30 50.62 19.01 0.53 Allowed 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 127.091 2.156 . . . . 0.0 114.35 -171.803 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -91.31 159.14 16.17 Favored 'General case' 0 N--CA 1.454 -0.239 0 C-N-CA 124.02 0.928 . . . . 0.0 109.798 -171.071 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -98.49 146.75 25.45 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 108.548 -0.908 . . . . 0.0 108.548 174.849 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.48 HD23 ' HA ' ' A' ' 63' ' ' PRO . 82.7 mt -140.01 -178.03 5.26 Favored 'General case' 0 C--N 1.326 -0.413 0 C-N-CA 125.564 1.546 . . . . 0.0 107.915 -179.386 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 26.5 p90 -143.32 149.69 38.13 Favored 'General case' 0 C--N 1.327 -0.378 0 C-N-CA 125.188 1.395 . . . . 0.0 108.191 168.073 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 42.0 t-105 -85.71 139.38 31.4 Favored 'General case' 0 C--O 1.235 0.337 0 N-CA-C 106.57 -1.641 . . . . 0.0 106.57 168.399 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 7.6 t0 -134.85 113.8 11.95 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 122.899 0.48 . . . . 0.0 110.057 -175.833 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -74.37 -12.01 82.18 Favored Glycine 0 CA--C 1.533 1.183 0 CA-C-O 119.117 -0.824 . . . . 0.0 113.498 176.179 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -67.15 -35.23 79.26 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 119.67 1.735 . . . . 0.0 108.937 176.388 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 43.0 mtt85 -120.21 -4.29 10.0 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 124.556 1.142 . . . . 0.0 112.75 -177.558 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 9.7 mtp85 49.19 51.53 16.08 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 126.695 1.998 . . . . 0.0 110.475 -173.247 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 1.4 t -146.36 173.86 11.89 Favored 'General case' 0 CA--C 1.536 0.424 0 O-C-N 121.345 -0.847 . . . . 0.0 108.793 -179.888 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 99.1 m-85 -111.03 119.66 39.78 Favored 'General case' 0 C--O 1.234 0.276 0 C-N-CA 125.044 1.337 . . . . 0.0 108.547 -179.445 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -126.4 156.84 72.12 Favored Pre-proline 0 N--CA 1.469 0.503 0 C-N-CA 125.946 1.698 . . . . 0.0 111.871 -169.805 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . 0.48 ' HA ' HD23 ' A' ' 52' ' ' LEU . 60.9 Cg_endo -74.43 118.46 5.36 Favored 'Trans proline' 0 N--CA 1.459 -0.553 0 C-N-CA 122.439 2.092 . . . . 0.0 111.947 -175.505 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.347 0 O-C-N 121.479 -0.763 . . . . 0.0 112.069 178.159 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 12.9 m-85 . . . . . 0 CA--C 1.539 0.553 0 CA-C-O 118.784 -0.627 . . . . 0.0 110.055 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -59.23 -164.88 0.03 OUTLIER 'Trans proline' 0 CA--C 1.542 0.916 1 C-N-CA 125.769 4.312 . . . . 0.0 113.881 162.268 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 47.0 t -126.2 88.06 55.01 Favored Pre-proline 0 CA--C 1.541 0.613 0 C-N-CA 127.083 2.153 . . . . 0.0 108.804 -176.473 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_endo -65.24 160.0 44.33 Favored 'Trans proline' 0 CA--C 1.539 0.745 0 C-N-CA 123.657 2.905 . . . . 0.0 112.451 -173.468 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 42.5 t0 -148.73 127.64 12.67 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 106.709 -1.589 . . . . 0.0 106.709 175.797 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 11.3 p -60.4 -21.44 22.9 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.534 0 C-N-CA 123.956 0.902 . . . . 0.0 112.123 177.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 42.6 t -62.77 -7.49 5.06 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 125.489 1.516 . . . . 0.0 113.381 -178.882 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 14.5 t -124.29 12.35 8.82 Favored 'General case' 0 CA--C 1.533 0.296 0 O-C-N 120.549 -1.344 . . . . 0.0 111.34 177.142 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 10.9 m-30 -73.88 169.28 17.74 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-O 122.101 0.953 . . . . 0.0 110.8 175.423 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 27.2 mt-30 -113.55 101.72 9.61 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 125.936 1.694 . . . . 0.0 107.49 177.763 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 74.9 t80 -67.17 147.02 53.62 Favored 'General case' 0 C--N 1.328 -0.348 0 O-C-N 121.82 -0.55 . . . . 0.0 110.215 169.828 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -129.17 87.99 2.64 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 123.351 0.661 . . . . 0.0 110.793 179.789 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -58.72 -21.94 56.27 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 114.075 1.139 . . . . 0.0 114.075 -168.967 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 3.2 t -58.61 -19.12 35.85 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.577 1.151 . . . . 0.0 112.41 174.405 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 48.8 m -137.54 -23.51 1.08 Allowed 'General case' 0 CA--C 1.539 0.519 0 N-CA-C 114.563 1.32 . . . . 0.0 114.563 177.43 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 98.6 19.98 20.98 Favored Glycine 0 CA--C 1.536 1.364 0 CA-C-N 120.361 1.437 . . . . 0.0 115.535 170.413 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 7.7 m-85 -122.62 169.55 10.92 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 119.595 1.698 . . . . 0.0 110.395 175.72 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 88.3 m-85 -102.49 153.43 20.06 Favored 'General case' 0 N--CA 1.448 -0.531 0 C-N-CA 125.186 1.395 . . . . 0.0 109.617 173.656 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 55.2 t80 -118.86 143.75 46.78 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 126.107 1.763 . . . . 0.0 108.699 172.147 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 65.7 t0 -106.15 87.29 2.43 Favored Pre-proline 0 C--N 1.33 -0.272 0 C-N-CA 126.749 2.02 . . . . 0.0 111.941 -175.738 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -61.16 -6.74 6.92 Favored 'Trans proline' 0 CA--C 1.535 0.551 0 C-N-CA 123.038 2.492 . . . . 0.0 114.747 176.145 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 54.5 mt-30 -74.98 -19.97 59.87 Favored 'General case' 0 CA--C 1.535 0.366 0 O-C-N 120.731 -1.23 . . . . 0.0 111.057 173.772 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 27.5 p -143.19 -40.75 0.31 Allowed 'General case' 0 C--O 1.235 0.339 0 C-N-CA 123.687 0.795 . . . . 0.0 112.791 -166.364 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 96.03 40.25 4.09 Favored Glycine 0 CA--C 1.525 0.663 0 C-N-CA 124.606 1.098 . . . . 0.0 111.744 -176.046 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 10.8 mt -115.56 167.01 11.27 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 124.961 1.305 . . . . 0.0 108.997 172.853 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 37.2 m-85 -106.88 160.57 15.41 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 118.801 0.728 . . . . 0.0 110.359 166.37 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 38.3 t80 -141.95 152.02 43.12 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 126.593 1.957 . . . . 0.0 109.23 -174.78 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -124.63 143.71 44.23 Favored Pre-proline 0 CA--C 1.535 0.402 0 C-N-CA 125.762 1.625 . . . . 0.0 108.797 174.863 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 95.5 Cg_endo -77.46 -21.27 11.74 Favored 'Trans proline' 0 CA--C 1.535 0.535 0 C-N-CA 123.089 2.526 . . . . 0.0 115.159 -172.553 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 81.9 m-20 -92.31 -33.94 14.41 Favored 'General case' 0 N--CA 1.447 -0.622 0 C-N-CA 125.513 1.525 . . . . 0.0 110.018 174.731 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 41.5 p -125.19 84.1 2.24 Favored 'General case' 0 N--CA 1.451 -0.375 0 C-N-CA 123.861 0.864 . . . . 0.0 108.806 -165.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 21.0 mp0 -57.87 -1.09 0.09 Allowed 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 127.149 2.18 . . . . 0.0 114.726 -175.666 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 45.3 m-85 -65.4 107.48 1.67 Allowed 'General case' 0 C--O 1.236 0.35 0 C-N-CA 125.529 1.532 . . . . 0.0 107.807 169.764 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 68.9 m-85 -65.72 140.83 58.48 Favored 'General case' 0 C--O 1.235 0.312 0 C-N-CA 123.87 0.868 . . . . 0.0 108.846 -178.96 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 64.8 t80 -95.29 109.72 21.82 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-O 122.752 1.263 . . . . 0.0 108.2 175.246 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 35.9 t30 -83.29 80.32 9.11 Favored 'General case' 0 N--CA 1.44 -0.946 0 CA-C-N 114.171 -1.377 . . . . 0.0 108.509 173.966 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -46.25 -35.3 5.11 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 125.095 1.358 . . . . 0.0 112.225 178.444 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -44.41 -50.62 9.18 Favored 'General case' 0 N--CA 1.444 -0.756 0 C-N-CA 127.942 2.497 . . . . 0.0 111.908 177.624 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 13.9 m -126.09 19.4 7.67 Favored 'General case' 0 C--N 1.332 -0.169 0 C-N-CA 124.845 1.258 . . . . 0.0 111.065 -178.345 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 11.1 mp0 50.88 18.67 0.54 Allowed 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 127.75 2.42 . . . . 0.0 113.275 -174.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -84.82 164.07 18.68 Favored 'General case' 0 N--CA 1.447 -0.578 0 C-N-CA 125.145 1.378 . . . . 0.0 111.303 -170.463 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 4.9 m-85 -118.57 121.57 40.54 Favored 'General case' 0 N--CA 1.449 -0.516 0 N-CA-C 105.62 -1.993 . . . . 0.0 105.62 -177.119 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 63.7 mt -124.4 176.56 6.4 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 125.076 1.35 . . . . 0.0 108.223 -170.895 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 13.5 p90 -135.4 148.21 49.28 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 108.121 -1.066 . . . . 0.0 108.121 168.604 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 57.8 t-105 -74.89 135.44 41.5 Favored 'General case' 0 C--O 1.236 0.359 0 N-CA-C 106.395 -1.706 . . . . 0.0 106.395 165.898 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 35.3 t0 -129.05 95.05 3.97 Favored 'General case' 0 N--CA 1.448 -0.564 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 177.567 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -66.09 -17.98 66.35 Favored Glycine 0 CA--C 1.526 0.744 0 CA-C-O 119.232 -0.76 . . . . 0.0 112.381 176.647 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 -68.33 -30.29 69.23 Favored 'General case' 0 C--N 1.34 0.166 0 CA-C-N 119.206 1.503 . . . . 0.0 109.366 174.559 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 47.6 mtt180 -102.86 -9.9 19.52 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.67 1.188 . . . . 0.0 112.106 178.327 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 11.8 mtm-85 44.68 54.94 6.23 Favored 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 127.539 2.335 . . . . 0.0 111.111 -167.297 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 7.5 t -154.94 178.15 10.5 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 124.092 0.957 . . . . 0.0 109.104 177.995 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 97.3 m-85 -109.36 128.28 54.99 Favored 'General case' 0 C--O 1.233 0.221 0 N-CA-C 107.571 -1.27 . . . . 0.0 107.571 168.349 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -126.73 158.34 68.4 Favored Pre-proline 0 C--N 1.324 -0.525 0 C-N-CA 126.494 1.918 . . . . 0.0 110.64 -173.692 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -72.61 136.93 26.74 Favored 'Trans proline' 0 N--CA 1.455 -0.778 0 C-N-CA 122.421 2.081 . . . . 0.0 110.135 -178.057 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 0.367 0 C-N-CA 123.521 0.728 . . . . 0.0 111.959 -176.824 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 37.8 m-85 . . . . . 0 C--O 1.241 0.614 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 29.5 Cg_endo -65.29 -178.25 0.81 Allowed 'Trans proline' 0 CA--C 1.54 0.824 0 C-N-CA 122.965 2.443 . . . . 0.0 111.422 160.202 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 59.1 t -111.34 87.99 8.31 Favored Pre-proline 0 CA--C 1.537 0.465 0 C-N-CA 127.653 2.381 . . . . 0.0 107.584 -173.242 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -68.82 164.92 31.57 Favored 'Trans proline' 0 CA--C 1.539 0.74 0 C-N-CA 123.467 2.778 . . . . 0.0 111.751 -179.109 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.9 t0 -143.25 130.58 20.96 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 108.003 -1.11 . . . . 0.0 108.003 167.653 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 14.0 p -58.68 -17.3 10.26 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.769 0 C-N-CA 124.25 1.02 . . . . 0.0 112.047 176.456 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 32.2 t -53.55 -26.2 20.28 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 125.708 1.603 . . . . 0.0 113.061 173.535 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 5.9 t -119.77 17.68 12.68 Favored 'General case' 0 CA--C 1.545 0.774 0 CA-C-N 119.33 0.968 . . . . 0.0 111.738 -175.18 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 8.1 m-30 -73.64 -168.98 0.63 Allowed 'General case' 0 C--O 1.237 0.398 0 C-N-CA 125.305 1.442 . . . . 0.0 110.456 171.741 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 6.8 mt-30 -122.43 150.86 41.9 Favored 'General case' 0 N--CA 1.446 -0.637 0 N-CA-C 107.018 -1.475 . . . . 0.0 107.018 163.81 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 78.2 t80 -93.95 152.42 18.86 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 108.122 -1.066 . . . . 0.0 108.122 163.909 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -136.05 86.52 2.24 Favored 'General case' 0 CA--C 1.511 -0.539 0 N-CA-C 107.477 -1.305 . . . . 0.0 107.477 175.114 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -47.03 -30.89 2.91 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 126.773 2.029 . . . . 0.0 112.773 179.773 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 1.3 t -65.9 -26.78 67.77 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 123.844 0.858 . . . . 0.0 110.682 -176.78 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 30.2 m -109.15 -24.15 11.28 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.599 1.159 . . . . 0.0 111.641 167.544 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 79.93 27.62 52.77 Favored Glycine 0 CA--C 1.526 0.757 0 C-N-CA 124.558 1.075 . . . . 0.0 112.162 -178.384 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 31.4 m-85 -118.09 169.1 9.95 Favored 'General case' 0 CA--C 1.521 -0.169 0 C-N-CA 124.965 1.306 . . . . 0.0 108.426 179.51 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 73.6 m-85 -94.17 154.46 17.56 Favored 'General case' 0 N--CA 1.449 -0.499 0 N-CA-C 108.25 -1.018 . . . . 0.0 108.25 159.848 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 20.1 t80 -117.93 137.1 53.06 Favored 'General case' 0 N--CA 1.447 -0.624 0 C-N-CA 127.845 2.458 . . . . 0.0 106.472 174.636 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 47.9 t0 -100.62 86.72 0.69 Allowed Pre-proline 0 C--N 1.327 -0.384 0 C-N-CA 128.088 2.555 . . . . 0.0 108.359 -179.648 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_endo -66.0 -11.9 33.03 Favored 'Trans proline' 0 N--CA 1.458 -0.593 0 C-N-CA 122.162 1.908 . . . . 0.0 114.244 177.646 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 56.7 mm-40 -63.51 -52.99 58.86 Favored 'General case' 0 C--O 1.233 0.196 0 N-CA-C 107.164 -1.421 . . . . 0.0 107.164 173.276 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 45.4 p -110.35 -32.53 6.92 Favored 'General case' 0 CA--C 1.532 0.274 0 N-CA-C 114.112 1.153 . . . . 0.0 114.112 -169.564 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 106.74 12.16 25.06 Favored Glycine 0 CA--C 1.529 0.968 0 C-N-CA 124.994 1.283 . . . . 0.0 113.378 -175.816 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 50.7 mt -87.58 169.52 12.1 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 118.57 1.185 . . . . 0.0 109.701 178.453 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 42.7 m-85 -112.02 161.53 16.36 Favored 'General case' 0 C--O 1.234 0.284 0 O-C-N 121.454 -0.779 . . . . 0.0 109.062 163.076 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 93.3 t80 -142.63 152.67 42.72 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 126.077 1.751 . . . . 0.0 108.685 -176.384 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -124.15 144.18 44.68 Favored Pre-proline 0 N--CA 1.467 0.38 0 CA-C-N 118.777 0.717 . . . . 0.0 109.892 177.11 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -72.99 -34.25 6.65 Favored 'Trans proline' 0 N--CA 1.456 -0.727 0 C-N-CA 122.263 1.975 . . . . 0.0 114.271 -177.366 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -77.65 -27.59 51.04 Favored 'General case' 0 CA--C 1.517 -0.323 0 CA-C-N 120.043 1.292 . . . . 0.0 112.617 172.791 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -134.08 83.66 2.06 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 106.833 -1.543 . . . . 0.0 106.833 -153.522 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -60.23 -6.77 1.59 Allowed 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 126.167 1.787 . . . . 0.0 114.18 -165.754 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 39.1 m-85 -65.04 123.57 19.82 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 123.956 0.902 . . . . 0.0 110.048 171.766 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 38.8 m-85 -75.44 152.86 37.9 Favored 'General case' 0 N--CA 1.45 -0.451 0 N-CA-C 108.688 -0.856 . . . . 0.0 108.688 174.046 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 9.0 t80 -114.42 109.12 17.83 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 126.099 1.76 . . . . 0.0 106.641 -177.885 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 44.7 t30 -83.62 77.15 9.9 Favored 'General case' 0 N--CA 1.445 -0.688 0 C-N-CA 125.272 1.429 . . . . 0.0 107.357 171.129 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -52.18 -33.14 39.37 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 123.017 0.527 . . . . 0.0 110.32 178.667 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -47.78 -32.04 5.55 Favored 'General case' 0 N--CA 1.448 -0.548 0 C-N-CA 127.663 2.385 . . . . 0.0 114.74 178.069 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 19.9 m -138.36 25.96 2.64 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 123.851 0.86 . . . . 0.0 110.039 170.12 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 24.5 mt-30 52.35 18.44 0.92 Allowed 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 127.503 2.321 . . . . 0.0 114.893 -176.859 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -95.52 159.58 14.92 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 123.638 0.775 . . . . 0.0 110.535 -166.942 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 9.5 m-85 -114.12 127.15 55.78 Favored 'General case' 0 CA--C 1.516 -0.358 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 -169.947 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 53.2 mt -126.53 174.63 8.51 Favored 'General case' 0 C--N 1.324 -0.54 0 C-N-CA 124.415 1.086 . . . . 0.0 108.691 -170.066 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 13.5 p90 -134.59 153.49 51.94 Favored 'General case' 0 N--CA 1.447 -0.608 0 N-CA-C 106.881 -1.526 . . . . 0.0 106.881 162.072 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 46.9 t-105 -78.28 127.69 32.61 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 105.713 -1.958 . . . . 0.0 105.713 164.703 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 19.9 t0 -110.24 108.78 19.02 Favored 'General case' 0 CA--C 1.515 -0.378 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 166.475 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -72.57 -15.39 77.57 Favored Glycine 0 N--CA 1.441 -1.003 0 CA-C-O 116.84 -2.089 . . . . 0.0 112.831 176.266 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -69.87 -56.18 7.76 Favored 'General case' 0 C--N 1.346 0.442 0 CA-C-N 121.021 2.411 . . . . 0.0 107.596 176.667 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 62.3 mtt85 -80.96 -3.97 53.41 Favored 'General case' 0 N--CA 1.456 -0.136 0 C-N-CA 124.047 0.939 . . . . 0.0 113.148 178.937 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 42.0 mtt180 43.36 58.18 3.52 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 126.982 2.113 . . . . 0.0 109.7 -175.276 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 6.2 t -153.88 157.45 39.29 Favored 'General case' 0 N--CA 1.448 -0.563 0 N-CA-C 107.143 -1.428 . . . . 0.0 107.143 176.759 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 71.7 m-85 -86.88 132.07 33.92 Favored 'General case' 0 C--O 1.237 0.398 0 N-CA-C 106.202 -1.777 . . . . 0.0 106.202 169.662 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -125.8 154.48 73.38 Favored Pre-proline 0 C--N 1.322 -0.627 0 C-N-CA 125.124 1.37 . . . . 0.0 110.391 -176.682 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -72.22 130.3 16.21 Favored 'Trans proline' 0 N--CA 1.454 -0.834 0 C-N-CA 122.523 2.149 . . . . 0.0 110.253 -178.112 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.235 0.297 0 N-CA-C 112.992 0.738 . . . . 0.0 112.992 -178.539 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 36.6 m-85 . . . . . 0 CA--C 1.539 0.52 0 CA-C-O 119.119 -0.467 . . . . 0.0 110.0 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -66.09 169.55 13.37 Favored 'Trans proline' 0 C--N 1.349 0.57 0 C-N-CA 123.78 2.987 . . . . 0.0 109.828 172.803 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 38.8 t -111.94 85.4 6.42 Favored Pre-proline 0 CA--C 1.539 0.547 0 N-CA-C 107.659 -1.237 . . . . 0.0 107.659 177.668 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -72.92 178.38 6.52 Favored 'Trans proline' 0 N--CA 1.457 -0.643 0 C-N-CA 123.669 2.913 . . . . 0.0 111.035 177.285 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -159.3 32.21 0.2 Allowed 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 113.367 0.877 . . . . 0.0 113.367 -177.285 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . 0.373 11.9 p 42.88 23.25 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.553 1.08 0 C-N-CA 128.072 2.549 . . . . 0.0 113.085 -173.805 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 7.5 t -113.51 -12.73 12.88 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 127.795 2.438 . . . . 0.0 109.287 -174.746 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 2.8 p -112.7 1.57 15.73 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 124.516 1.127 . . . . 0.0 111.08 -179.945 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 11.5 m-30 -85.0 173.27 10.65 Favored 'General case' 0 C--N 1.341 0.235 0 C-N-CA 124.597 1.159 . . . . 0.0 111.344 -167.294 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 68.5 mt-30 -119.89 99.1 6.43 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 126.023 1.729 . . . . 0.0 108.541 -174.297 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 87.1 t80 -58.18 143.82 42.83 Favored 'General case' 0 C--N 1.326 -0.422 0 O-C-N 122.302 -0.249 . . . . 0.0 111.012 171.246 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 4.1 t0 -122.64 112.68 18.26 Favored 'General case' 0 CA--C 1.515 -0.379 0 C-N-CA 123.902 0.881 . . . . 0.0 109.802 172.716 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -63.46 -19.36 64.66 Favored 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 124.794 1.238 . . . . 0.0 112.974 176.875 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 3.2 t -59.48 -32.81 70.61 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 123.445 0.698 . . . . 0.0 111.643 176.62 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 66.6 m -132.6 -20.54 2.3 Favored 'General case' 0 N--CA 1.462 0.162 0 C-N-CA 123.953 0.901 . . . . 0.0 112.209 -173.781 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 86.83 10.9 71.6 Favored Glycine 0 CA--C 1.526 0.737 0 C-N-CA 124.084 0.849 . . . . 0.0 111.942 -179.684 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 5.0 m-85 -96.87 168.74 10.3 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-N 118.429 1.115 . . . . 0.0 108.438 -177.313 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 93.8 m-85 -100.94 141.18 34.2 Favored 'General case' 0 N--CA 1.45 -0.44 0 N-CA-C 107.404 -1.332 . . . . 0.0 107.404 171.205 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 39.0 t80 -107.6 139.79 41.59 Favored 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 125.532 1.533 . . . . 0.0 107.634 175.03 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 62.3 t0 -104.1 87.27 1.53 Allowed Pre-proline 0 C--N 1.328 -0.347 0 C-N-CA 126.108 1.763 . . . . 0.0 111.672 -178.734 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -61.5 -12.48 24.61 Favored 'Trans proline' 0 N--CA 1.457 -0.659 0 C-N-CA 122.505 2.137 . . . . 0.0 114.289 176.959 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 22.4 mm-40 -72.7 -30.12 63.95 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-N 119.205 0.911 . . . . 0.0 110.599 178.65 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 22.0 p -120.54 -50.28 2.21 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 124.657 1.183 . . . . 0.0 109.276 -166.947 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 101.12 46.11 1.77 Allowed Glycine 0 CA--C 1.525 0.709 0 N-CA-C 108.995 -1.642 . . . . 0.0 108.995 -168.68 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 20.9 mt -126.57 171.19 11.31 Favored 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 125.384 1.474 . . . . 0.0 109.295 176.682 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 51.0 m-85 -114.69 164.79 13.56 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 124.69 1.196 . . . . 0.0 108.672 166.18 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 50.3 t80 -145.64 152.11 39.13 Favored 'General case' 0 C--O 1.239 0.518 0 C-N-CA 126.873 2.069 . . . . 0.0 107.576 179.025 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -121.9 143.83 39.54 Favored Pre-proline 0 CA--C 1.535 0.39 0 C-N-CA 123.421 0.689 . . . . 0.0 109.636 175.219 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo -76.33 -25.68 9.62 Favored 'Trans proline' 0 N--CA 1.458 -0.593 0 C-N-CA 121.953 1.768 . . . . 0.0 113.236 -176.093 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 26.8 m-20 -90.9 -21.21 21.51 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 119.538 1.063 . . . . 0.0 112.676 175.262 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 86.4 p -129.26 91.12 3.13 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 123.861 0.864 . . . . 0.0 109.597 179.406 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -56.02 -5.96 0.21 Allowed 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 128.71 2.804 . . . . 0.0 115.63 -171.71 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 54.5 m-85 -68.95 158.47 34.6 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 123.861 0.864 . . . . 0.0 108.851 172.755 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 31.6 m-85 -105.26 133.16 50.48 Favored 'General case' 0 N--CA 1.449 -0.518 0 N-CA-C 108.286 -1.005 . . . . 0.0 108.286 179.788 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 74.6 t80 -90.28 118.18 29.59 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 107.982 -1.118 . . . . 0.0 107.982 175.517 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 20.9 t30 -96.49 86.2 4.09 Favored 'General case' 0 N--CA 1.442 -0.831 0 C-N-CA 126.328 1.851 . . . . 0.0 107.941 179.08 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -50.3 -36.27 31.03 Favored 'General case' 0 N--CA 1.463 0.223 0 C-N-CA 123.957 0.903 . . . . 0.0 111.544 179.584 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 3.8 tt0 -47.19 -37.97 11.15 Favored 'General case' 0 N--CA 1.446 -0.633 0 C-N-CA 127.284 2.234 . . . . 0.0 113.126 -176.764 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 13.6 m -135.79 24.3 3.36 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 124.588 1.155 . . . . 0.0 109.76 176.422 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . 0.364 4.6 pt20 44.65 23.72 0.08 Allowed 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 129.052 2.941 . . . . 0.0 114.403 -175.36 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -92.43 172.18 8.56 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 126.507 1.923 . . . . 0.0 111.361 -171.186 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 4.9 m-85 -118.28 131.55 56.34 Favored 'General case' 0 N--CA 1.45 -0.428 0 N-CA-C 106.965 -1.495 . . . . 0.0 106.965 -177.77 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 48.9 mt -125.92 176.69 6.8 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 126.156 1.782 . . . . 0.0 107.859 -177.063 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 13.9 p90 -139.83 149.35 43.36 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 107.706 -1.22 . . . . 0.0 107.706 168.274 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 39.7 t-105 -78.13 127.19 31.92 Favored 'General case' 0 C--O 1.239 0.506 0 N-CA-C 107.46 -1.311 . . . . 0.0 107.46 172.277 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -120.81 86.88 2.65 Favored 'General case' 0 CA--C 1.512 -0.496 0 CA-C-O 121.631 0.729 . . . . 0.0 109.516 -179.634 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -58.71 -19.33 42.33 Favored Glycine 0 CA--C 1.526 0.778 0 CA-C-O 118.648 -1.085 . . . . 0.0 111.996 175.891 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -59.6 -34.75 73.14 Favored 'General case' 0 C--N 1.342 0.28 0 CA-C-N 118.989 1.395 . . . . 0.0 109.368 176.553 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 21.6 mtt180 -121.77 -1.55 9.44 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 127.232 2.213 . . . . 0.0 111.509 -171.997 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 60.1 mtt180 44.26 54.39 6.16 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 127.715 2.406 . . . . 0.0 111.489 -171.17 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 10.2 t -148.68 175.56 11.1 Favored 'General case' 0 C--N 1.328 -0.357 0 O-C-N 122.047 -0.408 . . . . 0.0 109.947 175.473 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 87.9 m-85 -98.96 134.78 41.32 Favored 'General case' 0 C--O 1.237 0.405 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 168.149 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -126.44 154.81 75.05 Favored Pre-proline 0 C--N 1.322 -0.627 0 C-N-CA 125.667 1.587 . . . . 0.0 109.359 176.841 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_endo -76.65 122.46 6.43 Favored 'Trans proline' 0 N--CA 1.46 -0.499 0 C-N-CA 123.099 2.533 . . . . 0.0 112.26 -174.276 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 0.335 0 C-N-CA 124.691 1.196 . . . . 0.0 112.999 -178.219 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 32.6 m-85 . . . . . 0 CA--C 1.532 0.282 0 N-CA-C 109.979 -0.378 . . . . 0.0 109.979 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 95.5 Cg_endo -67.91 177.7 4.06 Favored 'Trans proline' 0 N--CA 1.454 -0.834 0 C-N-CA 121.782 1.654 . . . . 0.0 109.023 161.282 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 45.7 t -104.71 86.27 1.4 Allowed Pre-proline 0 CA--C 1.537 0.46 0 C-N-CA 124.27 1.028 . . . . 0.0 109.162 -173.093 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_endo -69.62 153.69 69.25 Favored 'Trans proline' 0 N--CA 1.456 -0.694 0 C-N-CA 122.015 1.81 . . . . 0.0 110.386 -178.302 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -136.3 133.17 36.63 Favored 'General case' 0 C--O 1.235 0.305 0 C-N-CA 123.193 0.597 . . . . 0.0 111.808 -176.231 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.401 ' HA ' ' CD2' ' A' ' 18' ' ' TYR . 10.8 p -56.62 -25.95 22.33 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.407 0 C-N-CA 125.382 1.473 . . . . 0.0 113.544 -178.968 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 2.0 t -61.8 -12.3 16.52 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.999 0.919 . . . . 0.0 112.039 174.576 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 37.0 p -113.41 1.06 14.96 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.633 1.173 . . . . 0.0 111.723 -179.648 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . 0.401 ' CD2' ' HA ' ' A' ' 15' ' ' VAL . 15.3 m-30 -79.77 166.56 21.62 Favored 'General case' 0 C--O 1.238 0.499 0 O-C-N 120.858 -1.151 . . . . 0.0 110.159 179.984 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 28.0 mt-30 -105.31 112.55 25.7 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 124.728 1.211 . . . . 0.0 108.573 175.356 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 61.5 t80 -61.34 137.66 58.24 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 108.558 -0.904 . . . . 0.0 108.558 169.86 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 22.2 t0 -117.74 70.44 0.79 Allowed 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 125.932 1.693 . . . . 0.0 109.436 -172.389 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.55 -3.79 1.63 Allowed 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 115.527 1.677 . . . . 0.0 115.527 -169.224 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 1.3 t -65.94 -27.17 67.97 Favored 'General case' 0 C--N 1.315 -0.897 0 C-N-CA 126.659 1.984 . . . . 0.0 111.795 164.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 25.0 p -127.78 -25.83 3.04 Favored 'General case' 0 C--O 1.237 0.419 0 CA-C-N 120.169 1.35 . . . . 0.0 112.464 174.914 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 96.64 9.5 56.39 Favored Glycine 0 CA--C 1.533 1.201 0 CA-C-N 118.737 0.698 . . . . 0.0 112.39 177.206 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 8.3 m-85 -100.58 177.29 5.05 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.774 1.63 . . . . 0.0 109.1 178.119 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 77.9 m-85 -101.59 139.55 37.1 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 106.997 -1.483 . . . . 0.0 106.997 166.698 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 17.4 t80 -101.97 135.62 43.21 Favored 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 125.827 1.651 . . . . 0.0 107.099 172.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -110.55 85.08 4.42 Favored Pre-proline 0 N--CA 1.442 -0.863 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 -171.004 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_endo -61.36 -13.5 29.25 Favored 'Trans proline' 0 C--N 1.348 0.511 0 C-N-CA 122.388 2.059 . . . . 0.0 113.362 -179.919 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 98.6 mm-40 -60.64 -28.96 68.95 Favored 'General case' 0 N--CA 1.448 -0.567 0 C-N-CA 124.877 1.271 . . . . 0.0 111.423 178.697 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 12.6 p -145.96 -18.17 0.45 Allowed 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 113.664 0.987 . . . . 0.0 113.664 -176.745 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 99.53 7.57 53.71 Favored Glycine 0 CA--C 1.531 1.059 0 CA-C-N 119.446 1.021 . . . . 0.0 114.065 179.23 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 40.0 mt -85.69 179.51 7.07 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 124.847 1.259 . . . . 0.0 109.612 175.249 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 25.0 m-85 -118.91 159.79 23.14 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 124.329 1.052 . . . . 0.0 109.35 162.815 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 71.1 t80 -127.19 165.68 19.15 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 128.402 2.681 . . . . 0.0 109.128 173.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 6.1 t0 -137.77 144.1 42.97 Favored Pre-proline 0 N--CA 1.465 0.283 0 O-C-N 120.735 -1.228 . . . . 0.0 108.294 177.829 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 68.9 Cg_endo -71.62 -30.49 14.69 Favored 'Trans proline' 0 N--CA 1.454 -0.808 0 C-N-CA 121.354 1.37 . . . . 0.0 113.422 -175.281 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 77.2 m-20 -87.77 -28.53 21.65 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 125.139 1.375 . . . . 0.0 110.483 175.411 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 1.6 m -117.76 95.47 4.94 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 123.775 0.83 . . . . 0.0 109.572 -176.084 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 20.4 mp0 -62.18 -2.79 1.05 Allowed 'General case' 0 CA--C 1.547 0.843 0 O-C-N 121.387 -0.821 . . . . 0.0 111.758 166.676 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 17.8 m-85 -70.57 98.87 1.55 Allowed 'General case' 0 N--CA 1.444 -0.736 0 C-N-CA 125.39 1.476 . . . . 0.0 107.538 162.736 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 34.3 m-85 -59.27 153.85 17.73 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 125.204 1.402 . . . . 0.0 110.072 175.418 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 76.8 t80 -110.19 113.45 26.14 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 125.011 1.324 . . . . 0.0 108.514 177.826 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 38.7 t30 -87.45 81.58 7.77 Favored 'General case' 0 N--CA 1.445 -0.695 0 C-N-CA 125.22 1.408 . . . . 0.0 108.888 177.553 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -44.9 -38.46 4.66 Favored 'General case' 0 C--N 1.341 0.202 0 C-N-CA 124.273 1.029 . . . . 0.0 111.723 176.07 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 4.4 tt0 -44.41 -38.85 4.29 Favored 'General case' 0 N--CA 1.446 -0.626 0 C-N-CA 127.843 2.457 . . . . 0.0 113.054 -177.376 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 70.8 m -136.61 16.17 3.13 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 124.305 1.042 . . . . 0.0 111.726 176.852 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 25.7 mt-30 58.77 14.89 3.44 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 126.855 2.062 . . . . 0.0 113.494 -173.297 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 41.2 mm-40 -77.31 167.06 22.34 Favored 'General case' 0 C--N 1.334 -0.07 0 O-C-N 121.139 -0.976 . . . . 0.0 111.459 -177.209 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 37.0 m-85 -114.27 132.8 56.02 Favored 'General case' 0 C--O 1.236 0.347 0 C-N-CA 124.145 0.978 . . . . 0.0 109.97 172.141 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 66.6 mt -129.81 179.91 5.57 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 126.55 1.94 . . . . 0.0 108.801 -173.609 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 23.6 p90 -144.64 157.98 43.97 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 124.012 0.925 . . . . 0.0 109.685 165.425 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 54.5 t-105 -89.18 125.49 35.08 Favored 'General case' 0 C--O 1.237 0.434 0 N-CA-C 107.121 -1.437 . . . . 0.0 107.121 170.276 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -120.99 108.69 14.18 Favored 'General case' 0 CA--C 1.516 -0.328 0 CA-C-O 121.304 0.573 . . . . 0.0 110.578 177.557 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -72.6 -1.75 53.84 Favored Glycine 0 CA--C 1.526 0.723 0 CA-C-O 117.99 -1.45 . . . . 0.0 114.294 -172.792 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 2.9 pt-20 -76.23 -54.49 6.72 Favored 'General case' 0 C--N 1.339 0.138 0 CA-C-N 120.072 1.936 . . . . 0.0 110.255 171.511 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 13.0 mtt180 -88.42 -8.11 55.51 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 124.17 0.988 . . . . 0.0 110.567 -177.856 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 3.3 mpt_? 44.88 59.46 3.41 Favored 'General case' 0 C--N 1.342 0.263 0 C-N-CA 125.988 1.715 . . . . 0.0 109.321 -174.326 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 8.4 t -148.88 179.49 7.81 Favored 'General case' 0 C--O 1.238 0.457 0 N-CA-C 108.766 -0.828 . . . . 0.0 108.766 175.917 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 72.0 m-85 -104.32 132.29 50.74 Favored 'General case' 0 C--O 1.241 0.641 0 C-N-CA 123.878 0.871 . . . . 0.0 109.656 172.853 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -127.57 154.96 77.62 Favored Pre-proline 0 C--N 1.326 -0.421 0 C-N-CA 126.638 1.975 . . . . 0.0 110.631 -178.671 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_endo -70.12 131.18 20.2 Favored 'Trans proline' 0 CA--C 1.534 0.5 0 C-N-CA 123.321 2.681 . . . . 0.0 111.732 174.483 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 0.281 0 C-N-CA 124.729 1.211 . . . . 0.0 108.981 178.693 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 18.4 m-85 . . . . . 0 CA--C 1.543 0.68 0 CA-C-O 119.124 -0.465 . . . . 0.0 110.161 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 79.0 Cg_endo -73.53 -174.31 1.61 Allowed 'Trans proline' 0 CA--C 1.539 0.726 0 C-N-CA 123.989 3.126 . . . . 0.0 111.619 176.396 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 21.2 t -106.93 86.54 2.43 Favored Pre-proline 0 CA--C 1.532 0.276 0 C-N-CA 125.56 1.544 . . . . 0.0 108.452 176.589 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 91.7 Cg_endo -66.66 159.06 52.81 Favored 'Trans proline' 0 N--CA 1.457 -0.67 0 C-N-CA 122.161 1.907 . . . . 0.0 109.335 173.754 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.2 t0 -131.02 134.3 46.56 Favored 'General case' 0 C--O 1.234 0.249 0 N-CA-C 108.333 -0.988 . . . . 0.0 108.333 171.133 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.497 ' HA ' ' CD2' ' A' ' 18' ' ' TYR . 2.9 p -57.02 -25.18 22.0 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.472 0 C-N-CA 123.999 0.92 . . . . 0.0 111.864 178.002 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 56.6 m -59.08 -20.04 49.74 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 119.305 0.957 . . . . 0.0 113.51 173.222 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 12.2 p -119.07 16.33 13.28 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 119.805 1.184 . . . . 0.0 111.914 -176.761 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . 0.497 ' CD2' ' HA ' ' A' ' 15' ' ' VAL . 20.2 m-30 -71.89 159.57 34.05 Favored 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 160.614 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 26.4 mt-30 -111.12 114.6 27.98 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 125.787 1.635 . . . . 0.0 111.788 177.479 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 49.5 t80 -67.08 156.76 35.27 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 120.618 1.554 . . . . 0.0 113.341 -177.654 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -129.47 102.98 6.63 Favored 'General case' 0 C--N 1.342 0.273 0 N-CA-C 107.561 -1.274 . . . . 0.0 107.561 166.075 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -52.75 -29.89 29.72 Favored 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 124.795 1.238 . . . . 0.0 112.063 171.368 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 1.4 t -67.1 -20.73 65.83 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-O 117.899 -1.048 . . . . 0.0 111.987 -174.461 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 72.9 m -136.0 -9.79 2.04 Favored 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 113.795 1.035 . . . . 0.0 113.795 177.505 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 81.54 6.3 89.27 Favored Glycine 0 CA--C 1.526 0.721 0 C-N-CA 124.469 1.033 . . . . 0.0 114.007 169.243 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 5.3 m-85 -97.97 169.26 9.76 Favored 'General case' 0 C--O 1.238 0.485 0 CA-C-N 118.328 1.064 . . . . 0.0 108.746 174.819 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 56.5 m-85 -104.04 140.26 38.0 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 125.799 1.639 . . . . 0.0 108.33 175.379 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 41.6 t80 -107.58 142.42 37.53 Favored 'General case' 0 CA--C 1.512 -0.497 0 N-CA-C 107.386 -1.339 . . . . 0.0 107.386 179.666 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 11.8 m-20 -117.4 78.02 10.64 Favored Pre-proline 0 N--CA 1.441 -0.913 0 N-CA-C 107.71 -1.219 . . . . 0.0 107.71 -160.753 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 22.3 Cg_endo -64.57 -4.69 8.74 Favored 'Trans proline' 0 C--N 1.348 0.513 0 C-N-CA 124.044 3.163 . . . . 0.0 113.989 -173.706 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 99.6 mm-40 -71.89 -24.37 61.64 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-O 118.823 -0.608 . . . . 0.0 111.008 172.421 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 1.1 p -143.57 -15.9 0.64 Allowed 'General case' 0 CA--C 1.532 0.274 0 N-CA-C 114.747 1.388 . . . . 0.0 114.747 -176.061 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 89.69 12.25 62.76 Favored Glycine 0 CA--C 1.531 1.043 0 CA-C-N 119.848 1.204 . . . . 0.0 113.563 -176.198 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 55.0 mt -88.83 178.83 6.34 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.574 1.149 . . . . 0.0 109.256 178.253 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 39.3 m-85 -124.19 149.74 46.0 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 123.577 0.751 . . . . 0.0 109.164 163.583 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 41.0 t80 -118.39 150.26 39.85 Favored 'General case' 0 C--O 1.24 0.56 0 C-N-CA 126.822 2.049 . . . . 0.0 109.628 178.0 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -116.85 143.54 31.69 Favored Pre-proline 0 CA--C 1.537 0.477 0 C-N-CA 123.444 0.698 . . . . 0.0 109.516 171.784 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_endo -81.51 -22.43 5.61 Favored 'Trans proline' 0 N--CA 1.458 -0.617 0 C-N-CA 122.509 2.139 . . . . 0.0 114.922 -174.098 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 56.5 m-80 -77.38 -40.66 42.99 Favored 'General case' 0 N--CA 1.445 -0.681 0 O-C-N 120.915 -1.116 . . . . 0.0 108.675 164.406 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 38.5 m -124.54 95.61 4.59 Favored 'General case' 0 N--CA 1.452 -0.375 0 CA-C-O 122.028 0.918 . . . . 0.0 110.536 -156.965 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 20.2 mp0 -62.55 3.62 0.2 Allowed 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 125.758 1.623 . . . . 0.0 113.871 -174.388 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 19.0 m-85 -79.41 98.63 6.84 Favored 'General case' 0 N--CA 1.438 -1.034 0 C-N-CA 125.333 1.453 . . . . 0.0 108.17 -179.604 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 48.6 m-85 -59.17 120.25 8.84 Favored 'General case' 0 N--CA 1.445 -0.7 0 C-N-CA 125.706 1.603 . . . . 0.0 109.014 177.949 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 79.5 t80 -78.65 138.52 38.35 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 124.242 1.017 . . . . 0.0 108.385 176.77 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 24.4 t30 -116.65 85.79 2.38 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 127.033 2.133 . . . . 0.0 107.256 175.025 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -45.41 -40.26 7.93 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 127.65 2.38 . . . . 0.0 111.736 178.004 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -44.63 -41.74 6.88 Favored 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 127.397 2.279 . . . . 0.0 112.704 179.823 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 4.0 m -129.87 14.21 5.82 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 125.495 1.518 . . . . 0.0 109.774 -176.723 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . 0.411 4.5 pt20 44.38 30.64 0.49 Allowed 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 128.732 2.813 . . . . 0.0 113.989 -172.745 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -90.77 162.83 14.69 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 127.402 2.281 . . . . 0.0 110.633 -169.435 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 3.4 m-85 -110.44 131.8 54.74 Favored 'General case' 0 C--O 1.233 0.234 0 C-N-CA 124.558 1.143 . . . . 0.0 108.991 174.019 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 60.7 mt -128.67 178.08 6.58 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 126.91 2.084 . . . . 0.0 108.218 -178.129 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 9.6 p90 -138.03 148.38 45.05 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 106.807 -1.553 . . . . 0.0 106.807 166.922 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 43.8 t-105 -71.96 136.92 46.97 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 105.42 -2.067 . . . . 0.0 105.42 162.412 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -131.07 95.85 3.9 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 178.403 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -71.25 -5.5 59.26 Favored Glycine 0 CA--C 1.528 0.851 0 CA-C-O 118.722 -1.043 . . . . 0.0 112.538 -178.373 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -71.9 -58.77 3.17 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 119.496 1.648 . . . . 0.0 107.096 173.182 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 75.6 mtt-85 -80.36 -18.54 48.74 Favored 'General case' 0 C--O 1.232 0.173 0 C-N-CA 125.381 1.472 . . . . 0.0 112.636 -179.804 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 97.6 mtt180 55.93 58.84 4.12 Favored 'General case' 0 C--O 1.234 0.239 0 C-N-CA 127.094 2.157 . . . . 0.0 109.457 -173.912 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 6.2 t -155.22 -177.69 6.72 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 125.195 1.398 . . . . 0.0 108.55 175.045 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 76.0 m-85 -112.61 129.9 56.22 Favored 'General case' 0 C--O 1.238 0.477 0 C-N-CA 124.321 1.048 . . . . 0.0 108.791 172.462 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -126.29 154.74 74.66 Favored Pre-proline 0 C--N 1.326 -0.441 0 C-N-CA 126.4 1.88 . . . . 0.0 110.499 -171.53 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_endo -75.28 124.84 8.74 Favored 'Trans proline' 0 C--N 1.348 0.506 0 C-N-CA 122.927 2.418 . . . . 0.0 111.204 -178.299 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.411 0 N-CA-C 115.896 1.813 . . . . 0.0 115.896 -167.18 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 33.7 m-85 . . . . . 0 CA--C 1.538 0.509 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_endo -65.68 -171.4 0.21 Allowed 'Trans proline' 0 CA--C 1.537 0.646 0 C-N-CA 122.695 2.263 . . . . 0.0 110.339 164.031 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 61.7 t -104.92 87.29 1.79 Allowed Pre-proline 0 C--N 1.329 -0.304 0 N-CA-C 106.646 -1.612 . . . . 0.0 106.646 171.961 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.408 ' HD2' ' CZ2' ' A' ' 54' ' ' TRP . 96.8 Cg_endo -64.15 156.23 60.41 Favored 'Trans proline' 0 N--CA 1.451 -1.005 0 C-N-CA 122.226 1.951 . . . . 0.0 110.05 -177.547 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -135.12 129.29 33.67 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 123.898 0.879 . . . . 0.0 109.064 177.926 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 9.1 p -63.94 -26.44 40.56 Favored 'Isoleucine or valine' 0 C--O 1.234 0.266 0 C-N-CA 124.586 1.154 . . . . 0.0 111.531 178.758 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 41.5 m -69.6 1.77 3.82 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 119.908 1.231 . . . . 0.0 112.726 -178.103 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 7.0 t -125.9 11.0 7.7 Favored 'General case' 0 CA--C 1.545 0.777 0 O-C-N 120.899 -1.125 . . . . 0.0 111.773 169.757 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 15.0 m-30 -70.02 159.48 33.73 Favored 'General case' 0 C--O 1.24 0.581 0 O-C-N 120.525 -1.359 . . . . 0.0 111.694 172.346 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 54.6 mt-30 -82.59 135.07 35.16 Favored 'General case' 0 C--O 1.225 -0.234 0 N-CA-C 107.1 -1.444 . . . . 0.0 107.1 167.292 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 45.7 t80 -75.81 164.57 26.1 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 118.796 0.726 . . . . 0.0 109.145 160.246 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -143.04 108.82 5.13 Favored 'General case' 0 CA--C 1.51 -0.596 0 N-CA-C 108.868 -0.79 . . . . 0.0 108.868 159.696 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -59.72 -19.81 52.4 Favored 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 113.154 0.798 . . . . 0.0 113.154 174.628 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 1.4 t -55.29 -35.61 65.25 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 123.59 0.756 . . . . 0.0 110.694 -179.964 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 15.8 m -114.21 -28.06 7.42 Favored 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 125.147 1.379 . . . . 0.0 110.663 173.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 87.19 25.09 34.89 Favored Glycine 0 CA--C 1.528 0.898 0 N-CA-C 110.318 -1.113 . . . . 0.0 110.318 -173.432 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 6.7 m-85 -117.97 175.25 5.76 Favored 'General case' 0 C--O 1.232 0.176 0 C-N-CA 126.103 1.761 . . . . 0.0 107.776 -170.807 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -110.4 151.19 27.78 Favored 'General case' 0 CA--C 1.521 -0.157 0 N-CA-C 109.084 -0.71 . . . . 0.0 109.084 172.77 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 44.7 t80 -118.81 137.84 53.11 Favored 'General case' 0 N--CA 1.446 -0.633 0 C-N-CA 127.612 2.365 . . . . 0.0 107.79 179.761 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 37.3 t0 -106.95 86.22 2.29 Favored Pre-proline 0 C--N 1.33 -0.268 0 C-N-CA 126.129 1.772 . . . . 0.0 111.28 -175.612 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 22.9 Cg_endo -60.81 -14.25 31.13 Favored 'Trans proline' 0 CA--C 1.537 0.664 0 C-N-CA 121.903 1.735 . . . . 0.0 113.798 177.918 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 4.7 tt0 -67.81 -16.33 64.06 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 119.399 0.999 . . . . 0.0 111.276 176.731 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 40.1 p -131.48 -63.12 0.85 Allowed 'General case' 0 N--CA 1.447 -0.612 0 C-N-CA 125.271 1.428 . . . . 0.0 107.896 177.351 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 124.5 12.61 4.12 Favored Glycine 0 CA--C 1.531 1.05 0 C-N-CA 127.041 2.258 . . . . 0.0 112.025 -167.65 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 32.0 mt -87.22 175.59 7.97 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 126.119 1.768 . . . . 0.0 109.85 176.964 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 42.7 m-85 -117.42 167.41 11.29 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 125.097 1.359 . . . . 0.0 109.617 166.775 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 31.3 t80 -144.66 156.27 44.02 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 128.158 2.583 . . . . 0.0 108.345 -179.565 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 42.6 t0 -126.17 142.33 42.34 Favored Pre-proline 0 N--CA 1.473 0.722 0 N-CA-C 107.716 -1.216 . . . . 0.0 107.716 175.287 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 41.5 Cg_endo -73.15 -38.9 2.45 Favored 'Trans proline' 0 C--N 1.345 0.391 0 CA-C-N 120.952 1.376 . . . . 0.0 112.826 -176.15 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 30.5 m-20 -75.69 -25.66 56.91 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-O 118.533 -0.746 . . . . 0.0 111.383 -178.416 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 67.2 m -131.73 94.38 3.5 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 125.809 1.643 . . . . 0.0 109.434 -174.715 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 12.1 mp0 -59.43 -3.12 0.39 Allowed 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.974 1.31 . . . . 0.0 114.163 -178.119 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 68.4 m-85 -61.25 111.07 1.59 Allowed 'General case' 0 N--CA 1.446 -0.632 0 CA-C-N 119.189 0.904 . . . . 0.0 108.887 171.934 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 30.4 m-85 -62.1 153.63 29.38 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 123.519 0.727 . . . . 0.0 109.45 174.744 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 68.8 t80 -119.69 117.55 28.56 Favored 'General case' 0 N--CA 1.443 -0.811 0 CA-C-O 122.476 1.131 . . . . 0.0 108.802 -179.325 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 21.2 t30 -95.95 89.7 5.32 Favored 'General case' 0 N--CA 1.442 -0.863 0 C-N-CA 125.715 1.606 . . . . 0.0 107.354 175.252 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -48.1 -42.24 28.4 Favored 'General case' 0 CA--C 1.529 0.157 0 C-N-CA 124.838 1.255 . . . . 0.0 112.169 174.819 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -44.49 -48.64 10.11 Favored 'General case' 0 N--CA 1.448 -0.572 0 C-N-CA 126.213 1.805 . . . . 0.0 112.232 -175.621 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -118.43 12.78 13.39 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 125.207 1.403 . . . . 0.0 110.507 -177.052 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 31.2 mt-30 44.24 45.72 7.23 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 128.646 2.778 . . . . 0.0 112.755 -175.925 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -117.24 143.65 45.66 Favored 'General case' 0 N--CA 1.448 -0.557 0 C-N-CA 125.483 1.513 . . . . 0.0 110.233 -171.504 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.647 ' C ' HD23 ' A' ' 52' ' ' LEU . 58.3 m-85 -101.73 132.29 47.53 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 123.441 0.696 . . . . 0.0 111.704 176.432 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.647 HD23 ' C ' ' A' ' 51' ' ' TYR . 1.1 mt -135.87 -177.89 4.89 Favored 'General case' 0 C--N 1.323 -0.555 0 C-N-CA 126.779 2.031 . . . . 0.0 108.739 -165.414 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . 0.474 ' CE2' HG23 ' A' ' 62' ' ' VAL . 25.7 p90 -135.02 164.76 26.91 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 124.179 0.992 . . . . 0.0 109.219 173.182 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' TRP . . . . . 0.408 ' CZ2' ' HD2' ' A' ' 13' ' ' PRO . 21.4 t-105 -109.23 137.82 46.53 Favored 'General case' 0 CA--C 1.504 -0.794 0 C-N-CA 125.955 1.702 . . . . 0.0 108.501 172.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 22.7 p-10 -133.56 77.29 1.71 Allowed 'General case' 0 N--CA 1.42 -1.958 0 C-N-CA 126.822 2.049 . . . . 0.0 107.208 -171.163 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -61.03 1.09 0.91 Allowed Glycine 0 CA--C 1.53 1.018 0 C-N-CA 125.025 1.298 . . . . 0.0 114.538 179.288 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 14.9 mt-10 -69.72 -63.32 1.1 Allowed 'General case' 0 N--CA 1.444 -0.754 0 N-CA-C 106.552 -1.647 . . . . 0.0 106.552 171.789 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 82.4 mtt180 -72.91 -23.15 60.67 Favored 'General case' 0 C--O 1.226 -0.146 0 C-N-CA 127.157 2.183 . . . . 0.0 111.323 173.929 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 52.9 mtt85 56.24 69.83 0.7 Allowed 'General case' 0 C--O 1.232 0.151 0 C-N-CA 126.295 1.838 . . . . 0.0 109.456 -162.861 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 6.8 t -144.24 -175.11 4.49 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 118.385 0.539 . . . . 0.0 110.194 170.165 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 91.3 m-85 -120.54 129.1 53.66 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 107.101 -1.444 . . . . 0.0 107.101 164.351 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.474 HG23 ' CE2' ' A' ' 53' ' ' TYR . 0.0 OUTLIER -126.22 154.92 74.49 Favored Pre-proline 0 C--N 1.325 -0.458 0 C-N-CA 125.95 1.7 . . . . 0.0 113.068 -175.763 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . 0.585 ' HA ' HD22 ' A' ' 52' ' ' LEU . 71.5 Cg_endo -80.42 132.15 8.91 Favored 'Trans proline' 0 N--CA 1.443 -1.467 0 C-N-CA 121.355 1.37 . . . . 0.0 112.36 -171.907 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.571 0 C-N-CA 123.832 0.853 . . . . 0.0 113.118 -172.704 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 61.2 m-85 . . . . . 0 C--O 1.241 0.637 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 68.2 Cg_endo -67.67 -175.33 0.71 Allowed 'Trans proline' 0 CA--C 1.538 0.687 0 C-N-CA 123.661 2.908 . . . . 0.0 109.874 161.134 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 18.6 t -116.55 86.09 17.8 Favored Pre-proline 0 CA--C 1.541 0.607 0 C-N-CA 125.222 1.409 . . . . 0.0 107.813 -173.994 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo -73.17 174.87 11.34 Favored 'Trans proline' 0 C--N 1.347 0.456 0 C-N-CA 124.72 3.613 . . . . 0.0 111.667 -177.723 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -142.79 131.95 23.22 Favored 'General case' 0 N--CA 1.445 -0.692 0 C-N-CA 125.935 1.694 . . . . 0.0 110.881 -175.194 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 7.1 p -63.81 -26.39 40.5 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.423 0 O-C-N 121.061 -1.025 . . . . 0.0 112.558 179.549 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 93.1 p -71.64 0.67 8.14 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 120.06 1.3 . . . . 0.0 113.568 178.846 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 32.1 p -111.32 1.79 17.29 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.475 1.11 . . . . 0.0 112.02 172.076 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 11.0 m-30 -69.46 172.46 7.19 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.647 1.179 . . . . 0.0 111.88 -178.808 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 2.8 mm100 -116.11 101.88 9.12 Favored 'General case' 0 N--CA 1.478 0.926 0 N-CA-C 114.663 1.357 . . . . 0.0 114.663 179.03 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 55.1 t80 -63.68 147.84 50.57 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 118.426 0.557 . . . . 0.0 111.621 -175.637 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 8.4 t0 -124.82 84.42 2.28 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 123.289 0.636 . . . . 0.0 109.769 176.809 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.75 -19.48 50.49 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 115.152 1.538 . . . . 0.0 115.152 -172.351 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 5.9 t -49.16 -46.93 46.0 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-O 118.346 -0.835 . . . . 0.0 110.313 166.264 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 64.8 m -130.07 -8.16 4.36 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 114.203 1.186 . . . . 0.0 114.203 -171.625 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 96.87 14.57 42.56 Favored Glycine 0 CA--C 1.526 0.771 0 CA-C-N 119.081 0.855 . . . . 0.0 114.221 155.707 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 16.9 m-85 -110.49 171.69 7.31 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 118.287 1.044 . . . . 0.0 109.027 -176.967 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 35.0 m-85 -113.03 121.81 45.72 Favored 'General case' 0 CA--C 1.529 0.142 0 C-N-CA 124.644 1.177 . . . . 0.0 108.624 -175.353 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 71.9 t80 -91.26 138.45 31.58 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 124.475 1.11 . . . . 0.0 110.694 -177.467 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 32.3 t0 -98.78 86.81 0.53 Allowed Pre-proline 0 N--CA 1.472 0.645 0 C-N-CA 126.233 1.813 . . . . 0.0 111.992 179.497 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_endo -60.9 -11.84 19.74 Favored 'Trans proline' 0 N--CA 1.459 -0.541 0 C-N-CA 122.415 2.077 . . . . 0.0 114.196 178.218 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -63.86 -29.52 70.7 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 119.743 1.156 . . . . 0.0 110.0 173.928 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 38.4 p -133.98 -42.42 0.82 Allowed 'General case' 0 C--O 1.235 0.301 0 CA-C-N 118.867 0.758 . . . . 0.0 112.833 -174.102 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 113.78 19.35 6.52 Favored Glycine 0 CA--C 1.534 1.228 0 C-N-CA 125.605 1.574 . . . . 0.0 112.322 -179.533 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 22.5 mt -93.11 176.21 6.5 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 126.466 1.906 . . . . 0.0 109.306 178.989 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 55.6 m-85 -121.96 165.36 16.09 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 124.678 1.191 . . . . 0.0 110.603 172.936 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 77.0 t80 -147.93 160.06 43.2 Favored 'General case' 0 C--O 1.239 0.534 0 C-N-CA 129.112 2.965 . . . . 0.0 108.475 -175.897 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.4 ' HB3' ' HB2' ' A' ' 40' ' ' SER . 8.8 t0 -129.35 143.74 50.07 Favored Pre-proline 0 CA--C 1.537 0.469 0 N-CA-C 107.358 -1.349 . . . . 0.0 107.358 178.712 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_endo -63.72 -42.68 19.35 Favored 'Trans proline' 0 CA--C 1.537 0.633 0 C-N-CA 122.457 2.105 . . . . 0.0 113.262 -179.842 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 88.4 m-20 -75.07 -43.06 55.35 Favored 'General case' 0 N--CA 1.446 -0.647 0 C-N-CA 124.565 1.146 . . . . 0.0 109.596 176.041 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . 0.4 ' HB2' ' HB3' ' A' ' 37' ' ' ASP . 14.9 m -103.92 97.89 7.81 Favored 'General case' 0 N--CA 1.456 -0.132 0 C-N-CA 123.727 0.811 . . . . 0.0 109.11 -171.177 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 7.4 mp0 -58.83 -15.61 13.3 Favored 'General case' 0 CA--C 1.541 0.621 0 O-C-N 121.78 -0.575 . . . . 0.0 111.135 173.526 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 32.1 m-85 -61.5 105.44 0.52 Allowed 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 125.94 1.696 . . . . 0.0 109.7 170.163 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 27.1 m-85 -67.99 168.36 12.01 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 124.692 1.197 . . . . 0.0 110.52 175.078 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 75.7 t80 -123.48 121.22 35.13 Favored 'General case' 0 N--CA 1.446 -0.649 0 C-N-CA 125.422 1.489 . . . . 0.0 109.559 176.183 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 28.1 t30 -86.18 88.38 7.59 Favored 'General case' 0 N--CA 1.443 -0.784 0 C-N-CA 127.875 2.47 . . . . 0.0 108.744 173.147 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -52.09 -36.39 50.7 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.498 0.719 . . . . 0.0 111.825 175.524 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -48.01 -57.09 6.22 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 126.393 1.877 . . . . 0.0 112.172 -178.257 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -111.23 18.48 19.27 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 125.037 1.335 . . . . 0.0 111.603 179.317 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 3.0 mt-30 48.4 34.0 4.37 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 125.579 1.551 . . . . 0.0 112.606 -176.516 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -105.76 174.56 5.83 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 126.714 2.006 . . . . 0.0 110.975 -174.02 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 5.6 m-85 -114.44 146.47 40.59 Favored 'General case' 0 C--N 1.332 -0.153 0 N-CA-C 108.387 -0.968 . . . . 0.0 108.387 179.601 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.473 HD23 ' HA ' ' A' ' 63' ' ' PRO . 85.2 mt -137.82 174.76 10.24 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.966 1.306 . . . . 0.0 108.874 -175.503 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 8.7 p90 -139.46 142.96 37.35 Favored 'General case' 0 C--O 1.239 0.543 0 C-N-CA 125.687 1.595 . . . . 0.0 107.917 165.948 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 41.8 t-105 -85.12 100.86 12.0 Favored 'General case' 0 N--CA 1.449 -0.524 0 N-CA-C 105.543 -2.021 . . . . 0.0 105.543 176.907 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 51.4 t0 -88.53 87.08 7.15 Favored 'General case' 0 N--CA 1.447 -0.615 0 N-CA-C 107.61 -1.255 . . . . 0.0 107.61 -178.47 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -58.55 -17.3 32.89 Favored Glycine 0 CA--C 1.53 1.02 0 CA-C-O 118.299 -1.278 . . . . 0.0 112.345 177.599 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 17.6 mt-10 -69.7 -22.27 63.43 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 120.021 1.911 . . . . 0.0 111.282 174.47 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 8.8 mtt180 -120.16 -2.71 10.13 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 125.173 1.389 . . . . 0.0 111.359 -179.516 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 2.1 mpt_? 44.55 56.15 5.29 Favored 'General case' 0 C--O 1.234 0.252 0 C-N-CA 126.664 1.986 . . . . 0.0 110.278 -173.54 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 5.0 t -148.89 153.46 38.06 Favored 'General case' 0 N--CA 1.448 -0.53 0 N-CA-C 108.851 -0.796 . . . . 0.0 108.851 176.513 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 80.3 m-85 -93.08 115.74 28.39 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 106.186 -1.783 . . . . 0.0 106.186 175.641 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -125.26 154.92 71.99 Favored Pre-proline 0 C--N 1.326 -0.425 0 C-N-CA 125.667 1.587 . . . . 0.0 110.274 -171.462 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . 0.473 ' HA ' HD23 ' A' ' 52' ' ' LEU . 56.4 Cg_endo -68.32 130.32 20.96 Favored 'Trans proline' 0 N--CA 1.455 -0.782 0 C-N-CA 122.36 2.04 . . . . 0.0 110.464 -179.032 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.231 0 CA-C-O 121.993 0.901 . . . . 0.0 112.764 177.916 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 58.5 m-85 . . . . . 0 C--O 1.235 0.329 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -61.04 169.69 5.73 Favored 'Trans proline' 0 N--CA 1.453 -0.873 0 C-N-CA 121.823 1.682 . . . . 0.0 109.846 161.94 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 59.7 t -104.67 86.69 1.51 Allowed Pre-proline 0 C--O 1.241 0.615 0 N-CA-C 107.073 -1.454 . . . . 0.0 107.073 -173.028 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 69.0 Cg_endo -66.79 169.18 15.13 Favored 'Trans proline' 0 CA--C 1.534 0.48 0 C-N-CA 123.856 3.037 . . . . 0.0 111.525 -168.929 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -146.43 123.15 11.21 Favored 'General case' 0 C--O 1.232 0.164 0 O-C-N 121.535 -0.728 . . . . 0.0 111.057 -175.948 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 13.3 p -58.61 -20.84 17.24 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.671 0 C-N-CA 124.679 1.192 . . . . 0.0 112.695 -178.052 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 38.7 p -64.66 -13.7 55.13 Favored 'General case' 0 N--CA 1.434 -1.229 0 O-C-N 119.856 -1.777 . . . . 0.0 113.705 179.24 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 12.7 t -119.87 8.42 11.1 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 125.185 1.394 . . . . 0.0 110.75 176.669 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 12.9 m-30 -74.68 155.78 37.38 Favored 'General case' 0 C--O 1.238 0.467 0 O-C-N 120.977 -1.077 . . . . 0.0 110.524 170.68 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 25.5 mt-30 -93.47 150.79 20.17 Favored 'General case' 0 C--O 1.224 -0.26 0 CA-C-N 114.915 -1.039 . . . . 0.0 109.79 171.457 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.423 ' CZ ' ' HA2' ' A' ' 25' ' ' GLY . 70.2 t80 -96.46 152.81 18.26 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 124.567 1.147 . . . . 0.0 109.975 167.469 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -132.66 97.28 4.02 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 124.134 0.974 . . . . 0.0 109.415 173.872 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.418 ' HG2' ' H ' ' A' ' 22' ' ' GLU . 1.3 pt-20 -62.22 -20.2 63.95 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 125.307 1.443 . . . . 0.0 113.861 -172.403 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 15.1 t -56.74 -24.8 52.39 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 123.495 0.718 . . . . 0.0 111.617 171.38 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 66.2 m -133.14 -19.92 2.19 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.834 1.254 . . . . 0.0 112.775 179.522 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . 0.423 ' HA2' ' CZ ' ' A' ' 20' ' ' TYR . . . 62.77 25.37 67.49 Favored Glycine 0 CA--C 1.531 1.073 0 O-C-N 121.016 -1.052 . . . . 0.0 112.682 -175.516 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 17.8 m-85 -87.98 170.57 11.01 Favored 'General case' 0 C--O 1.238 0.482 0 N-CA-C 107.419 -1.326 . . . . 0.0 107.419 160.966 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 76.9 m-85 -107.04 152.45 23.99 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 124.316 1.046 . . . . 0.0 108.741 166.782 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 46.6 t80 -111.21 137.63 48.67 Favored 'General case' 0 N--CA 1.447 -0.623 0 C-N-CA 126.933 2.093 . . . . 0.0 108.315 179.162 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 6.2 t0 -96.02 86.7 0.37 Allowed Pre-proline 0 CA--C 1.532 0.267 0 C-N-CA 128.609 2.763 . . . . 0.0 107.048 177.335 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -66.91 -10.27 27.8 Favored 'Trans proline' 0 C--N 1.347 0.485 0 C-N-CA 122.424 2.083 . . . . 0.0 111.983 175.982 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 10.0 tt0 -70.1 -18.54 63.25 Favored 'General case' 0 N--CA 1.447 -0.599 0 C-N-CA 124.578 1.151 . . . . 0.0 110.523 -179.151 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 37.0 p -145.57 -53.29 0.27 Allowed 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 126.165 1.786 . . . . 0.0 111.106 178.438 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 135.1 12.23 1.3 Allowed Glycine 0 CA--C 1.531 1.08 0 C-N-CA 126.329 1.919 . . . . 0.0 113.851 178.727 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 10.7 mt -81.1 177.19 9.2 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 118.92 1.36 . . . . 0.0 110.339 178.332 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 59.5 m-85 -121.95 167.52 12.97 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.275 1.03 . . . . 0.0 110.196 168.915 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 33.9 t80 -149.65 139.73 22.08 Favored 'General case' 0 C--O 1.235 0.317 0 C-N-CA 127.518 2.327 . . . . 0.0 107.835 -172.63 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -99.29 143.25 26.06 Favored Pre-proline 0 CA--C 1.538 0.506 0 N-CA-C 106.951 -1.5 . . . . 0.0 106.951 -178.389 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -66.48 -38.43 19.6 Favored 'Trans proline' 0 C--O 1.236 0.417 0 C-N-CA 121.423 1.415 . . . . 0.0 113.735 -178.841 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 11.2 m-80 -99.78 -14.26 18.91 Favored 'General case' 0 CA--C 1.518 -0.264 0 N-CA-C 113.31 0.855 . . . . 0.0 113.31 -172.414 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 24.2 m -127.93 103.33 7.19 Favored 'General case' 0 C--N 1.32 -0.689 0 C-N-CA 125.954 1.702 . . . . 0.0 107.659 178.161 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -65.62 -1.51 2.75 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 123.56 0.744 . . . . 0.0 112.344 -176.832 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 42.1 m-85 -60.98 120.75 10.82 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 119.414 1.007 . . . . 0.0 108.435 164.769 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 32.5 m-85 -74.1 164.36 26.71 Favored 'General case' 0 N--CA 1.442 -0.838 0 C-N-CA 124.482 1.113 . . . . 0.0 109.355 173.611 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 94.4 t80 -119.44 139.52 51.91 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 125.474 1.509 . . . . 0.0 108.674 173.027 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 18.7 t30 -121.17 79.97 1.59 Allowed 'General case' 0 N--CA 1.444 -0.745 0 C-N-CA 128.169 2.588 . . . . 0.0 106.179 -171.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -52.15 -33.07 38.63 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 123.629 0.772 . . . . 0.0 111.621 179.97 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -46.19 -38.04 7.83 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 127.369 2.268 . . . . 0.0 113.012 177.097 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.3 m -129.05 13.12 6.22 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 125.141 1.376 . . . . 0.0 110.488 179.127 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 52.4 mt-30 44.02 35.25 1.11 Allowed 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 128.859 2.864 . . . . 0.0 113.7 -169.003 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -108.08 -179.83 4.01 Favored 'General case' 0 N--CA 1.448 -0.54 0 C-N-CA 124.839 1.256 . . . . 0.0 112.145 -176.227 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 55.4 m-85 -123.28 139.7 53.78 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 124.723 1.209 . . . . 0.0 109.221 -178.08 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.412 HD23 ' HA ' ' A' ' 63' ' ' PRO . 64.9 mt -130.97 167.25 19.34 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.865 1.266 . . . . 0.0 107.838 -174.28 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 13.6 p90 -126.05 149.85 48.56 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 107.437 -1.319 . . . . 0.0 107.437 165.835 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 62.9 t-105 -88.03 152.92 21.68 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 106.212 -1.774 . . . . 0.0 106.212 166.805 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 49.0 t0 -145.58 155.25 42.93 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 107.595 -1.261 . . . . 0.0 107.595 166.553 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -100.84 -7.93 49.51 Favored Glycine 0 CA--C 1.526 0.758 0 CA-C-O 118.883 -0.954 . . . . 0.0 112.322 177.95 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 75.6 mt-10 -74.11 -44.29 54.42 Favored 'General case' 0 C--N 1.341 0.201 0 CA-C-N 119.664 1.732 . . . . 0.0 107.824 177.251 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 81.3 mtt180 -102.05 -5.21 24.82 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-O 117.703 -1.142 . . . . 0.0 112.499 -178.499 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 60.6 mtt85 43.95 57.89 3.91 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 126.997 2.119 . . . . 0.0 111.941 177.684 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . 0.484 HG23 HG13 ' A' ' 62' ' ' VAL . 10.0 t -151.05 156.44 41.11 Favored 'General case' 0 N--CA 1.442 -0.835 0 N-CA-C 107.848 -1.167 . . . . 0.0 107.848 177.174 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 31.3 m-85 -75.27 128.25 35.0 Favored 'General case' 0 C--O 1.238 0.479 0 N-CA-C 106.616 -1.624 . . . . 0.0 106.616 154.499 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.484 HG13 HG23 ' A' ' 60' ' ' THR . 0.0 OUTLIER -126.04 154.46 73.99 Favored Pre-proline 0 C--N 1.325 -0.481 0 C-N-CA 126.81 2.044 . . . . 0.0 111.429 -178.697 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . 0.412 ' HA ' HD23 ' A' ' 52' ' ' LEU . 54.4 Cg_endo -71.78 122.68 8.74 Favored 'Trans proline' 0 N--CA 1.456 -0.686 0 C-N-CA 122.87 2.38 . . . . 0.0 111.782 -176.17 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.311 0 N-CA-C 115.144 1.535 . . . . 0.0 115.144 -174.691 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 44.0 m-85 . . . . . 0 C--O 1.241 0.656 0 N-CA-C 109.922 -0.399 . . . . 0.0 109.922 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 62.8 Cg_endo -71.82 -169.0 0.4 Allowed 'Trans proline' 0 N--CA 1.46 -0.468 0 C-N-CA 123.598 2.865 . . . . 0.0 110.516 170.497 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 85.9 t -109.38 88.13 5.78 Favored Pre-proline 0 CA--C 1.539 0.544 0 C-N-CA 126.232 1.813 . . . . 0.0 108.341 178.226 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 64.9 Cg_endo -66.4 175.23 5.23 Favored 'Trans proline' 0 CA--C 1.543 0.935 0 C-N-CA 122.957 2.438 . . . . 0.0 112.744 -177.356 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -154.1 147.76 25.26 Favored 'General case' 0 N--CA 1.465 0.295 0 C-N-CA 123.171 0.588 . . . . 0.0 111.144 168.234 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.492 ' HA ' ' CD2' ' A' ' 18' ' ' TYR . 13.0 p -58.01 -22.9 20.01 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.151 0 C-N-CA 125.22 1.408 . . . . 0.0 114.048 178.711 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 8.0 t -64.92 -3.5 3.51 Favored 'General case' 0 CA--C 1.541 0.633 0 O-C-N 121.022 -1.049 . . . . 0.0 112.52 174.476 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 40.9 p -105.48 -7.98 18.36 Favored 'General case' 0 CA--C 1.543 0.707 0 CA-C-N 119.558 1.072 . . . . 0.0 112.369 178.257 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . 0.492 ' CD2' ' HA ' ' A' ' 15' ' ' VAL . 17.8 m-30 -88.99 168.28 12.49 Favored 'General case' 0 C--N 1.342 0.282 0 C-N-CA 124.61 1.164 . . . . 0.0 111.637 -170.226 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 14.5 mt-30 -118.09 116.04 26.05 Favored 'General case' 0 C--O 1.226 -0.181 0 C-N-CA 124.835 1.254 . . . . 0.0 110.099 178.805 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 69.6 t80 -71.27 143.02 50.5 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 118.473 0.578 . . . . 0.0 110.509 172.962 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -131.0 96.75 4.13 Favored 'General case' 0 CA--C 1.515 -0.376 0 C-N-CA 124.425 1.09 . . . . 0.0 110.141 178.529 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.7 pt-20 -53.54 -19.12 3.39 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.86 1.264 . . . . 0.0 113.289 -179.972 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 1.3 t -64.21 -17.92 64.01 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.229 1.412 . . . . 0.0 111.974 178.581 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -143.83 -19.96 0.58 Allowed 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 119.341 0.973 . . . . 0.0 112.467 177.712 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 89.88 10.57 64.63 Favored Glycine 0 CA--C 1.529 0.923 0 CA-C-O 118.331 -1.261 . . . . 0.0 113.433 176.105 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 -110.63 151.08 28.09 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-N 119.257 1.529 . . . . 0.0 108.468 177.602 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 66.0 m-85 -80.29 147.79 31.0 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 106.774 -1.565 . . . . 0.0 106.774 172.764 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 35.9 t80 -105.67 135.32 47.29 Favored 'General case' 0 C--O 1.239 0.515 0 C-N-CA 125.039 1.336 . . . . 0.0 110.223 175.892 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -99.65 85.8 0.51 Allowed Pre-proline 0 N--CA 1.451 -0.403 0 C-N-CA 126.824 2.049 . . . . 0.0 110.771 -178.591 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -65.73 -5.68 12.33 Favored 'Trans proline' 0 N--CA 1.458 -0.58 0 C-N-CA 121.649 1.566 . . . . 0.0 113.994 -179.49 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 36.7 tt0 -77.31 -33.03 55.69 Favored 'General case' 0 N--CA 1.447 -0.594 0 O-C-N 121.263 -0.898 . . . . 0.0 110.46 177.948 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.439 ' HB ' ' CD2' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -135.37 -19.57 1.67 Allowed 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 126.268 1.827 . . . . 0.0 112.988 -162.913 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 94.84 -4.78 68.8 Favored Glycine 0 N--CA 1.445 -0.725 0 CA-C-O 117.678 -1.623 . . . . 0.0 113.623 175.584 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.493 ' N ' HD13 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -76.84 -179.45 5.43 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 119.847 1.824 . . . . 0.0 109.906 178.644 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 41.0 m-85 -116.54 135.34 53.9 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-N 114.672 -1.149 . . . . 0.0 109.688 161.126 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 63.7 t80 -92.18 153.38 19.35 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 126.213 1.805 . . . . 0.0 109.683 168.235 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -128.93 144.28 51.93 Favored Pre-proline 0 CA--C 1.538 0.499 0 O-C-N 121.523 -0.736 . . . . 0.0 110.383 172.461 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 61.9 Cg_endo -72.75 -23.78 18.91 Favored 'Trans proline' 0 N--CA 1.457 -0.654 0 C-N-CA 122.445 2.096 . . . . 0.0 114.573 -176.539 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -84.79 -31.11 24.09 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-N 120.558 1.526 . . . . 0.0 109.935 166.029 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 49.4 m -127.32 92.77 3.57 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-O 122.403 1.096 . . . . 0.0 110.724 -162.924 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 5.5 mp0 -62.7 -5.92 3.14 Favored 'General case' 0 CA--C 1.546 0.825 0 CA-C-N 115.215 -0.902 . . . . 0.0 111.216 168.98 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 24.7 m-85 -62.92 98.0 0.12 Allowed 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 125.829 1.652 . . . . 0.0 107.398 160.395 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 67.9 m-85 -61.69 157.16 18.34 Favored 'General case' 0 C--O 1.232 0.153 0 C-N-CA 126.335 1.854 . . . . 0.0 111.511 177.692 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 10.8 t80 -115.89 108.45 16.3 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 125.029 1.332 . . . . 0.0 108.769 174.812 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 29.7 t30 -90.32 75.74 6.85 Favored 'General case' 0 C--O 1.235 0.299 0 C-N-CA 126.761 2.024 . . . . 0.0 106.111 177.359 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -48.63 -31.07 6.12 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 124.845 1.258 . . . . 0.0 111.413 178.703 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -44.75 -39.25 5.04 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 127.643 2.377 . . . . 0.0 112.594 178.901 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 35.2 m -134.22 20.14 3.72 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.956 1.302 . . . . 0.0 110.101 176.054 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 37.3 mt-30 46.66 17.82 0.06 Allowed 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 128.741 2.817 . . . . 0.0 114.844 -165.995 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 33.7 mm-40 -76.28 166.49 23.37 Favored 'General case' 0 CA--C 1.522 -0.117 0 CA-C-N 119.623 1.101 . . . . 0.0 111.623 -176.027 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 9.6 m-85 -118.98 123.93 45.75 Favored 'General case' 0 N--CA 1.45 -0.448 0 N-CA-C 106.318 -1.734 . . . . 0.0 106.318 -177.788 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.423 HD23 ' HA ' ' A' ' 63' ' ' PRO . 22.6 mt -124.1 167.81 13.72 Favored 'General case' 0 N--CA 1.464 0.252 0 C-N-CA 126.478 1.911 . . . . 0.0 110.495 -177.032 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 9.3 p90 -134.23 148.88 50.92 Favored 'General case' 0 N--CA 1.448 -0.573 0 O-C-N 120.948 -1.095 . . . . 0.0 108.197 164.722 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 39.6 t-105 -70.92 130.49 41.75 Favored 'General case' 0 C--O 1.236 0.365 0 N-CA-C 106.242 -1.762 . . . . 0.0 106.242 167.128 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 18.9 t0 -122.82 92.08 3.63 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-N 119.329 0.968 . . . . 0.0 109.788 174.758 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -59.51 -12.81 20.47 Favored Glycine 0 CA--C 1.529 0.93 0 CA-C-O 117.645 -1.642 . . . . 0.0 113.58 -178.454 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 -69.57 -20.98 63.65 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 120.389 2.094 . . . . 0.0 111.508 174.149 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 78.6 mtt85 -134.58 -0.07 2.95 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 126.771 2.028 . . . . 0.0 111.334 -167.756 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 5.9 mpt_? 44.63 48.3 8.65 Favored 'General case' 0 N--CA 1.463 0.177 0 C-N-CA 129.093 2.957 . . . . 0.0 112.593 174.579 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 13.9 t -143.67 -174.63 4.3 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 107.473 -1.306 . . . . 0.0 107.473 172.052 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 51.6 m-85 -106.05 135.73 46.99 Favored 'General case' 0 C--O 1.234 0.277 0 N-CA-C 106.913 -1.514 . . . . 0.0 106.913 169.77 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -125.87 157.3 69.54 Favored Pre-proline 0 C--N 1.328 -0.359 0 C-N-CA 126.043 1.737 . . . . 0.0 109.176 178.598 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . 0.423 ' HA ' HD23 ' A' ' 52' ' ' LEU . 61.0 Cg_endo -70.77 142.08 42.64 Favored 'Trans proline' 0 N--CA 1.452 -0.932 0 C-N-CA 121.232 1.288 . . . . 0.0 111.331 179.629 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.488 0 C-N-CA 125.589 1.555 . . . . 0.0 111.245 -177.29 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 45.6 m-85 . . . . . 0 CA--C 1.536 0.433 0 CA-C-O 119.507 -0.282 . . . . 0.0 111.567 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 61.9 Cg_endo -73.11 -177.8 3.18 Favored 'Trans proline' 0 CA--C 1.537 0.672 0 C-N-CA 124.747 3.631 . . . . 0.0 112.084 174.686 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 29.7 t -110.88 87.33 6.78 Favored Pre-proline 0 CA--C 1.532 0.284 0 C-N-CA 126.818 2.047 . . . . 0.0 108.697 -176.184 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 41.0 Cg_endo -67.27 162.1 40.11 Favored 'Trans proline' 0 CA--C 1.542 0.89 0 C-N-CA 121.847 1.698 . . . . 0.0 109.955 171.539 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.424 ' C ' ' H ' ' A' ' 16' ' ' SER . 50.8 t0 -159.45 32.94 0.2 Allowed 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 123.12 0.568 . . . . 0.0 111.302 -172.817 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . 0.376 7.5 p 43.78 -22.68 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.552 1.055 1 C-N-CA 133.408 4.683 . . . . 0.0 116.727 -165.94 . . . . . . . . 3 2 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . 0.424 ' H ' ' C ' ' A' ' 14' ' ' ASP . 2.8 p -70.18 -18.22 63.19 Favored 'General case' 0 N--CA 1.446 -0.672 0 C-N-CA 128.635 2.774 . . . . 0.0 111.995 -174.086 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 16.5 p -87.62 -13.95 41.37 Favored 'General case' 0 CA--C 1.538 0.501 0 O-C-N 121.139 -0.976 . . . . 0.0 110.712 175.455 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 13.7 m-30 -72.56 148.35 45.04 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-O 122.501 1.143 . . . . 0.0 111.023 -161.014 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 84.7 mt-30 -87.4 101.95 14.06 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 105.921 -1.881 . . . . 0.0 105.921 170.178 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 88.3 t80 -59.05 142.72 50.57 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 107.742 -1.207 . . . . 0.0 107.742 159.817 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -128.13 88.95 2.84 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 104.692 -2.336 . . . . 0.0 104.692 -176.484 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -56.09 -27.89 55.5 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 124.544 1.138 . . . . 0.0 113.699 -171.017 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 10.6 t -45.74 -52.93 10.26 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 126.024 1.73 . . . . 0.0 111.124 177.741 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 22.2 m -93.22 -35.71 12.98 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 118.513 0.597 . . . . 0.0 110.86 169.548 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 80.16 58.36 2.8 Favored Glycine 0 CA--C 1.524 0.61 0 N-CA-C 110.044 -1.222 . . . . 0.0 110.044 -173.198 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 30.3 m-85 -142.23 169.95 16.62 Favored 'General case' 0 C--O 1.24 0.597 0 C-N-CA 130.237 3.415 . . . . 0.0 106.229 173.138 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 82.2 m-85 -101.64 150.89 22.64 Favored 'General case' 0 CA--C 1.522 -0.116 0 O-C-N 121.906 -0.496 . . . . 0.0 111.043 178.709 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 41.6 t80 -119.84 140.92 50.06 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 127.848 2.459 . . . . 0.0 107.886 174.279 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 51.4 t0 -104.92 86.4 1.49 Allowed Pre-proline 0 N--CA 1.467 0.4 0 C-N-CA 127.468 2.307 . . . . 0.0 109.95 -177.134 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo -62.26 -13.77 34.36 Favored 'Trans proline' 0 CA--C 1.533 0.455 0 C-N-CA 122.716 2.278 . . . . 0.0 113.765 -175.924 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -74.32 -14.42 60.89 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 124.169 0.988 . . . . 0.0 111.453 -179.42 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.483 HG21 ' CE2' ' A' ' 61' ' ' TYR . 2.9 p -141.12 -45.77 0.38 Allowed 'General case' 0 C--N 1.332 -0.17 0 C-N-CA 125.519 1.528 . . . . 0.0 110.426 -172.204 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 98.31 46.06 2.25 Favored Glycine 0 N--CA 1.446 -0.654 0 N-CA-C 109.731 -1.348 . . . . 0.0 109.731 -175.719 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 12.7 mt -118.77 173.2 7.01 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 127.111 2.164 . . . . 0.0 107.568 172.535 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 26.4 m-85 -117.86 166.1 12.88 Favored 'General case' 0 C--O 1.238 0.481 0 C-N-CA 123.962 0.905 . . . . 0.0 109.443 168.358 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 69.2 t80 -143.87 158.65 43.55 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 125.995 1.718 . . . . 0.0 109.63 -178.372 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -131.24 143.76 50.66 Favored Pre-proline 0 CA--C 1.538 0.501 0 C-N-CA 125.406 1.482 . . . . 0.0 110.825 175.2 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -74.26 -35.12 4.18 Favored 'Trans proline' 0 CA--C 1.536 0.614 0 C-N-CA 123.465 2.777 . . . . 0.0 114.346 -178.183 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 13.6 m-80 -76.51 -23.32 53.7 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 120.085 1.311 . . . . 0.0 110.851 174.667 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -134.91 85.99 2.22 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 124.135 0.974 . . . . 0.0 108.895 -158.495 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 6.1 mp0 -62.85 -0.08 0.61 Allowed 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 124.598 1.159 . . . . 0.0 114.084 -176.038 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 60.8 m-85 -77.85 110.12 12.46 Favored 'General case' 0 C--O 1.237 0.402 0 O-C-N 120.052 -1.655 . . . . 0.0 108.449 174.525 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 14.5 m-85 -63.03 146.04 54.1 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 125.507 1.523 . . . . 0.0 109.811 -176.094 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 74.7 t80 -102.23 112.81 25.64 Favored 'General case' 0 CA--C 1.516 -0.34 0 CA-C-O 122.735 1.255 . . . . 0.0 108.206 177.785 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 49.3 t30 -84.64 80.88 9.1 Favored 'General case' 0 N--CA 1.44 -0.944 0 C-N-CA 125.266 1.427 . . . . 0.0 108.728 175.785 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -44.42 -37.17 3.25 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 125.182 1.393 . . . . 0.0 111.817 175.737 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 3.2 tt0 -44.35 -43.11 7.3 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 127.842 2.457 . . . . 0.0 112.766 179.927 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 17.9 m -131.78 21.04 4.6 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 125.438 1.495 . . . . 0.0 110.835 177.878 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 43.4 mt-30 48.27 27.99 1.47 Allowed 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 126.153 1.781 . . . . 0.0 112.571 -173.433 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.1 tp-100 -94.09 169.8 10.0 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 124.638 1.175 . . . . 0.0 110.594 -170.422 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 3.4 m-85 -108.29 144.57 35.62 Favored 'General case' 0 C--O 1.236 0.386 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 169.461 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 83.4 mt -142.6 179.93 6.68 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 127.197 2.199 . . . . 0.0 107.663 -178.991 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 17.8 p90 -135.83 146.09 47.13 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 124.435 1.094 . . . . 0.0 108.817 167.75 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 64.8 t-105 -73.43 132.95 43.54 Favored 'General case' 0 C--O 1.236 0.379 0 N-CA-C 105.676 -1.972 . . . . 0.0 105.676 164.961 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 58.9 t0 -129.63 76.6 1.73 Allowed 'General case' 0 CA--C 1.514 -0.412 0 C-N-CA 123.921 0.888 . . . . 0.0 109.004 -174.46 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -57.48 -7.16 2.78 Favored Glycine 0 CA--C 1.534 1.268 0 C-N-CA 124.692 1.139 . . . . 0.0 113.074 -176.079 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 34.3 mm-40 -65.2 -32.68 74.49 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 119.157 1.479 . . . . 0.0 109.414 169.461 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 62.5 mtt180 -118.67 -13.37 9.62 Favored 'General case' 0 C--O 1.231 0.093 0 C-N-CA 127.11 2.164 . . . . 0.0 113.466 -174.732 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 81.9 mtt180 56.58 59.72 3.44 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 124.702 1.201 . . . . 0.0 110.705 -173.8 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 4.7 t -153.94 -179.23 7.67 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 123.515 0.726 . . . . 0.0 109.051 174.475 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . 0.483 ' CE2' HG21 ' A' ' 32' ' ' THR . 98.7 m-85 -116.73 123.0 46.11 Favored 'General case' 0 C--O 1.233 0.207 0 N-CA-C 108.587 -0.894 . . . . 0.0 108.587 172.239 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -124.31 157.26 65.24 Favored Pre-proline 0 C--N 1.328 -0.357 0 C-N-CA 126.029 1.731 . . . . 0.0 110.29 -168.689 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo -72.0 130.87 17.25 Favored 'Trans proline' 0 N--CA 1.454 -0.852 0 C-N-CA 122.013 1.809 . . . . 0.0 110.933 -171.909 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 0.395 0 CA-C-O 122.156 0.979 . . . . 0.0 111.089 -176.551 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 . . . . . 0 C--O 1.239 0.53 0 CA-C-O 120.28 0.086 . . . . 0.0 110.96 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_endo -75.79 -178.07 4.07 Favored 'Trans proline' 0 N--CA 1.455 -0.757 0 C-N-CA 123.571 2.847 . . . . 0.0 110.288 168.93 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 13.8 t -109.81 87.64 5.83 Favored Pre-proline 0 CA--C 1.544 0.719 0 C-N-CA 126.95 2.1 . . . . 0.0 108.58 -170.38 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 25.1 Cg_endo -77.1 -178.25 4.44 Favored 'Trans proline' 0 CA--C 1.539 0.769 0 C-N-CA 124.552 3.501 . . . . 0.0 111.726 -173.76 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 22.7 t0 -152.5 142.48 22.19 Favored 'General case' 0 N--CA 1.468 0.437 0 O-C-N 121.473 -0.767 . . . . 0.0 110.102 166.417 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 12.5 p -62.65 -19.95 24.02 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.64 0 O-C-N 121.336 -0.853 . . . . 0.0 110.971 174.089 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 17.4 m -59.41 -10.55 3.3 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.804 1.242 . . . . 0.0 113.914 173.276 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.4 t -115.97 9.26 14.85 Favored 'General case' 0 CA--C 1.545 0.767 0 CA-C-N 120.159 1.345 . . . . 0.0 111.199 177.729 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 11.4 m-30 -89.01 167.68 12.97 Favored 'General case' 0 C--O 1.236 0.36 0 O-C-N 120.837 -1.165 . . . . 0.0 111.756 -178.224 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 43.9 mt-30 -98.54 129.69 45.1 Favored 'General case' 0 C--O 1.224 -0.268 0 N-CA-C 107.455 -1.313 . . . . 0.0 107.455 170.652 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 69.2 t80 -73.62 150.25 41.49 Favored 'General case' 0 C--O 1.24 0.577 0 CA-C-N 119.239 0.927 . . . . 0.0 108.742 161.281 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -126.25 93.83 3.92 Favored 'General case' 0 C--O 1.233 0.206 0 N-CA-C 107.513 -1.292 . . . . 0.0 107.513 175.541 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.82 -27.46 51.47 Favored 'General case' 0 N--CA 1.462 0.141 0 C-N-CA 124.864 1.265 . . . . 0.0 112.676 -179.677 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 13.5 t -50.95 -30.67 15.54 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 126.084 1.754 . . . . 0.0 112.385 173.43 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 31.0 m -139.18 -13.11 1.19 Allowed 'General case' 0 CA--C 1.532 0.255 0 N-CA-C 114.004 1.113 . . . . 0.0 114.004 -172.759 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 77.11 39.65 26.79 Favored Glycine 0 CA--C 1.527 0.841 0 CA-C-N 119.623 1.101 . . . . 0.0 111.651 174.181 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 4.8 m-85 -129.0 171.56 12.23 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 126.833 2.053 . . . . 0.0 107.317 170.691 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 84.2 m-85 -102.79 151.35 22.51 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 124.851 1.261 . . . . 0.0 107.717 163.92 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 37.4 t80 -117.59 139.98 50.24 Favored 'General case' 0 N--CA 1.45 -0.446 0 C-N-CA 126.801 2.04 . . . . 0.0 107.977 174.824 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -113.91 84.06 8.29 Favored Pre-proline 0 N--CA 1.439 -1.014 0 C-N-CA 125.705 1.602 . . . . 0.0 108.939 -162.184 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_endo -64.83 -14.42 44.88 Favored 'Trans proline' 0 C--N 1.349 0.587 0 C-N-CA 123.143 2.562 . . . . 0.0 113.176 -176.881 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 26.9 tt0 -69.38 -20.29 63.82 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 126.349 1.859 . . . . 0.0 111.495 -178.786 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -146.69 -33.63 0.3 Allowed 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 125.235 1.414 . . . . 0.0 112.391 -166.732 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 91.98 39.3 5.51 Favored Glycine 0 CA--C 1.527 0.831 0 C-N-CA 125.079 1.323 . . . . 0.0 111.648 -176.89 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 10.0 mt -122.66 -179.2 4.14 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 125.707 1.603 . . . . 0.0 108.012 177.546 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 47.2 m-85 -123.14 154.98 37.91 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 123.447 0.699 . . . . 0.0 109.369 166.61 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 39.7 t80 -124.41 158.38 32.87 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 127.376 2.27 . . . . 0.0 110.195 177.081 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 15.5 t0 -132.42 142.05 43.5 Favored Pre-proline 0 N--CA 1.468 0.461 0 C-N-CA 126.124 1.77 . . . . 0.0 108.253 -179.414 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo -81.1 -30.18 1.74 Allowed 'Trans proline' 0 C--O 1.239 0.572 0 C-N-CA 122.345 2.03 . . . . 0.0 114.18 -174.577 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -76.74 -30.4 56.58 Favored 'General case' 0 N--CA 1.453 -0.309 0 O-C-N 121.141 -0.974 . . . . 0.0 110.833 173.365 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 48.9 m -136.92 98.08 3.68 Favored 'General case' 0 C--O 1.219 -0.527 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 -168.82 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 26.9 mp0 -56.97 -6.68 0.37 Allowed 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 125.942 1.697 . . . . 0.0 113.782 -178.985 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 25.4 m-85 -66.26 103.51 1.01 Allowed 'General case' 0 N--CA 1.446 -0.643 0 C-N-CA 126.049 1.74 . . . . 0.0 107.803 173.549 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 50.2 m-85 -59.56 156.94 12.42 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 125.056 1.342 . . . . 0.0 109.771 178.235 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 66.7 t80 -111.57 112.76 24.71 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 125.169 1.388 . . . . 0.0 108.042 177.579 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 50.3 t30 -84.15 81.41 8.82 Favored 'General case' 0 N--CA 1.446 -0.651 0 C-N-CA 125.875 1.67 . . . . 0.0 109.098 178.096 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -50.21 -30.83 12.36 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 124.82 1.248 . . . . 0.0 112.354 178.425 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -53.65 -36.61 62.27 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 127.182 2.193 . . . . 0.0 113.68 -179.35 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 60.5 m -128.59 -1.0 5.52 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.656 1.182 . . . . 0.0 112.543 -179.505 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 20.6 mt-30 65.7 35.97 6.6 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.799 1.639 . . . . 0.0 110.166 -169.494 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -103.78 170.39 7.95 Favored 'General case' 0 N--CA 1.468 0.451 0 O-C-N 120.435 -1.416 . . . . 0.0 110.822 -175.331 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 4.2 m-85 -117.98 133.02 56.32 Favored 'General case' 0 C--O 1.234 0.245 0 C-N-CA 124.888 1.275 . . . . 0.0 107.898 177.771 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.455 ' HA ' ' HA ' ' A' ' 63' ' ' PRO . 41.9 mt -132.9 177.84 7.34 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 125.777 1.631 . . . . 0.0 109.135 -175.136 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 32.5 p90 -139.16 153.15 47.89 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 125.457 1.503 . . . . 0.0 108.697 168.611 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 57.2 t-105 -85.71 128.6 34.83 Favored 'General case' 0 C--O 1.233 0.227 0 N-CA-C 106.806 -1.554 . . . . 0.0 106.806 168.927 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 61.8 t0 -121.16 100.01 6.81 Favored 'General case' 0 N--CA 1.446 -0.657 0 N-CA-C 108.444 -0.946 . . . . 0.0 108.444 -174.743 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -71.23 -15.79 74.89 Favored Glycine 0 CA--C 1.526 0.732 0 CA-C-O 118.317 -1.268 . . . . 0.0 112.835 176.95 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -62.99 -43.96 97.35 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 119.615 1.708 . . . . 0.0 107.028 173.389 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 5.6 mtt180 -107.1 -6.44 17.39 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 125.097 1.359 . . . . 0.0 113.288 -170.494 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 86.1 mtt180 43.88 60.81 2.55 Favored 'General case' 0 CA--C 1.52 -0.205 0 C-N-CA 127.989 2.515 . . . . 0.0 109.753 -169.874 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 6.2 t -150.2 172.2 15.71 Favored 'General case' 0 N--CA 1.447 -0.594 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 -179.831 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 74.0 m-85 -104.43 129.16 52.41 Favored 'General case' 0 C--O 1.236 0.363 0 N-CA-C 108.701 -0.852 . . . . 0.0 108.701 166.223 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -126.16 154.98 74.32 Favored Pre-proline 0 C--N 1.327 -0.388 0 C-N-CA 127.272 2.229 . . . . 0.0 108.815 -177.142 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . 0.455 ' HA ' ' HA ' ' A' ' 52' ' ' LEU . 68.5 Cg_endo -75.39 137.73 21.24 Favored 'Trans proline' 0 N--CA 1.456 -0.691 0 C-N-CA 122.104 1.869 . . . . 0.0 111.726 -176.986 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.461 0.113 0 C-N-CA 124.847 1.259 . . . . 0.0 111.703 -178.047 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 27.9 m-85 . . . . . 0 CA--C 1.536 0.432 0 CA-C-O 119.646 -0.216 . . . . 0.0 111.52 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -65.67 170.09 11.83 Favored 'Trans proline' 0 CA--C 1.536 0.582 0 C-N-CA 123.819 3.012 . . . . 0.0 109.842 165.313 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 42.4 t -109.23 86.19 3.96 Favored Pre-proline 0 CA--C 1.536 0.428 0 C-N-CA 125.277 1.431 . . . . 0.0 108.539 -170.479 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 42.1 Cg_endo -75.93 166.78 27.44 Favored 'Trans proline' 0 N--CA 1.449 -1.103 0 C-N-CA 121.74 1.627 . . . . 0.0 110.34 -174.366 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 61.5 t0 -142.61 129.38 20.47 Favored 'General case' 0 C--O 1.237 0.412 0 N-CA-C 107.08 -1.452 . . . . 0.0 107.08 173.838 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.476 HG21 ' CE1' ' A' ' 36' ' ' TYR . 12.3 p -53.85 -24.55 10.57 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.352 0 C-N-CA 124.626 1.17 . . . . 0.0 111.995 176.039 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 38.7 t -45.54 -29.54 1.2 Allowed 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.74 1.616 . . . . 0.0 112.389 170.267 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 49.0 p -109.68 2.22 20.03 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 125.149 1.38 . . . . 0.0 112.879 -171.557 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 15.7 m-30 -77.37 175.49 9.72 Favored 'General case' 0 C--O 1.236 0.382 0 O-C-N 121.302 -0.873 . . . . 0.0 110.605 -178.973 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 80.9 mt-30 -116.85 106.59 13.62 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 125.263 1.425 . . . . 0.0 107.473 -176.313 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 49.4 t80 -66.34 147.11 53.78 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.826 -0.435 . . . . 0.0 109.826 176.371 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -135.08 86.0 2.22 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 125.319 1.448 . . . . 0.0 107.203 176.709 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -49.86 -32.22 13.86 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 126.946 2.098 . . . . 0.0 113.635 179.415 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 7.1 t -60.54 -18.65 53.61 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 125.035 1.334 . . . . 0.0 112.503 179.165 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 58.6 m -107.17 -50.3 3.11 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 118.965 0.802 . . . . 0.0 109.582 153.967 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 117.27 9.56 10.38 Favored Glycine 0 CA--C 1.522 0.499 0 C-N-CA 125.452 1.501 . . . . 0.0 112.05 -172.048 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -105.63 168.94 8.77 Favored 'General case' 0 CA--C 1.519 -0.236 0 CA-C-N 118.576 1.188 . . . . 0.0 109.011 -175.443 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 94.8 m-85 -93.33 147.37 22.99 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 107.602 -1.258 . . . . 0.0 107.602 167.884 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 14.9 t80 -111.96 136.11 51.72 Favored 'General case' 0 N--CA 1.442 -0.871 0 C-N-CA 126.35 1.86 . . . . 0.0 107.027 171.57 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -119.69 77.71 21.29 Favored Pre-proline 0 N--CA 1.437 -1.091 0 C-N-CA 125.407 1.483 . . . . 0.0 108.773 -162.874 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 22.6 Cg_endo -62.9 -12.13 27.82 Favored 'Trans proline' 0 C--N 1.348 0.518 0 C-N-CA 122.83 2.354 . . . . 0.0 113.445 -176.861 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 21.0 mm-40 -62.71 -19.92 64.38 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.68 0.792 . . . . 0.0 111.111 174.459 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 5.8 p -141.74 -23.58 0.71 Allowed 'General case' 0 C--O 1.234 0.286 0 N-CA-C 113.834 1.049 . . . . 0.0 113.834 178.569 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 79.03 43.2 11.08 Favored Glycine 0 CA--C 1.531 1.034 0 N-CA-C 109.905 -1.278 . . . . 0.0 109.905 -166.301 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 42.3 mt -111.84 178.55 4.28 Favored 'General case' 0 C--O 1.234 0.282 0 C-N-CA 124.712 1.205 . . . . 0.0 108.175 165.659 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 36.9 m-85 -123.65 154.63 39.09 Favored 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 124.883 1.273 . . . . 0.0 107.605 166.304 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.476 ' CE1' HG21 ' A' ' 15' ' ' VAL . 24.3 t80 -131.02 156.06 45.79 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 125.414 1.485 . . . . 0.0 109.358 -178.217 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -127.22 144.15 49.62 Favored Pre-proline 0 CA--C 1.536 0.436 0 C-N-CA 123.649 0.78 . . . . 0.0 110.359 175.529 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -74.28 -31.75 7.21 Favored 'Trans proline' 0 CA--C 1.535 0.54 0 C-N-CA 122.894 2.396 . . . . 0.0 113.849 -176.758 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 8.5 m-80 -75.38 -29.62 59.91 Favored 'General case' 0 N--CA 1.462 0.144 0 CA-C-N 119.346 0.976 . . . . 0.0 109.925 170.395 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -129.64 89.73 2.88 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 123.881 0.873 . . . . 0.0 109.841 -158.267 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -68.15 9.94 0.27 Allowed 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 124.49 1.116 . . . . 0.0 112.913 -177.627 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 56.6 m-85 -81.78 112.77 19.24 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 126.589 1.956 . . . . 0.0 106.947 170.314 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 23.1 m-85 -77.96 124.49 28.07 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 124.255 1.022 . . . . 0.0 111.036 -177.681 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 92.1 t80 -77.2 118.85 20.12 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 125.153 1.381 . . . . 0.0 108.983 178.925 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 26.4 t30 -90.41 83.96 5.96 Favored 'General case' 0 CA--C 1.512 -0.489 0 C-N-CA 125.432 1.493 . . . . 0.0 109.565 -178.558 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -53.26 -26.03 16.64 Favored 'General case' 0 CA--C 1.538 0.504 0 N-CA-C 114.37 1.248 . . . . 0.0 114.37 -173.734 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -52.67 -66.01 0.46 Allowed 'General case' 0 C--O 1.236 0.343 0 C-N-CA 125.898 1.679 . . . . 0.0 109.084 178.178 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 19.2 m -112.69 22.67 14.3 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 124.922 1.289 . . . . 0.0 111.258 -171.272 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . 0.337 5.3 pt20 44.65 34.14 1.08 Allowed 'General case' 0 CA--C 1.554 1.11 0 C-N-CA 126.72 2.008 . . . . 0.0 113.312 -178.525 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 7.0 mm-40 -97.47 152.69 18.73 Favored 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 126.483 1.913 . . . . 0.0 112.26 178.844 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 3.4 m-30 -95.57 139.72 31.42 Favored 'General case' 0 N--CA 1.47 0.566 0 O-C-N 120.833 -1.167 . . . . 0.0 108.762 172.862 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.486 ' HA ' ' H ' ' A' ' 64' ' ' ALA . 41.4 mt -131.33 174.29 10.21 Favored 'General case' 0 N--CA 1.465 0.279 0 C-N-CA 126.749 2.02 . . . . 0.0 110.267 -176.478 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 31.2 p90 -143.53 149.14 37.03 Favored 'General case' 0 C--O 1.238 0.493 0 C-N-CA 124.107 0.963 . . . . 0.0 110.361 168.077 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 50.1 t-105 -93.16 92.6 7.84 Favored 'General case' 0 CA--C 1.516 -0.36 0 N-CA-C 105.075 -2.195 . . . . 0.0 105.075 -176.53 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 43.8 t0 -87.52 96.45 10.4 Favored 'General case' 0 N--CA 1.446 -0.669 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 -177.691 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -59.44 -15.37 31.55 Favored Glycine 0 CA--C 1.53 0.971 0 CA-C-O 118.414 -1.215 . . . . 0.0 112.694 178.754 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 22.7 mt-10 -66.92 -34.84 78.65 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 119.987 1.894 . . . . 0.0 110.1 175.4 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 21.1 mtt180 -109.58 -4.97 15.86 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 125.541 1.536 . . . . 0.0 111.453 -177.05 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 76.1 mtm180 44.21 49.16 7.77 Favored 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 126.374 1.87 . . . . 0.0 110.169 -174.697 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 3.2 t -147.13 178.81 8.09 Favored 'General case' 0 N--CA 1.443 -0.798 0 N-CA-C 108.909 -0.775 . . . . 0.0 108.909 -177.451 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 89.3 m-85 -109.76 131.72 54.8 Favored 'General case' 0 C--O 1.24 0.572 0 N-CA-C 108.146 -1.057 . . . . 0.0 108.146 178.1 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -125.88 154.43 73.56 Favored Pre-proline 0 C--N 1.325 -0.484 0 C-N-CA 125.788 1.635 . . . . 0.0 108.907 176.092 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . 0.42 ' HA ' HD23 ' A' ' 52' ' ' LEU . 72.0 Cg_endo -75.43 124.03 8.06 Favored 'Trans proline' 0 N--CA 1.453 -0.871 0 C-N-CA 122.562 2.174 . . . . 0.0 111.105 179.497 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.486 ' H ' ' HA ' ' A' ' 52' ' ' LEU . . . . . . . . 0 C--O 1.236 0.355 0 CA-C-O 122.531 1.158 . . . . 0.0 109.379 166.674 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 68.6 m-85 . . . . . 0 CA--C 1.537 0.457 0 CA-C-O 119.479 -0.296 . . . . 0.0 111.208 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -71.7 178.47 5.71 Favored 'Trans proline' 0 N--CA 1.459 -0.514 0 C-N-CA 123.964 3.109 . . . . 0.0 110.848 167.498 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 37.1 t -104.6 85.85 1.26 Allowed Pre-proline 0 CA--C 1.541 0.609 0 C-N-CA 127.009 2.123 . . . . 0.0 108.987 -171.494 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_endo -69.91 171.71 14.14 Favored 'Trans proline' 0 C--O 1.237 0.462 0 C-N-CA 123.142 2.561 . . . . 0.0 111.045 179.845 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 14.0 t0 -144.61 139.94 28.41 Favored 'General case' 0 C--O 1.224 -0.238 0 N-CA-C 107.412 -1.329 . . . . 0.0 107.412 178.401 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 6.5 p -65.61 -19.89 26.46 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.599 0 CA-C-N 119.291 0.951 . . . . 0.0 111.22 175.382 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 10.6 t -60.42 -17.83 46.87 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-O 117.334 -1.317 . . . . 0.0 112.092 173.079 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 29.7 p -100.15 -6.13 26.7 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 121.577 1.989 . . . . 0.0 113.028 176.005 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 13.3 m-30 -70.74 173.67 6.96 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 119.531 1.06 . . . . 0.0 112.472 -174.322 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 77.0 mt-30 -114.79 109.28 17.94 Favored 'General case' 0 CA--C 1.528 0.122 0 C-N-CA 126.142 1.777 . . . . 0.0 108.949 176.745 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 81.8 t80 -68.64 142.08 55.2 Favored 'General case' 0 C--O 1.238 0.491 0 CA-C-N 119.343 0.974 . . . . 0.0 110.674 169.708 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 3.6 t0 -119.71 111.42 18.0 Favored 'General case' 0 CA--C 1.504 -0.822 0 N-CA-C 106.686 -1.598 . . . . 0.0 106.686 170.817 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -64.2 -21.94 66.75 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 118.155 -0.926 . . . . 0.0 112.927 178.082 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 1.3 t -61.34 -38.76 88.1 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 118.327 0.512 . . . . 0.0 110.555 -171.82 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 7.8 m -113.36 -19.34 11.77 Favored 'General case' 0 C--O 1.233 0.219 0 C-N-CA 124.703 1.201 . . . . 0.0 111.018 173.87 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 81.46 34.49 25.51 Favored Glycine 0 C--N 1.337 0.599 0 N-CA-C 110.74 -0.944 . . . . 0.0 110.74 174.692 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 4.4 m-85 -119.69 171.05 8.66 Favored 'General case' 0 N--CA 1.463 0.213 0 C-N-CA 126.482 1.913 . . . . 0.0 108.352 178.475 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 67.5 m-85 -103.76 141.01 36.83 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 107.701 -1.222 . . . . 0.0 107.701 171.929 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 52.3 t80 -102.2 136.91 41.21 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 125.868 1.667 . . . . 0.0 106.574 169.91 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 16.7 t0 -97.82 87.45 0.53 Allowed Pre-proline 0 C--N 1.327 -0.387 0 C-N-CA 126.458 1.903 . . . . 0.0 110.332 179.826 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -61.51 -10.54 16.63 Favored 'Trans proline' 0 CA--C 1.537 0.647 0 C-N-CA 121.618 1.546 . . . . 0.0 113.236 176.22 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -80.88 -13.52 58.85 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 124.643 1.177 . . . . 0.0 112.219 -177.784 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 69.8 p -146.48 -23.81 0.43 Allowed 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 113.98 1.104 . . . . 0.0 113.98 168.2 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 108.14 3.27 33.7 Favored Glycine 0 CA--C 1.53 1.009 0 C-N-CA 124.881 1.229 . . . . 0.0 113.936 -179.272 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 39.4 mt -71.38 178.19 3.55 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 125.562 1.545 . . . . 0.0 110.587 173.983 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 54.3 m-85 -116.7 167.19 11.31 Favored 'General case' 0 C--O 1.237 0.424 0 C-N-CA 124.682 1.193 . . . . 0.0 108.333 158.295 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 80.3 t80 -141.4 163.06 33.97 Favored 'General case' 0 C--O 1.237 0.431 0 C-N-CA 126.376 1.87 . . . . 0.0 108.916 176.808 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -133.11 143.9 50.39 Favored Pre-proline 0 CA--C 1.536 0.406 0 C-N-CA 124.189 0.996 . . . . 0.0 110.503 177.971 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -73.71 -38.65 2.27 Favored 'Trans proline' 0 N--CA 1.454 -0.84 0 C-N-CA 123.236 2.624 . . . . 0.0 112.656 -176.017 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 27.0 m-80 -78.13 -35.97 48.38 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-N 119.091 0.86 . . . . 0.0 110.414 -178.272 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 48.8 p -130.86 91.95 3.14 Favored 'General case' 0 C--O 1.223 -0.301 0 N-CA-C 108.379 -0.971 . . . . 0.0 108.379 -159.886 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -60.79 0.17 0.23 Allowed 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 126.311 1.844 . . . . 0.0 115.549 -163.828 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 38.2 m-85 -68.53 123.98 22.33 Favored 'General case' 0 N--CA 1.448 -0.575 0 C-N-CA 125.134 1.374 . . . . 0.0 108.927 174.271 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 25.6 m-85 -75.92 141.64 42.25 Favored 'General case' 0 N--CA 1.448 -0.54 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 175.789 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 56.9 t80 -102.51 115.32 30.34 Favored 'General case' 0 C--N 1.33 -0.242 0 C-N-CA 123.949 0.899 . . . . 0.0 109.288 176.318 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 26.4 t30 -88.29 87.16 7.21 Favored 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 106.992 -1.484 . . . . 0.0 106.992 172.43 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -48.62 -39.6 24.59 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 124.618 1.167 . . . . 0.0 110.112 175.858 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -55.95 -11.34 1.02 Allowed 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 127.673 2.389 . . . . 0.0 116.409 -177.807 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -145.02 6.56 1.16 Allowed 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 119.728 1.149 . . . . 0.0 111.268 160.847 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 50.4 mt-30 64.94 15.78 10.14 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 129.345 3.058 . . . . 0.0 113.273 -168.045 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.92 148.64 49.89 Favored 'General case' 0 N--CA 1.466 0.334 0 O-C-N 121.096 -1.003 . . . . 0.0 111.19 -179.399 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 8.8 m-85 -106.34 132.31 52.53 Favored 'General case' 0 C--O 1.234 0.262 0 N-CA-C 108.165 -1.05 . . . . 0.0 108.165 168.037 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 78.5 mt -135.17 -176.03 4.12 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 127.136 2.174 . . . . 0.0 107.511 -172.741 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 19.6 p90 -146.7 160.24 42.47 Favored 'General case' 0 C--O 1.235 0.316 0 O-C-N 120.758 -1.213 . . . . 0.0 109.527 163.871 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 45.9 t-105 -82.39 105.07 13.15 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 125.15 1.38 . . . . 0.0 108.068 173.104 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 23.1 t0 -89.94 96.86 10.87 Favored 'General case' 0 C--O 1.235 0.339 0 N-CA-C 105.986 -1.857 . . . . 0.0 105.986 170.858 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -76.49 -7.38 85.35 Favored Glycine 0 CA--C 1.531 1.075 0 CA-C-O 118.235 -1.314 . . . . 0.0 112.804 -179.989 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 25.3 mt-10 -73.58 -48.6 31.55 Favored 'General case' 0 C--N 1.341 0.236 0 CA-C-N 119.853 1.827 . . . . 0.0 108.808 172.158 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -81.02 -14.62 57.74 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.631 1.172 . . . . 0.0 112.449 174.01 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.9 mpt_? 46.91 61.42 2.85 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 125.436 1.495 . . . . 0.0 109.913 -164.339 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 5.6 t -150.38 174.85 12.42 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-O 121.543 0.687 . . . . 0.0 109.978 174.059 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 93.6 m-85 -108.63 121.25 44.63 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 125.158 1.383 . . . . 0.0 108.106 179.028 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -125.21 154.31 71.82 Favored Pre-proline 0 C--N 1.324 -0.514 0 C-N-CA 125.403 1.481 . . . . 0.0 110.25 -170.263 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_endo -70.0 126.57 13.3 Favored 'Trans proline' 0 N--CA 1.454 -0.843 0 C-N-CA 122.479 2.119 . . . . 0.0 110.527 178.937 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.332 -0.158 0 N-CA-C 114.235 1.198 . . . . 0.0 114.235 -173.621 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 49.9 m-85 . . . . . 0 CA--C 1.547 0.837 0 N-CA-C 112.579 0.585 . . . . 0.0 112.579 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -69.08 -176.51 1.32 Allowed 'Trans proline' 0 CA--C 1.539 0.742 0 C-N-CA 124.672 3.582 . . . . 0.0 110.699 164.336 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 45.9 t -107.89 86.79 3.26 Favored Pre-proline 0 CA--C 1.541 0.625 0 C-N-CA 125.612 1.565 . . . . 0.0 109.351 -178.881 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 94.3 Cg_endo -67.76 154.81 72.17 Favored 'Trans proline' 0 C--N 1.348 0.523 0 C-N-CA 123.276 2.651 . . . . 0.0 111.772 175.513 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -127.13 129.17 47.41 Favored 'General case' 0 N--CA 1.433 -1.277 0 C-N-CA 126.003 1.721 . . . . 0.0 109.723 -175.254 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 11.8 p -60.03 -24.44 30.02 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 O-C-N 121.776 -0.577 . . . . 0.0 111.41 173.452 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -49.84 -53.73 23.74 Favored 'General case' 0 N--CA 1.438 -1.044 0 C-N-CA 125.818 1.647 . . . . 0.0 112.213 173.507 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 4.4 t -77.91 -4.22 45.71 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-O 117.897 -1.049 . . . . 0.0 112.716 -178.985 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 11.9 m-30 -64.6 156.51 29.75 Favored 'General case' 0 C--O 1.238 0.479 0 CA-C-N 121.412 1.915 . . . . 0.0 111.018 178.888 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 63.0 mt-30 -92.74 121.67 34.37 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 124.332 1.053 . . . . 0.0 108.219 169.148 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 33.8 t80 -63.28 158.67 19.64 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 118.653 0.661 . . . . 0.0 110.639 163.085 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -135.32 108.05 7.49 Favored 'General case' 0 CA--C 1.513 -0.465 0 C-N-CA 123.992 0.917 . . . . 0.0 109.375 160.158 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 1.9 pt-20 -61.34 -25.24 67.01 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 124.636 1.174 . . . . 0.0 112.675 177.912 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 1.4 t -62.73 -50.46 71.0 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 119.388 0.995 . . . . 0.0 109.587 -177.245 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 74.2 m -78.03 -47.76 17.69 Favored 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 124.651 1.18 . . . . 0.0 109.315 173.671 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 102.43 13.51 30.36 Favored Glycine 0 CA--C 1.53 1.027 0 C-N-CA 125.153 1.359 . . . . 0.0 111.004 -168.834 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 3.8 m-85 -111.53 178.28 4.38 Favored 'General case' 0 C--O 1.227 -0.129 0 C-N-CA 126.713 2.005 . . . . 0.0 109.347 -168.635 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 72.1 m-85 -117.13 156.28 27.89 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 108.521 -0.918 . . . . 0.0 108.521 170.889 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 42.3 t80 -114.33 134.95 54.6 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 127.213 2.205 . . . . 0.0 108.78 175.866 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 56.3 t0 -98.56 87.13 0.54 Allowed Pre-proline 0 C--O 1.237 0.404 0 C-N-CA 127.366 2.266 . . . . 0.0 110.381 -178.593 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 61.7 Cg_endo -62.28 -8.55 12.7 Favored 'Trans proline' 0 N--CA 1.457 -0.671 0 C-N-CA 122.085 1.857 . . . . 0.0 114.254 -178.565 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -74.14 -28.2 61.21 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 119.473 1.033 . . . . 0.0 110.703 178.907 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.593 HG21 ' CE2' ' A' ' 61' ' ' TYR . 0.1 OUTLIER -142.35 -22.78 0.68 Allowed 'General case' 0 C--O 1.238 0.48 0 C-N-CA 124.238 1.015 . . . . 0.0 113.317 -164.901 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 103.0 -3.41 48.32 Favored Glycine 0 N--CA 1.444 -0.784 0 C-N-CA 125.091 1.329 . . . . 0.0 112.841 169.593 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.512 HD21 ' HB ' ' A' ' 32' ' ' THR . 0.0 OUTLIER -74.86 173.86 10.02 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 118.807 1.304 . . . . 0.0 108.298 -178.721 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 37.2 m-85 -107.14 165.05 11.65 Favored 'General case' 0 C--N 1.321 -0.639 0 C-N-CA 124.389 1.075 . . . . 0.0 108.609 162.509 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 71.2 t80 -144.0 144.69 31.78 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 126.618 1.967 . . . . 0.0 108.092 -172.672 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -113.26 143.08 28.57 Favored Pre-proline 0 C--O 1.236 0.378 0 C-N-CA 124.952 1.301 . . . . 0.0 108.513 175.706 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 91.2 Cg_endo -77.64 -29.33 4.66 Favored 'Trans proline' 0 N--CA 1.456 -0.729 0 C-N-CA 121.917 1.744 . . . . 0.0 112.423 -178.519 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -73.97 -34.6 64.32 Favored 'General case' 0 C--O 1.234 0.279 0 C-N-CA 123.983 0.913 . . . . 0.0 110.734 174.488 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 1.1 m -131.64 93.5 3.34 Favored 'General case' 0 C--O 1.222 -0.381 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 -157.471 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 8.2 mp0 -64.88 6.68 0.21 Allowed 'General case' 0 CA--C 1.549 0.922 0 O-C-N 121.083 -1.011 . . . . 0.0 113.487 -178.013 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 24.3 m-85 -77.13 104.42 7.62 Favored 'General case' 0 C--O 1.235 0.333 0 O-C-N 120.626 -1.296 . . . . 0.0 108.668 166.893 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 29.0 m-85 -64.3 162.89 13.94 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 126.955 2.102 . . . . 0.0 110.784 179.727 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 64.2 t80 -120.25 110.25 16.36 Favored 'General case' 0 CA--C 1.521 -0.143 0 C-N-CA 125.934 1.694 . . . . 0.0 109.038 179.19 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 41.9 t30 -85.29 86.6 7.36 Favored 'General case' 0 C--N 1.32 -0.716 0 C-N-CA 125.082 1.353 . . . . 0.0 109.142 175.985 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -58.37 -15.55 11.07 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 125.401 1.48 . . . . 0.0 114.049 -176.356 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -54.63 -76.5 0.03 OUTLIER 'General case' 0 CA--C 1.528 0.111 0 C-N-CA 125.027 1.331 . . . . 0.0 108.923 170.475 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 10.3 m -94.59 13.69 23.35 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.243 0.617 . . . . 0.0 110.624 -174.342 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 49.4 mt-30 56.28 24.61 8.41 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 127.3 2.24 . . . . 0.0 112.802 -173.049 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -92.75 166.84 12.25 Favored 'General case' 0 CA--C 1.532 0.285 0 O-C-N 121.269 -0.894 . . . . 0.0 111.629 -167.103 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 4.8 m-85 -109.79 138.64 45.87 Favored 'General case' 0 N--CA 1.467 0.401 0 O-C-N 121.4 -0.812 . . . . 0.0 109.117 -179.996 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.42 HD23 ' HA ' ' A' ' 63' ' ' PRO . 32.8 mt -134.48 179.69 6.13 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 124.82 1.248 . . . . 0.0 110.294 -177.172 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 14.1 p90 -145.75 154.35 41.95 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 124.545 1.138 . . . . 0.0 109.113 161.019 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 53.7 t-105 -80.43 120.26 24.21 Favored 'General case' 0 C--O 1.24 0.558 0 N-CA-C 107.181 -1.415 . . . . 0.0 107.181 167.714 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 42.3 t0 -114.76 95.36 5.19 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 123.926 0.89 . . . . 0.0 108.975 174.552 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -66.67 -15.94 64.96 Favored Glycine 0 N--CA 1.444 -0.796 0 CA-C-O 117.492 -1.727 . . . . 0.0 112.564 174.244 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -64.54 -23.83 67.4 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 120.681 2.24 . . . . 0.0 109.551 171.324 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 4.5 mtt-85 -120.11 -2.3 10.22 Favored 'General case' 0 C--O 1.233 0.208 0 C-N-CA 126.062 1.745 . . . . 0.0 112.677 -177.537 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 81.3 mtp180 44.07 50.28 7.38 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 125.643 1.577 . . . . 0.0 110.607 -171.919 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 4.9 t -151.31 174.85 12.81 Favored 'General case' 0 N--CA 1.45 -0.437 0 O-C-N 121.691 -0.631 . . . . 0.0 110.49 179.399 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . 0.593 ' CE2' HG21 ' A' ' 32' ' ' THR . 97.4 m-85 -100.11 135.23 41.84 Favored 'General case' 0 C--O 1.238 0.467 0 N-CA-C 108.547 -0.909 . . . . 0.0 108.547 171.181 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -126.06 153.81 74.02 Favored Pre-proline 0 C--N 1.321 -0.645 0 C-N-CA 125.081 1.353 . . . . 0.0 107.431 -178.86 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . 0.42 ' HA ' HD23 ' A' ' 52' ' ' LEU . 88.2 Cg_endo -84.43 131.28 4.76 Favored 'Trans proline' 0 N--CA 1.457 -0.672 0 C-N-CA 122.257 1.971 . . . . 0.0 109.99 -177.591 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.497 0 N-CA-C 115.87 1.804 . . . . 0.0 115.87 -167.08 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 27.6 m-85 . . . . . 0 CA--C 1.54 0.586 0 N-CA-C 110.163 -0.31 . . . . 0.0 110.163 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -72.19 -173.12 1.01 Allowed 'Trans proline' 0 CA--C 1.534 0.482 0 C-N-CA 124.4 3.4 . . . . 0.0 110.415 166.82 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 61.1 t -113.56 85.66 9.38 Favored Pre-proline 0 CA--C 1.539 0.55 0 N-CA-C 106.204 -1.776 . . . . 0.0 106.204 172.739 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 69.7 Cg_endo -72.86 161.85 42.62 Favored 'Trans proline' 0 CA--C 1.539 0.751 0 C-N-CA 122.399 2.066 . . . . 0.0 110.572 -177.816 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -136.13 137.14 40.69 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 123.773 0.829 . . . . 0.0 110.627 -175.161 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.457 ' HA ' ' CD2' ' A' ' 18' ' ' TYR . 11.9 p -61.2 -22.01 26.21 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.664 0 N-CA-C 112.992 0.738 . . . . 0.0 112.992 179.479 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 3.0 t -68.98 8.35 0.55 Allowed 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 125.145 1.378 . . . . 0.0 112.586 171.748 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.3 t -126.3 4.85 7.02 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 120.598 1.545 . . . . 0.0 111.358 169.174 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . 0.457 ' CD2' ' HA ' ' A' ' 15' ' ' VAL . 16.0 m-30 -82.78 150.49 26.61 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 118.921 0.782 . . . . 0.0 109.719 179.768 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . 0.425 HE21 ' HG3' ' A' ' 30' ' ' PRO . 71.8 mt-30 -95.42 103.92 15.8 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 127.17 2.188 . . . . 0.0 111.035 177.477 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 88.0 t80 -58.12 151.48 18.85 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 120.271 1.396 . . . . 0.0 110.376 -179.991 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -129.61 93.58 3.57 Favored 'General case' 0 CA--C 1.516 -0.354 0 N-CA-C 106.091 -1.818 . . . . 0.0 106.091 177.345 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 1.9 pt-20 -51.99 -33.09 36.52 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-O 118.528 -0.748 . . . . 0.0 112.291 176.487 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 1.3 t -68.82 -5.68 22.32 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 123.297 0.639 . . . . 0.0 111.645 -174.408 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 50.7 m -137.1 -12.91 1.64 Allowed 'General case' 0 CA--C 1.53 0.204 0 O-C-N 120.185 -1.572 . . . . 0.0 112.463 167.874 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 88.39 18.77 54.59 Favored Glycine 0 C--N 1.338 0.64 0 CA-C-N 118.983 0.81 . . . . 0.0 112.124 169.936 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 7.1 m-85 -125.04 175.16 7.53 Favored 'General case' 0 C--N 1.332 -0.195 0 C-N-CA 126.88 2.072 . . . . 0.0 108.122 -171.725 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 58.8 m-85 -99.26 135.35 40.8 Favored 'General case' 0 N--CA 1.448 -0.529 0 N-CA-C 106.892 -1.522 . . . . 0.0 106.892 176.114 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 25.3 t80 -99.41 141.24 32.46 Favored 'General case' 0 C--O 1.238 0.472 0 N-CA-C 107.047 -1.464 . . . . 0.0 107.047 168.026 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 29.5 m-20 -118.45 76.44 12.96 Favored Pre-proline 0 CA--C 1.535 0.389 0 N-CA-C 108.935 -0.765 . . . . 0.0 108.935 -159.088 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.425 ' HG3' HE21 ' A' ' 19' ' ' GLN . 54.3 Cg_endo -65.05 -10.64 26.36 Favored 'Trans proline' 0 CA--C 1.534 0.486 0 C-N-CA 124.326 3.35 . . . . 0.0 114.722 -167.644 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 33.7 tt0 -76.58 -25.73 54.29 Favored 'General case' 0 CA--C 1.537 0.474 0 O-C-N 121.504 -0.747 . . . . 0.0 110.979 175.985 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.599 ' HB ' HD23 ' A' ' 34' ' ' LEU . 0.8 OUTLIER -136.34 -26.32 1.13 Allowed 'General case' 0 C--O 1.234 0.278 0 C-N-CA 124.215 1.006 . . . . 0.0 112.495 -165.642 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 108.12 -3.77 33.5 Favored Glycine 0 CA--C 1.527 0.811 0 C-N-CA 124.069 0.843 . . . . 0.0 115.074 169.924 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.599 HD23 ' HB ' ' A' ' 32' ' ' THR . 0.9 OUTLIER -84.36 -177.11 6.54 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 126.591 1.957 . . . . 0.0 109.975 -172.739 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 25.0 m-85 -115.95 139.04 50.63 Favored 'General case' 0 C--O 1.238 0.459 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 155.569 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 62.4 t80 -104.25 154.43 19.79 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 125.426 1.49 . . . . 0.0 108.246 178.911 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 37.0 t70 -127.4 143.57 47.76 Favored Pre-proline 0 N--CA 1.467 0.388 0 N-CA-C 112.157 0.428 . . . . 0.0 112.157 167.184 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -67.61 -31.01 34.16 Favored 'Trans proline' 0 N--CA 1.455 -0.771 0 C-N-CA 122.953 2.435 . . . . 0.0 114.205 -179.555 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 4.2 m-80 -87.19 -17.57 32.36 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 119.58 1.082 . . . . 0.0 111.626 172.692 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -138.85 81.57 1.85 Allowed 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 -162.52 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -60.5 5.91 0.04 OUTLIER 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.146 1.378 . . . . 0.0 113.709 177.171 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 24.3 m-85 -75.64 93.56 3.08 Favored 'General case' 0 N--CA 1.444 -0.74 0 C-N-CA 125.302 1.441 . . . . 0.0 107.766 171.598 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 43.8 m-85 -58.54 123.97 18.07 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 124.378 1.071 . . . . 0.0 108.675 -179.74 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 8.0 t80 -86.22 108.22 18.27 Favored 'General case' 0 N--CA 1.447 -0.609 0 C-N-CA 125.243 1.417 . . . . 0.0 107.219 -176.65 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 33.6 t30 -82.62 79.42 9.04 Favored 'General case' 0 N--CA 1.446 -0.655 0 N-CA-C 107.997 -1.112 . . . . 0.0 107.997 171.326 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -53.28 -33.12 51.92 Favored 'General case' 0 C--N 1.341 0.213 0 C-N-CA 123.553 0.741 . . . . 0.0 112.129 -178.783 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -44.3 -62.23 1.24 Allowed 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 128.261 2.625 . . . . 0.0 109.904 177.379 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.1 t -106.97 11.22 30.05 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.634 1.173 . . . . 0.0 110.578 -175.233 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 34.0 mt-30 46.98 40.81 9.98 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 127.011 2.125 . . . . 0.0 110.67 -176.433 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 17.4 mm-40 -103.95 159.73 15.41 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 126.238 1.815 . . . . 0.0 109.017 174.66 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -112.09 129.42 56.23 Favored 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 106.679 -1.6 . . . . 0.0 106.679 170.987 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.445 HD12 HD11 ' A' ' 34' ' ' LEU . 50.8 mt -118.4 177.51 4.79 Favored 'General case' 0 N--CA 1.442 -0.875 0 C-N-CA 126.124 1.769 . . . . 0.0 107.352 -179.748 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 14.0 p90 -141.71 154.2 45.15 Favored 'General case' 0 N--CA 1.441 -0.889 0 N-CA-C 106.786 -1.561 . . . . 0.0 106.786 158.751 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 20.3 t-105 -76.22 136.78 39.71 Favored 'General case' 0 N--CA 1.445 -0.687 0 N-CA-C 106.195 -1.78 . . . . 0.0 106.195 169.453 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 6.6 t0 -131.92 99.43 4.75 Favored 'General case' 0 CA--C 1.507 -0.695 0 CA-C-O 122.442 1.115 . . . . 0.0 109.719 175.102 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -65.89 -8.26 40.6 Favored Glycine 0 N--CA 1.442 -0.913 0 CA-C-O 117.256 -1.858 . . . . 0.0 113.221 -174.449 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . 0.464 ' HG3' ' H ' ' A' ' 58' ' ' ARG . 1.8 pt-20 -72.67 -64.82 0.88 Allowed 'General case' 0 C--N 1.338 0.108 0 CA-C-N 120.363 2.082 . . . . 0.0 107.47 177.342 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . 0.464 ' H ' ' HG3' ' A' ' 57' ' ' GLU . 82.3 mtt180 -74.85 -7.12 52.5 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 125.181 1.392 . . . . 0.0 111.817 179.059 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 90.5 mtt180 44.79 56.25 5.39 Favored 'General case' 0 C--O 1.231 0.128 0 C-N-CA 126.51 1.924 . . . . 0.0 110.55 -172.595 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 7.4 t -146.62 164.0 34.05 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 109.217 -0.66 . . . . 0.0 109.217 167.781 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 27.4 m-85 -81.66 135.93 35.52 Favored 'General case' 0 C--O 1.237 0.426 0 N-CA-C 107.216 -1.402 . . . . 0.0 107.216 166.877 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -126.01 154.77 73.93 Favored Pre-proline 0 C--N 1.323 -0.587 0 C-N-CA 125.806 1.642 . . . . 0.0 108.863 176.585 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -67.98 135.67 35.75 Favored 'Trans proline' 0 N--CA 1.451 -1.012 0 C-N-CA 121.949 1.766 . . . . 0.0 109.715 171.791 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.463 0.187 0 C-N-CA 124.154 0.982 . . . . 0.0 112.698 -178.316 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 51.7 m-85 . . . . . 0 C--O 1.239 0.514 0 N-CA-C 109.43 -0.581 . . . . 0.0 109.43 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -70.62 -175.12 1.25 Allowed 'Trans proline' 0 CA--C 1.537 0.646 0 C-N-CA 124.489 3.459 . . . . 0.0 111.239 167.277 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 38.8 t -104.97 88.12 2.21 Favored Pre-proline 0 CA--C 1.543 0.709 0 C-N-CA 125.991 1.717 . . . . 0.0 109.478 -178.744 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 19.8 Cg_endo -70.55 173.66 11.35 Favored 'Trans proline' 0 CA--C 1.546 1.079 0 C-N-CA 123.087 2.525 . . . . 0.0 110.856 173.549 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -156.62 133.61 10.4 Favored 'General case' 0 N--CA 1.468 0.439 0 O-C-N 121.272 -0.893 . . . . 0.0 110.053 171.932 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.439 ' HA ' ' CD2' ' A' ' 18' ' ' TYR . 12.5 p -54.24 -25.14 12.97 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.42 0 N-CA-C 113.604 0.964 . . . . 0.0 113.604 177.928 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 14.0 m -62.02 -14.07 32.08 Favored 'General case' 0 C--O 1.237 0.406 0 O-C-N 120.943 -1.098 . . . . 0.0 112.96 179.987 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 5.5 t -120.55 9.94 10.98 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 124.012 0.925 . . . . 0.0 111.85 176.187 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . 0.439 ' CD2' ' HA ' ' A' ' 15' ' ' VAL . 17.0 m-30 -73.4 152.6 40.76 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-N 119.708 1.14 . . . . 0.0 109.719 168.858 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 51.6 mt-30 -87.38 115.58 24.9 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 108.529 -0.915 . . . . 0.0 108.529 174.236 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 85.4 t80 -66.32 147.89 52.65 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 118.224 0.465 . . . . 0.0 110.233 168.693 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -119.13 112.58 19.7 Favored 'General case' 0 N--CA 1.442 -0.871 0 C-N-CA 127.681 2.393 . . . . 0.0 106.517 177.829 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -81.6 -15.85 53.39 Favored 'General case' 0 CA--C 1.533 0.314 0 O-C-N 121.396 -0.815 . . . . 0.0 113.087 178.178 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 5.2 t -67.09 -31.77 72.49 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.533 1.133 . . . . 0.0 111.335 179.619 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 69.2 m -128.26 -26.16 2.86 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 119.883 1.22 . . . . 0.0 112.889 171.386 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 104.24 25.3 7.12 Favored Glycine 0 CA--C 1.527 0.806 0 CA-C-O 117.889 -1.506 . . . . 0.0 113.674 172.651 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 2.7 m-85 -110.91 -179.58 3.78 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 120.206 2.003 . . . . 0.0 108.821 -179.84 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 68.2 m-85 -120.88 123.35 42.33 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 124.636 1.174 . . . . 0.0 108.239 178.055 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 23.5 t80 -91.14 134.77 34.26 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 125.571 1.548 . . . . 0.0 110.76 -179.642 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 12.6 t0 -101.11 88.06 0.99 Allowed Pre-proline 0 CA--C 1.533 0.319 0 C-N-CA 128.034 2.534 . . . . 0.0 112.429 178.543 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -64.81 -6.84 13.33 Favored 'Trans proline' 0 CA--C 1.533 0.47 0 C-N-CA 121.656 1.571 . . . . 0.0 115.332 172.002 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 3.3 tm0? -64.92 -52.03 58.66 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 119.852 1.206 . . . . 0.0 108.297 176.032 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 77.7 p -99.97 -51.96 3.56 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-N 118.295 0.498 . . . . 0.0 111.081 174.461 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 125.98 5.82 6.13 Favored Glycine 0 CA--C 1.535 1.341 0 C-N-CA 126.818 2.151 . . . . 0.0 112.135 -166.257 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 84.5 mt -74.21 174.36 8.86 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 119.126 1.463 . . . . 0.0 110.935 176.476 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 27.0 m-85 -120.38 169.77 9.99 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 125.902 1.681 . . . . 0.0 108.294 161.604 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 28.3 t80 -145.52 153.57 41.26 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 128.913 2.885 . . . . 0.0 107.67 -174.935 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 8.9 t0 -121.32 142.51 35.42 Favored Pre-proline 0 CA--C 1.532 0.267 0 C-N-CA 124.968 1.307 . . . . 0.0 107.89 179.419 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -74.74 -32.95 5.37 Favored 'Trans proline' 0 N--CA 1.453 -0.887 0 C-N-CA 121.635 1.557 . . . . 0.0 115.279 -174.101 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -73.32 -35.6 66.08 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 120.508 1.503 . . . . 0.0 108.45 172.072 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 69.4 m -126.43 93.52 3.82 Favored 'General case' 0 N--CA 1.449 -0.494 0 C-N-CA 123.493 0.717 . . . . 0.0 110.246 -157.349 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 25.6 mp0 -55.72 -0.92 0.04 OUTLIER 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 127.34 2.256 . . . . 0.0 114.597 179.531 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 49.3 m-85 -70.9 106.19 3.53 Favored 'General case' 0 N--CA 1.442 -0.839 0 C-N-CA 125.595 1.558 . . . . 0.0 108.194 170.351 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 40.7 m-85 -65.75 153.82 40.72 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 125.613 1.565 . . . . 0.0 109.972 179.01 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 74.9 t80 -108.58 133.95 52.01 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 125.668 1.587 . . . . 0.0 107.983 175.41 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 43.1 t30 -110.8 73.9 0.85 Allowed 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 128.944 2.898 . . . . 0.0 109.619 -173.305 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -49.53 -26.4 3.44 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 125.651 1.58 . . . . 0.0 114.036 -172.014 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 3.1 tt0 -53.95 -31.18 49.62 Favored 'General case' 0 N--CA 1.446 -0.656 0 C-N-CA 128.989 2.915 . . . . 0.0 113.315 174.858 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 4.1 m -143.9 9.6 1.52 Allowed 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 124.894 1.277 . . . . 0.0 111.479 -168.537 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 52.0 mt-30 47.39 30.43 1.57 Allowed 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 126.415 1.886 . . . . 0.0 113.623 -173.907 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -104.22 161.48 14.0 Favored 'General case' 0 C--O 1.233 0.213 0 C-N-CA 125.083 1.353 . . . . 0.0 112.653 -175.995 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -103.26 134.86 45.95 Favored 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 124.7 1.2 . . . . 0.0 110.783 178.336 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 53.8 mt -133.34 179.8 5.98 Favored 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 125.943 1.697 . . . . 0.0 109.193 -177.091 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 14.1 p90 -148.52 155.21 40.85 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 125.103 1.361 . . . . 0.0 108.684 164.518 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 68.9 t-105 -77.42 119.29 20.83 Favored 'General case' 0 C--O 1.233 0.232 0 N-CA-C 107.333 -1.358 . . . . 0.0 107.333 167.878 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 39.7 t0 -98.68 94.44 6.64 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 107.88 -1.155 . . . . 0.0 107.88 167.505 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -62.7 -14.98 53.27 Favored Glycine 0 CA--C 1.531 1.091 0 CA-C-O 119.081 -0.844 . . . . 0.0 113.394 178.13 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -74.6 -17.29 60.74 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 119.228 1.514 . . . . 0.0 110.667 174.941 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 83.9 mtt85 -123.34 -4.49 8.35 Favored 'General case' 0 C--O 1.223 -0.299 0 C-N-CA 125.342 1.457 . . . . 0.0 111.799 178.711 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 97.2 mtt180 44.34 59.36 3.31 Favored 'General case' 0 C--O 1.233 0.209 0 C-N-CA 125.389 1.476 . . . . 0.0 110.335 -173.096 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 5.8 t -152.95 173.67 15.1 Favored 'General case' 0 N--CA 1.448 -0.551 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 177.681 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 82.2 m-85 -104.96 134.34 48.23 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 107.624 -1.25 . . . . 0.0 107.624 173.185 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -126.12 154.6 74.21 Favored Pre-proline 0 C--N 1.324 -0.527 0 C-N-CA 125.327 1.451 . . . . 0.0 109.492 -178.223 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -74.16 125.68 9.95 Favored 'Trans proline' 0 N--CA 1.458 -0.581 0 C-N-CA 123.413 2.742 . . . . 0.0 111.08 -178.916 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.463 0.187 0 N-CA-C 114.607 1.336 . . . . 0.0 114.607 -173.25 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 82.0 m-85 . . . . . 0 CA--C 1.543 0.706 0 CA-C-O 119.572 -0.251 . . . . 0.0 110.865 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_endo -72.71 -167.44 0.34 Allowed 'Trans proline' 0 CA--C 1.536 0.578 0 C-N-CA 123.991 3.128 . . . . 0.0 109.891 166.255 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 43.2 t -106.99 86.5 2.43 Favored Pre-proline 0 CA--C 1.541 0.634 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 174.016 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 91.8 Cg_endo -65.08 164.6 24.51 Favored 'Trans proline' 0 CA--C 1.536 0.604 0 C-N-CA 123.577 2.852 . . . . 0.0 110.252 178.205 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -152.94 142.97 22.28 Favored 'General case' 0 N--CA 1.475 0.776 0 O-C-N 120.608 -1.307 . . . . 0.0 113.236 -179.64 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 14.4 p -60.13 -19.82 18.75 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.287 0 C-N-CA 124.906 1.282 . . . . 0.0 112.885 171.494 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.4 t -57.59 -5.59 0.38 Allowed 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 124.632 1.173 . . . . 0.0 113.079 170.267 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.4 t -137.11 12.67 3.07 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-N 119.617 1.099 . . . . 0.0 113.74 176.468 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 16.4 m-30 -72.42 164.18 26.78 Favored 'General case' 0 C--O 1.236 0.363 0 O-C-N 120.476 -1.39 . . . . 0.0 111.295 175.028 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 19.2 mt-30 -108.08 129.22 55.16 Favored 'General case' 0 CA--C 1.519 -0.217 0 C-N-CA 125.179 1.392 . . . . 0.0 108.794 169.726 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 49.8 t80 -77.94 150.71 33.97 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 118.357 0.526 . . . . 0.0 110.073 170.017 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -128.58 88.08 2.68 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 107.504 -1.295 . . . . 0.0 107.504 173.846 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.7 pt-20 -52.77 -19.89 2.8 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 127.831 2.452 . . . . 0.0 113.589 175.057 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 6.7 t -51.33 -36.72 44.15 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 124.137 0.975 . . . . 0.0 111.413 168.344 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 54.3 m -138.61 -8.07 1.46 Allowed 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 124.7 1.2 . . . . 0.0 113.834 -178.05 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 88.47 19.96 50.2 Favored Glycine 0 CA--C 1.528 0.859 0 O-C-N 120.198 -1.564 . . . . 0.0 113.723 167.798 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 32.7 m-85 -110.37 174.88 5.65 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 125.673 1.589 . . . . 0.0 109.381 -179.025 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 83.8 m-85 -120.56 151.45 39.4 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 124.675 1.19 . . . . 0.0 109.098 177.117 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 55.3 t80 -125.6 137.08 53.88 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 125.412 1.485 . . . . 0.0 110.715 -175.511 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -97.75 88.74 0.65 Allowed Pre-proline 0 N--CA 1.463 0.182 0 C-N-CA 128.088 2.555 . . . . 0.0 112.418 -179.817 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo -58.09 -10.51 8.2 Favored 'Trans proline' 0 CA--C 1.536 0.614 0 CA-C-N 121.19 1.461 . . . . 0.0 115.012 175.265 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -66.81 -41.55 87.38 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 120.058 1.299 . . . . 0.0 109.786 176.295 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 22.4 p -137.34 -11.09 1.66 Allowed 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 116.156 1.909 . . . . 0.0 116.156 -173.819 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 95.14 6.68 60.04 Favored Glycine 0 CA--C 1.528 0.904 0 O-C-N 121.21 -0.931 . . . . 0.0 113.329 171.921 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 15.2 mt -82.1 163.15 22.21 Favored 'General case' 0 C--O 1.237 0.426 0 CA-C-N 118.169 0.985 . . . . 0.0 109.196 174.901 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 57.6 m-85 -108.9 157.44 18.62 Favored 'General case' 0 C--O 1.234 0.274 0 C-N-CA 123.141 0.576 . . . . 0.0 109.954 171.07 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 56.0 t80 -127.93 151.37 49.19 Favored 'General case' 0 C--O 1.238 0.448 0 C-N-CA 128.918 2.887 . . . . 0.0 107.865 -178.995 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -130.14 144.02 51.47 Favored Pre-proline 0 C--N 1.331 -0.213 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 173.345 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -64.99 -24.43 60.28 Favored 'Trans proline' 0 N--CA 1.455 -0.769 0 C-N-CA 122.539 2.159 . . . . 0.0 114.038 -175.427 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 17.7 m-80 -104.07 -19.04 14.31 Favored 'General case' 0 C--O 1.237 0.417 0 C-N-CA 123.721 0.808 . . . . 0.0 112.002 176.527 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 33.6 t -120.77 84.52 2.24 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 125.278 1.431 . . . . 0.0 109.163 177.63 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 24.9 mp0 -58.61 -8.16 1.18 Allowed 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 124.459 1.104 . . . . 0.0 111.657 162.443 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 26.8 m-85 -70.3 99.56 1.57 Allowed 'General case' 0 N--CA 1.45 -0.452 0 N-CA-C 107.357 -1.349 . . . . 0.0 107.357 164.732 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 54.3 m-85 -59.92 146.4 42.43 Favored 'General case' 0 C--O 1.237 0.432 0 C-N-CA 125.877 1.671 . . . . 0.0 109.974 -174.722 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 73.9 t80 -96.81 118.77 33.97 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-O 122.417 1.103 . . . . 0.0 109.748 173.634 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . 0.59 HD22 ' HG2' ' A' ' 50' ' ' GLN . 17.2 t30 -88.07 79.57 7.92 Favored 'General case' 0 N--CA 1.443 -0.806 0 C-N-CA 127.108 2.163 . . . . 0.0 107.557 -179.273 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -53.64 -32.65 52.29 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 123.684 0.794 . . . . 0.0 111.034 177.652 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.7 tt0 -51.01 -28.09 9.26 Favored 'General case' 0 N--CA 1.449 -0.496 0 C-N-CA 127.454 2.302 . . . . 0.0 114.365 -176.8 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -144.95 4.75 1.12 Allowed 'General case' 0 CA--C 1.535 0.39 0 N-CA-C 112.697 0.629 . . . . 0.0 112.697 174.692 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 26.8 mt-30 68.16 60.68 0.41 Allowed 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 125.968 1.707 . . . . 0.0 109.997 -177.461 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.59 ' HG2' HD22 ' A' ' 45' ' ' ASN . 0.0 OUTLIER -124.89 168.18 13.64 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 125.929 1.692 . . . . 0.0 114.871 174.715 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 4.4 m-85 -107.14 149.82 27.25 Favored 'General case' 0 C--O 1.233 0.202 0 N-CA-C 107.898 -1.149 . . . . 0.0 107.898 162.246 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 90.9 mt -145.99 -176.78 5.28 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 127.279 2.232 . . . . 0.0 107.025 -178.607 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 4.4 p90 -127.68 179.81 5.33 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 125.165 1.386 . . . . 0.0 108.278 162.726 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 27.5 t-105 -105.08 135.71 45.91 Favored 'General case' 0 C--O 1.238 0.499 0 N-CA-C 105.055 -2.202 . . . . 0.0 105.055 160.685 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -124.01 115.97 22.08 Favored 'General case' 0 N--CA 1.446 -0.628 0 C-N-CA 124.742 1.217 . . . . 0.0 108.013 177.886 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -77.27 -15.93 81.04 Favored Glycine 0 N--CA 1.445 -0.758 0 CA-C-O 117.407 -1.774 . . . . 0.0 112.361 177.316 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -65.7 -47.85 74.0 Favored 'General case' 0 C--N 1.345 0.388 0 CA-C-N 121.308 2.554 . . . . 0.0 108.241 -177.167 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 5.4 mtt85 -102.19 5.0 39.98 Favored 'General case' 0 CA--C 1.529 0.149 0 C-N-CA 125.805 1.642 . . . . 0.0 111.293 -179.051 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 3.2 mtt180 44.78 60.34 2.97 Favored 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 126.601 1.96 . . . . 0.0 109.798 -178.174 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 5.5 t -149.85 173.05 14.19 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-O 121.763 0.792 . . . . 0.0 110.193 -168.551 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 82.2 m-85 -113.74 116.39 29.33 Favored 'General case' 0 C--O 1.234 0.283 0 C-N-CA 124.906 1.283 . . . . 0.0 108.246 172.802 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -125.58 158.98 62.86 Favored Pre-proline 0 C--N 1.327 -0.382 0 C-N-CA 126.831 2.052 . . . . 0.0 110.409 -168.941 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -72.89 124.14 9.44 Favored 'Trans proline' 0 N--CA 1.458 -0.602 0 C-N-CA 122.931 2.421 . . . . 0.0 111.924 -175.986 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.245 0 C-N-CA 123.737 0.815 . . . . 0.0 112.713 179.855 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.463 0.452 0 N-CA-C 109.824 -1.31 . . . . 0.0 109.824 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 2.8 p-80 -144.8 4.38 1.13 Allowed 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 125.011 1.324 . . . . 0.0 111.792 -175.571 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 6.5 mtm -117.34 175.62 5.53 Favored 'General case' 0 C--O 1.234 0.244 0 C-N-CA 125.101 1.36 . . . . 0.0 108.939 174.572 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 36.6 tt0 46.79 81.61 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 127.521 2.329 . . . . 0.0 111.767 -171.038 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 8.1 tt0 -70.07 -17.82 63.25 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-O 118.079 -0.963 . . . . 0.0 112.702 175.525 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 73.2 m 59.3 93.21 0.04 OUTLIER 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.816 1.247 . . . . 0.0 113.277 172.063 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 25.7 p90 -118.56 -169.07 1.65 Allowed 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 126.084 1.754 . . . . 0.0 109.965 -175.056 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 46.4 m 58.87 76.4 0.35 Allowed 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 125.445 1.498 . . . . 0.0 113.019 177.525 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -142.41 -171.25 3.36 Favored 'General case' 0 N--CA 1.445 -0.687 0 C-N-CA 125.425 1.49 . . . . 0.0 110.442 -178.795 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 17.7 m-85 -111.71 166.7 10.35 Favored Pre-proline 0 CA--C 1.54 0.59 0 C-N-CA 127.558 2.343 . . . . 0.0 108.919 -176.138 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 96.2 Cg_endo -65.36 -176.06 0.48 Allowed 'Trans proline' 0 CA--C 1.537 0.644 0 C-N-CA 123.623 2.882 . . . . 0.0 111.594 169.404 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 48.8 t -113.95 85.82 10.4 Favored Pre-proline 0 CA--C 1.541 0.609 0 N-CA-C 106.987 -1.486 . . . . 0.0 106.987 178.09 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -67.0 175.53 5.47 Favored 'Trans proline' 0 C--N 1.35 0.614 0 C-N-CA 123.39 2.726 . . . . 0.0 112.121 -176.881 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 63.3 t0 -142.46 125.23 15.99 Favored 'General case' 0 C--O 1.237 0.445 0 N-CA-C 105.154 -2.165 . . . . 0.0 105.154 166.429 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 5.3 p -55.33 -23.05 13.0 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.433 0 C-N-CA 123.816 0.846 . . . . 0.0 111.499 175.531 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 31.6 t -67.65 2.29 1.96 Allowed 'General case' 0 CA--C 1.54 0.573 0 O-C-N 120.895 -1.128 . . . . 0.0 112.248 175.565 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 47.3 p -114.65 3.22 14.72 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 125.272 1.429 . . . . 0.0 110.878 174.608 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 14.7 m-30 -85.57 175.79 8.58 Favored 'General case' 0 C--O 1.236 0.391 0 O-C-N 121.03 -1.044 . . . . 0.0 109.579 -179.362 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 15.7 mt-30 -120.14 114.27 21.7 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 124.271 1.029 . . . . 0.0 110.119 -178.348 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 69.0 t80 -72.79 135.74 45.31 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 123.344 0.658 . . . . 0.0 110.407 175.116 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -118.98 75.81 1.06 Allowed 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 125.421 1.488 . . . . 0.0 108.649 -173.543 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -56.52 -19.49 15.82 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 125.343 1.457 . . . . 0.0 114.662 -167.528 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 1.3 t -54.67 -30.76 56.32 Favored 'General case' 0 CA--C 1.554 1.111 0 C-N-CA 124.705 1.202 . . . . 0.0 110.234 170.427 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 47.1 m -132.12 -16.94 2.77 Favored 'General case' 0 C--N 1.346 0.439 0 N-CA-C 115.61 1.707 . . . . 0.0 115.61 -178.854 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 99.78 2.39 56.25 Favored Glycine 0 CA--C 1.535 1.326 0 CA-C-N 120.865 1.666 . . . . 0.0 114.297 172.223 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 80.4 m-85 -95.32 169.3 10.17 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 125.106 1.363 . . . . 0.0 110.657 178.083 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 71.3 m-85 -102.09 151.91 21.6 Favored 'General case' 0 N--CA 1.453 -0.319 0 N-CA-C 106.335 -1.728 . . . . 0.0 106.335 160.411 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 40.6 t80 -115.68 140.4 49.23 Favored 'General case' 0 C--O 1.241 0.625 0 C-N-CA 125.926 1.69 . . . . 0.0 107.457 175.525 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -121.96 76.34 39.65 Favored Pre-proline 0 N--CA 1.444 -0.763 0 N-CA-C 106.636 -1.616 . . . . 0.0 106.636 -158.561 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 27.2 Cg_endo -60.9 -19.49 62.53 Favored 'Trans proline' 0 CA--C 1.537 0.665 0 C-N-CA 122.415 2.077 . . . . 0.0 114.353 -168.536 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 14.8 tt0 -68.09 -22.79 64.9 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.539 1.135 . . . . 0.0 111.33 178.956 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.492 ' CB ' HD22 ' A' ' 34' ' ' LEU . 0.5 OUTLIER -116.13 -58.21 2.12 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 127.725 2.41 . . . . 0.0 107.091 -178.309 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 113.88 -7.59 23.71 Favored Glycine 0 CA--C 1.53 1.005 0 C-N-CA 127.443 2.449 . . . . 0.0 110.861 -169.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.492 HD22 ' CB ' ' A' ' 32' ' ' THR . 0.0 OUTLIER -59.5 168.71 1.49 Allowed 'General case' 0 N--CA 1.434 -1.237 0 C-N-CA 129.118 2.967 . . . . 0.0 111.086 170.95 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 63.4 m-85 -116.1 140.46 49.26 Favored 'General case' 0 C--O 1.238 0.478 0 CA-C-N 114.45 -1.25 . . . . 0.0 108.658 158.934 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 58.6 t80 -105.41 153.9 21.04 Favored 'General case' 0 C--N 1.325 -0.493 0 C-N-CA 125.387 1.475 . . . . 0.0 108.093 171.345 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 6.9 t0 -119.76 142.77 33.64 Favored Pre-proline 0 C--N 1.329 -0.31 0 N-CA-C 105.898 -1.89 . . . . 0.0 105.898 171.255 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -73.48 -28.68 11.84 Favored 'Trans proline' 0 N--CA 1.455 -0.779 0 C-N-CA 121.369 1.38 . . . . 0.0 113.01 -174.35 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 52.3 m-80 -95.24 -25.41 16.37 Favored 'General case' 0 N--CA 1.448 -0.528 0 C-N-CA 125.986 1.714 . . . . 0.0 110.467 -177.603 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 4.1 m -121.03 95.65 4.78 Favored 'General case' 0 C--O 1.223 -0.317 0 C-N-CA 124.536 1.135 . . . . 0.0 108.733 -178.654 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 20.7 mp0 -64.06 1.15 0.74 Allowed 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 125.665 1.586 . . . . 0.0 114.121 179.417 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 26.4 m-85 -77.29 109.04 10.86 Favored 'General case' 0 C--O 1.234 0.26 0 C-N-CA 126.024 1.73 . . . . 0.0 108.97 169.657 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 18.8 m-85 -67.23 157.38 33.97 Favored 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 125.472 1.509 . . . . 0.0 109.442 179.872 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . 0.425 ' CZ ' ' HA ' ' A' ' 46' ' ' ALA . 7.8 t80 -118.86 105.17 11.24 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 125.443 1.497 . . . . 0.0 107.885 178.875 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 30.1 t30 -79.25 92.18 5.09 Favored 'General case' 0 N--CA 1.445 -0.7 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 168.152 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.425 ' HA ' ' CZ ' ' A' ' 44' ' ' TYR . . . -56.54 -35.18 67.81 Favored 'General case' 0 N--CA 1.456 -0.144 0 C-N-CA 124.046 0.938 . . . . 0.0 112.482 179.743 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -45.76 -55.78 6.11 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 126.157 1.783 . . . . 0.0 111.606 -176.941 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.9 m -109.99 -1.84 17.42 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 123.736 0.814 . . . . 0.0 111.36 -172.827 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 40.9 mt-30 50.46 60.59 3.74 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 126.302 1.841 . . . . 0.0 109.442 -163.741 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -106.85 149.29 27.57 Favored 'General case' 0 C--O 1.233 0.198 0 N-CA-C 107.992 -1.114 . . . . 0.0 107.992 167.237 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 3.8 m-85 -104.79 131.03 52.75 Favored 'General case' 0 CA--C 1.515 -0.397 0 N-CA-C 105.475 -2.046 . . . . 0.0 105.475 168.498 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.403 HD23 ' HA ' ' A' ' 63' ' ' PRO . 49.9 mt -127.08 177.89 6.36 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 125.521 1.528 . . . . 0.0 108.164 -171.709 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 26.1 p90 -142.94 156.3 44.86 Favored 'General case' 0 N--CA 1.447 -0.618 0 N-CA-C 108.845 -0.798 . . . . 0.0 108.845 160.89 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 26.6 t-105 -82.52 118.95 23.63 Favored 'General case' 0 N--CA 1.448 -0.562 0 N-CA-C 106.937 -1.505 . . . . 0.0 106.937 171.288 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 20.9 t0 -109.39 93.58 4.58 Favored 'General case' 0 CA--C 1.516 -0.365 0 N-CA-C 107.918 -1.141 . . . . 0.0 107.918 171.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -62.89 -12.4 42.29 Favored Glycine 0 CA--C 1.53 1.029 0 CA-C-O 117.947 -1.474 . . . . 0.0 113.641 179.846 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 11.7 mt-10 -75.77 -32.95 60.14 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 121.228 2.514 . . . . 0.0 109.363 173.911 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 51.0 mtt85 -104.43 -5.06 22.02 Favored 'General case' 0 CA--C 1.529 0.137 0 C-N-CA 125.201 1.4 . . . . 0.0 111.727 -177.807 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 38.9 mtp180 44.28 43.75 6.16 Favored 'General case' 0 CA--C 1.514 -0.436 0 C-N-CA 128.604 2.762 . . . . 0.0 110.836 178.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 4.9 t -145.43 172.18 13.57 Favored 'General case' 0 N--CA 1.444 -0.737 0 N-CA-C 106.573 -1.639 . . . . 0.0 106.573 177.874 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 71.0 m-85 -94.58 140.42 29.88 Favored 'General case' 0 C--O 1.242 0.71 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 170.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -125.79 154.45 73.35 Favored Pre-proline 0 C--N 1.321 -0.661 0 C-N-CA 126.161 1.784 . . . . 0.0 107.182 173.124 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.403 ' HA ' HD23 ' A' ' 52' ' ' LEU . 39.9 Cg_endo -68.33 145.52 65.96 Favored 'Trans proline' 0 N--CA 1.45 -1.081 0 C-N-CA 122.132 1.888 . . . . 0.0 109.62 172.974 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -106.19 30.8 5.61 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 124.207 1.003 . . . . 0.0 111.411 173.872 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 5.9 mp -80.7 99.85 8.4 Favored 'General case' 0 C--N 1.332 -0.184 0 O-C-N 121.073 -1.017 . . . . 0.0 108.371 179.311 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 67.68 154.7 0.1 Allowed 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 126.769 2.028 . . . . 0.0 111.989 175.919 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 5.2 mt-30 -163.65 164.47 23.97 Favored 'General case' 0 C--N 1.316 -0.873 0 C-N-CA 128.529 2.732 . . . . 0.0 110.91 -176.265 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 45.09 77.23 0.08 Allowed 'General case' 0 C--O 1.236 0.373 0 C-N-CA 126.763 2.025 . . . . 0.0 110.946 174.398 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -61.74 80.12 0.02 OUTLIER 'General case' 0 C--O 1.233 0.198 0 C-N-CA 126.979 2.112 . . . . 0.0 112.047 -168.728 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 -131.56 -6.92 3.69 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 128.045 2.538 . . . . 0.0 109.919 168.291 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -112.31 -86.65 1.61 Allowed Glycine 0 C--N 1.339 0.718 0 N-CA-C 108.306 -1.918 . . . . 0.0 108.306 171.643 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 6.9 t-160 49.53 35.1 7.75 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 125.042 1.337 . . . . 0.0 111.904 -166.388 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 3.1 mmmt -129.44 6.21 5.24 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 124.816 1.246 . . . . 0.0 112.599 -171.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -149.74 -171.53 3.92 Favored 'General case' 0 C--N 1.324 -0.523 0 C-N-CA 129.512 3.125 . . . . 0.0 106.406 171.703 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -57.81 -41.56 82.45 Favored 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 125.572 1.549 . . . . 0.0 113.348 167.684 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -117.06 179.28 17.43 Favored Glycine 0 N--CA 1.443 -0.862 0 N-CA-C 108.477 -1.849 . . . . 0.0 108.477 -176.794 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -121.4 79.44 36.91 Favored Pre-proline 0 CA--C 1.54 0.582 0 C-N-CA 122.812 0.445 . . . . 0.0 110.148 -171.617 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 67.3 Cg_endo -67.01 -4.35 11.31 Favored 'Trans proline' 0 CA--C 1.541 0.861 0 C-N-CA 125.195 3.93 . . . . 0.0 114.897 -172.211 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -77.76 13.76 1.25 Allowed 'General case' 0 C--N 1.327 -0.413 0 C-N-CA 127.368 2.267 . . . . 0.0 114.969 -165.288 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 6.1 mtpm? -98.2 -8.02 28.21 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 120.199 1.363 . . . . 0.0 112.073 177.468 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 9.8 tt0 -69.33 -21.92 63.8 Favored 'General case' 0 C--O 1.233 0.223 0 N-CA-C 113.261 0.837 . . . . 0.0 113.261 -166.354 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 106.42 -19.2 37.28 Favored Glycine 0 CA--C 1.524 0.651 0 C-N-CA 124.654 1.121 . . . . 0.0 113.401 -176.847 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 25.2 mttp -91.74 -51.65 5.13 Favored 'General case' 0 C--O 1.218 -0.576 0 CA-C-N 119.019 1.41 . . . . 0.0 108.131 167.967 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . 0.308 11.5 pt-20 56.59 -74.49 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 117.309 2.337 . . . . 0.0 117.309 154.694 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 20.8 mmmt -118.79 14.62 13.42 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 125.675 1.59 . . . . 0.0 111.846 174.335 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 60.57 176.38 0.1 Allowed 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 131.035 3.734 . . . . 0.0 111.313 -162.882 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -49.47 -34.75 17.7 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 125.842 1.657 . . . . 0.0 112.513 -178.35 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 54.38 -152.33 0.33 Allowed 'General case' 0 CA--C 1.538 0.481 0 N-CA-C 108.26 -1.015 . . . . 0.0 108.26 -179.872 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 30.1 m170 56.2 9.33 0.49 Allowed 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 119.882 3.29 . . . . 0.0 119.882 146.949 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 13.5 tptt 70.25 -164.58 0.16 Allowed 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 121.071 1.76 . . . . 0.0 108.046 -167.603 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 9.1 m -115.26 24.73 11.4 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 124.512 1.125 . . . . 0.0 108.484 -176.542 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 11.9 mptt . . . . . 0 C--O 1.255 1.379 0 C-N-CA 125.659 1.584 . . . . 0.0 107.779 -133.461 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 0.986 0 N-CA-C 109.683 -1.367 . . . . 0.0 109.683 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 12.4 p-80 -100.91 13.32 35.49 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-N 119.425 1.613 . . . . 0.0 111.296 176.351 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 83.0 mtp -142.45 114.27 8.06 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 127.889 2.475 . . . . 0.0 105.605 178.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -158.48 66.35 0.44 Allowed 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 125.428 1.491 . . . . 0.0 107.926 167.364 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 -128.04 -6.98 5.46 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.384 -179.136 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 46.0 m 53.35 32.34 13.57 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 112.488 0.551 . . . . 0.0 112.488 -179.699 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 3.0 p90 -61.53 -14.92 33.51 Favored 'General case' 0 CA--C 1.539 0.54 0 O-C-N 121.178 -0.951 . . . . 0.0 112.665 178.268 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 6.3 t -107.19 122.58 46.8 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 126.486 1.915 . . . . 0.0 109.426 177.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -68.4 -62.33 1.44 Allowed 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 123.376 0.671 . . . . 0.0 109.257 165.414 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 28.5 m-85 -108.84 165.01 13.44 Favored Pre-proline 0 C--O 1.239 0.544 0 C-N-CA 124.054 0.942 . . . . 0.0 111.49 -168.237 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 68.5 Cg_endo -74.51 -178.98 4.38 Favored 'Trans proline' 0 C--N 1.349 0.586 0 C-N-CA 122.957 2.438 . . . . 0.0 110.207 171.896 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 25.0 t -104.73 86.46 1.46 Allowed Pre-proline 0 CA--C 1.538 0.506 0 N-CA-C 106.05 -1.833 . . . . 0.0 106.05 176.422 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -68.67 170.62 14.81 Favored 'Trans proline' 0 N--CA 1.457 -0.639 0 C-N-CA 123.125 2.55 . . . . 0.0 109.134 -176.616 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 12.0 t0 -144.53 138.28 27.43 Favored 'General case' 0 CA--C 1.511 -0.532 0 N-CA-C 107.342 -1.355 . . . . 0.0 107.342 176.011 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.539 ' HA ' ' CD2' ' A' ' 18' ' ' TYR . 1.5 t -69.1 -19.27 23.6 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 N-CA-C 107.902 -1.147 . . . . 0.0 107.902 178.399 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 86.7 p -61.66 -15.66 41.87 Favored 'General case' 0 N--CA 1.43 -1.446 0 N-CA-C 113.606 0.965 . . . . 0.0 113.606 -179.384 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 14.0 t -124.08 9.92 8.73 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 126.308 1.843 . . . . 0.0 112.807 177.836 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.539 ' CD2' ' HA ' ' A' ' 15' ' ' VAL . 18.3 m-30 -68.86 170.59 9.35 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-N 120.393 1.451 . . . . 0.0 108.488 166.577 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 14.3 mt-30 -118.1 106.25 12.67 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 124.521 1.128 . . . . 0.0 110.028 177.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 84.8 t80 -56.03 141.76 38.78 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 124.599 1.16 . . . . 0.0 111.456 170.879 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -126.04 95.09 4.28 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 124.158 0.983 . . . . 0.0 109.312 179.727 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -57.35 -23.21 47.51 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 125.176 1.39 . . . . 0.0 113.285 -177.637 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 5.2 t -48.59 -35.58 13.82 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 127.128 2.171 . . . . 0.0 109.659 172.983 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -120.68 -55.76 1.99 Allowed 'General case' 0 N--CA 1.445 -0.719 0 C-N-CA 124.167 0.987 . . . . 0.0 108.538 -177.768 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 117.0 28.71 2.36 Favored Glycine 0 CA--C 1.527 0.833 0 C-N-CA 123.965 0.793 . . . . 0.0 114.424 -174.904 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 39.4 m-85 -130.82 165.33 23.24 Favored 'General case' 0 C--O 1.239 0.504 0 C-N-CA 126.244 1.817 . . . . 0.0 106.804 -176.261 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 79.6 m-85 -90.41 140.17 29.97 Favored 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 124.554 1.141 . . . . 0.0 108.037 173.265 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 31.3 t80 -102.34 134.86 44.95 Favored 'General case' 0 C--O 1.237 0.433 0 N-CA-C 107.459 -1.311 . . . . 0.0 107.459 170.039 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -112.69 77.0 2.28 Favored Pre-proline 0 N--CA 1.447 -0.587 0 C-N-CA 125.89 1.676 . . . . 0.0 109.429 -166.347 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -67.22 -6.27 15.81 Favored 'Trans proline' 0 N--CA 1.46 -0.465 0 C-N-CA 122.929 2.42 . . . . 0.0 114.145 -170.82 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 3.9 tt0 -63.29 -26.11 68.62 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 118.516 0.598 . . . . 0.0 110.408 174.314 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 7.3 p -139.98 -21.15 0.88 Allowed 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 124.78 1.232 . . . . 0.0 113.474 179.453 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 97.45 14.81 39.95 Favored Glycine 0 CA--C 1.529 0.963 0 CA-C-N 119.054 0.843 . . . . 0.0 112.764 -178.463 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 24.3 mt -86.51 -178.33 6.39 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 118.634 1.217 . . . . 0.0 109.18 175.664 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 39.0 m-85 -126.63 146.42 50.18 Favored 'General case' 0 C--O 1.238 0.461 0 C-N-CA 124.507 1.123 . . . . 0.0 109.825 166.374 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 85.9 t80 -117.83 154.79 31.21 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.932 1.693 . . . . 0.0 109.348 177.878 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -124.95 143.81 45.11 Favored Pre-proline 0 CA--C 1.535 0.383 0 C-N-CA 126.248 1.819 . . . . 0.0 109.151 171.927 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 70.7 Cg_endo -79.33 -31.92 1.93 Allowed 'Trans proline' 0 N--CA 1.459 -0.516 0 C-N-CA 123.691 2.927 . . . . 0.0 113.853 -176.238 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 8.2 m-80 -81.98 -22.04 36.82 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 124.049 0.939 . . . . 0.0 109.592 176.656 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 38.4 m -137.6 98.1 3.61 Favored 'General case' 0 CA--C 1.513 -0.477 0 C-N-CA 125.501 1.521 . . . . 0.0 108.94 -170.554 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 19.7 mp0 -67.35 24.33 0.02 OUTLIER 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 127.733 2.413 . . . . 0.0 113.203 -179.278 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 33.2 m-85 -99.25 101.44 12.76 Favored 'General case' 0 CA--C 1.536 0.42 0 O-C-N 120.202 -1.561 . . . . 0.0 108.261 177.501 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 29.6 m-85 -65.69 111.83 3.38 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 128.554 2.741 . . . . 0.0 110.604 -179.747 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 63.8 t80 -75.33 127.29 32.81 Favored 'General case' 0 C--N 1.326 -0.452 0 C-N-CA 125.618 1.567 . . . . 0.0 110.448 -176.495 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 45.0 t30 -99.3 81.33 2.53 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 126.886 2.074 . . . . 0.0 109.54 175.364 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -46.08 -36.79 6.08 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 124.749 1.22 . . . . 0.0 111.992 176.936 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.7 tt0 -49.78 -31.07 10.75 Favored 'General case' 0 N--CA 1.447 -0.611 0 C-N-CA 127.573 2.349 . . . . 0.0 114.121 -178.425 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 40.2 m -134.04 17.13 3.81 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 123.52 0.728 . . . . 0.0 111.223 172.146 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 40.8 mt-30 44.99 32.31 0.83 Allowed 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 125.519 1.528 . . . . 0.0 112.006 -163.376 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -93.6 168.33 11.1 Favored 'General case' 0 N--CA 1.452 -0.345 0 O-C-N 120.9 -1.125 . . . . 0.0 109.848 -176.167 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 5.7 m-85 -116.57 128.07 55.08 Favored 'General case' 0 N--CA 1.446 -0.633 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 -174.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.436 HD23 ' HA ' ' A' ' 63' ' ' PRO . 22.6 mt -124.02 178.24 5.39 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 127.326 2.25 . . . . 0.0 109.885 179.686 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 5.1 p90 -145.69 152.44 39.62 Favored 'General case' 0 C--O 1.235 0.318 0 C-N-CA 127.788 2.435 . . . . 0.0 106.943 168.441 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 69.2 t-105 -77.1 142.98 39.53 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 107.316 -1.364 . . . . 0.0 107.316 164.569 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 63.9 t0 -131.85 104.53 6.93 Favored 'General case' 0 C--O 1.234 0.272 0 N-CA-C 108.876 -0.786 . . . . 0.0 108.876 169.708 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -75.81 -7.63 83.82 Favored Glycine 0 CA--C 1.533 1.163 0 C-N-CA 124.362 0.982 . . . . 0.0 113.345 -178.935 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 73.7 mt-10 -75.04 -31.57 61.34 Favored 'General case' 0 CA--C 1.531 0.222 0 O-C-N 121.066 -1.255 . . . . 0.0 109.933 170.342 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 63.9 mtt180 -110.04 -7.31 14.95 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 125.502 1.521 . . . . 0.0 112.668 -177.115 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 61.3 mtt85 44.98 55.66 5.97 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 128.294 2.638 . . . . 0.0 110.752 -174.02 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 11.3 t -150.72 169.46 21.56 Favored 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 123.268 0.627 . . . . 0.0 109.833 174.051 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 93.4 m-85 -92.43 134.88 34.52 Favored 'General case' 0 C--O 1.238 0.458 0 N-CA-C 107.23 -1.396 . . . . 0.0 107.23 164.071 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -126.95 157.7 71.02 Favored Pre-proline 0 C--N 1.322 -0.608 0 C-N-CA 127.026 2.13 . . . . 0.0 111.113 178.362 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.436 ' HA ' HD23 ' A' ' 52' ' ' LEU . 42.8 Cg_endo -75.23 123.41 7.74 Favored 'Trans proline' 0 CA--C 1.533 0.471 0 C-N-CA 123.925 3.083 . . . . 0.0 112.568 -177.939 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -90.03 14.13 13.11 Favored 'General case' 0 N--CA 1.465 0.298 0 N-CA-C 115.831 1.789 . . . . 0.0 115.831 -169.091 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -45.53 -75.21 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 126.776 2.031 . . . . 0.0 111.726 -167.706 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 14.8 mp0 -87.13 -50.47 6.6 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-N 118.448 0.567 . . . . 0.0 110.155 179.088 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 51.26 17.41 0.49 Allowed 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 127.398 2.279 . . . . 0.0 113.281 -174.503 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 24.9 p -159.82 144.04 14.71 Favored 'General case' 0 N--CA 1.443 -0.784 0 O-C-N 120.597 -1.314 . . . . 0.0 108.744 170.327 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -128.81 8.88 5.8 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 127.378 2.271 . . . . 0.0 110.509 174.157 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 29.7 t0 -124.55 93.95 4.06 Favored 'General case' 0 C--O 1.241 0.648 0 N-CA-C 107.758 -1.201 . . . . 0.0 107.758 -178.754 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 119.55 162.15 11.85 Favored Glycine 0 CA--C 1.524 0.654 0 C-N-CA 125.137 1.351 . . . . 0.0 109.955 178.355 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 38.8 m170 -75.61 86.0 2.67 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 123.95 0.9 . . . . 0.0 109.796 177.391 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 2.1 mptt -130.29 170.79 13.66 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-N 118.833 0.742 . . . . 0.0 110.611 166.428 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -144.45 -56.4 0.35 Allowed 'General case' 0 C--O 1.224 -0.273 0 C-N-CA 123.804 0.842 . . . . 0.0 109.713 172.359 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 5.7 p -141.6 -24.88 0.71 Allowed 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 123.92 0.888 . . . . 0.0 112.953 166.596 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -168.9 -159.76 15.32 Favored Glycine 0 C--N 1.334 0.419 0 N-CA-C 110.577 -1.009 . . . . 0.0 110.577 -161.75 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -131.85 68.55 80.62 Favored Pre-proline 0 C--O 1.239 0.545 0 CA-C-N 117.541 0.67 . . . . 0.0 111.231 168.31 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_endo -57.41 106.83 0.26 Allowed 'Trans proline' 0 N--CA 1.454 -0.829 0 C-N-CA 124.367 3.378 . . . . 0.0 109.392 174.88 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 58.5 m 45.0 42.74 6.64 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 123.666 0.787 . . . . 0.0 112.323 -175.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -135.24 14.3 3.52 Favored 'General case' 0 N--CA 1.461 0.102 0 C-N-CA 123.232 0.613 . . . . 0.0 111.232 178.834 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 22.6 tt0 -153.69 61.21 0.74 Allowed 'General case' 0 C--O 1.235 0.309 0 N-CA-C 108.088 -1.078 . . . . 0.0 108.088 176.487 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 76.48 -30.47 1.44 Allowed Glycine 0 CA--C 1.534 1.226 0 O-C-N 120.718 -1.239 . . . . 0.0 113.922 172.48 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 1.6 mtmm -52.91 -25.68 12.53 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 118.735 1.267 . . . . 0.0 111.162 168.509 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -51.58 -36.04 43.78 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 125.508 1.523 . . . . 0.0 112.728 176.023 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.38 4.51 15.38 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 124.059 0.944 . . . . 0.0 111.02 -176.856 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 73.3 mttt -97.28 -44.72 6.79 Favored 'General case' 0 CA--C 1.51 -0.567 0 O-C-N 120.774 -1.204 . . . . 0.0 109.733 167.881 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 14.5 tt0 56.82 68.88 0.8 Allowed 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 124.638 1.175 . . . . 0.0 110.348 177.719 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -138.95 75.36 1.51 Allowed 'General case' 0 C--O 1.232 0.166 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 -169.42 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 31.1 t-80 -74.61 109.21 7.9 Favored 'General case' 0 C--O 1.239 0.514 0 N-CA-C 107.219 -1.4 . . . . 0.0 107.219 170.199 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 15.6 tptt -152.36 -22.49 0.17 Allowed 'General case' 0 N--CA 1.464 0.262 0 CA-C-O 116.266 -1.826 . . . . 0.0 113.03 -178.081 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 5.2 m 44.02 61.32 2.38 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 125.525 1.53 . . . . 0.0 111.799 160.227 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 1.2 mtpt . . . . . 0 C--O 1.253 1.244 0 N-CA-C 104.446 -2.427 . . . . 0.0 104.446 -178.031 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.73 0 N-CA-C 110.14 -1.184 . . . . 0.0 110.14 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 13.3 m80 69.79 -167.02 0.17 Allowed 'General case' 0 C--O 1.24 0.574 0 C-N-CA 125.767 1.627 . . . . 0.0 109.868 -167.438 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . 0.468 ' HG2' ' H ' ' A' ' 4' ' ' GLN . 7.6 ttt -74.57 -162.69 0.17 Allowed 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 125.728 1.611 . . . . 0.0 109.608 178.421 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.468 ' H ' ' HG2' ' A' ' 3' ' ' MET . 10.7 mt-30 -140.91 152.58 45.15 Favored 'General case' 0 N--CA 1.452 -0.333 0 O-C-N 120.912 -1.118 . . . . 0.0 109.594 170.607 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -65.27 -17.42 64.49 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 125.219 1.408 . . . . 0.0 113.281 -177.367 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 8.4 t 59.59 64.53 1.31 Allowed 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 125.825 1.65 . . . . 0.0 111.856 170.25 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 40.9 p90 -112.88 -22.06 10.84 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 124.28 1.032 . . . . 0.0 113.581 -176.111 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 2.1 t 49.77 58.66 5.2 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 125.972 1.709 . . . . 0.0 113.041 174.22 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 38.8 mm-40 -130.68 176.31 8.29 Favored 'General case' 0 C--O 1.233 0.225 0 C-N-CA 124.659 1.184 . . . . 0.0 112.019 177.174 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 61.4 m-85 -60.0 163.0 8.53 Favored Pre-proline 0 C--O 1.242 0.708 0 C-N-CA 126.05 1.74 . . . . 0.0 112.013 -169.96 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 92.3 Cg_endo -68.62 179.28 3.2 Favored 'Trans proline' 0 N--CA 1.456 -0.713 0 C-N-CA 123.541 2.827 . . . . 0.0 109.976 167.639 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 10.7 t -105.1 88.39 2.41 Favored Pre-proline 0 N--CA 1.45 -0.445 0 N-CA-C 106.748 -1.575 . . . . 0.0 106.748 176.403 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_endo -58.67 170.89 2.26 Favored 'Trans proline' 0 CA--C 1.545 1.048 0 CA-C-N 120.248 1.124 . . . . 0.0 110.397 171.703 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 15.3 t0 -132.84 129.25 38.22 Favored 'General case' 0 N--CA 1.447 -0.621 0 N-CA-C 106.139 -1.8 . . . . 0.0 106.139 164.524 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.671 HG11 ' CE2' ' A' ' 36' ' ' TYR . 1.7 t -59.0 -26.6 33.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 114.515 -1.221 . . . . 0.0 108.149 173.545 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 36.4 p -60.34 -38.22 83.1 Favored 'General case' 0 N--CA 1.437 -1.114 0 C-N-CA 118.033 -1.467 . . . . 0.0 109.047 -172.42 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 16.4 p -87.68 18.33 4.09 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 126.436 1.894 . . . . 0.0 111.778 179.374 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.586 ' CE2' HG13 ' A' ' 15' ' ' VAL . 13.3 m-30 -79.96 160.6 25.88 Favored 'General case' 0 C--O 1.234 0.258 0 O-C-N 119.903 -1.748 . . . . 0.0 110.049 170.518 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 25.6 mt-30 -100.56 109.6 21.71 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 107.975 -1.12 . . . . 0.0 107.975 -178.429 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 66.9 t80 -63.45 152.68 37.68 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 124.081 0.953 . . . . 0.0 110.421 176.042 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -128.73 105.3 8.16 Favored 'General case' 0 CA--C 1.512 -0.505 0 C-N-CA 125.139 1.376 . . . . 0.0 108.498 168.135 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -61.09 -27.47 68.39 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 119.172 -0.442 . . . . 0.0 112.109 169.917 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 15.1 t -66.08 -4.98 8.36 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.347 1.059 . . . . 0.0 113.184 -178.132 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 12.5 t -140.75 -47.8 0.42 Allowed 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 123.301 0.641 . . . . 0.0 109.555 172.619 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 112.0 43.66 0.92 Allowed Glycine 0 CA--C 1.526 0.743 0 C-N-CA 124.921 1.248 . . . . 0.0 111.929 -177.75 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 68.8 m-85 -136.13 170.28 16.27 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 119.401 1.601 . . . . 0.0 111.161 -177.785 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 79.4 m-85 -110.91 125.96 54.22 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 124.76 1.224 . . . . 0.0 107.707 173.685 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 34.8 t80 -88.56 139.48 30.43 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 124.368 1.067 . . . . 0.0 108.396 177.962 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 27.7 t0 -97.4 86.54 0.42 Allowed Pre-proline 0 CA--C 1.529 0.145 0 C-N-CA 126.946 2.098 . . . . 0.0 109.247 177.796 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -70.37 -5.08 15.77 Favored 'Trans proline' 0 N--CA 1.456 -0.702 0 C-N-CA 122.592 2.195 . . . . 0.0 113.685 175.798 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 2.4 mm-40 -73.77 -28.26 61.57 Favored 'General case' 0 CA--C 1.533 0.309 0 O-C-N 121.328 -0.858 . . . . 0.0 109.368 175.284 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 23.7 p -140.31 -24.11 0.81 Allowed 'General case' 0 C--O 1.238 0.453 0 N-CA-C 115.079 1.511 . . . . 0.0 115.079 -169.404 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 104.13 9.95 35.49 Favored Glycine 0 CA--C 1.53 1.021 0 C-N-CA 124.135 0.874 . . . . 0.0 112.986 177.426 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 19.8 mt -89.84 179.99 5.86 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 125.544 1.538 . . . . 0.0 109.07 178.253 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 57.4 m-85 -124.3 171.37 9.94 Favored 'General case' 0 C--O 1.234 0.282 0 C-N-CA 124.474 1.11 . . . . 0.0 108.843 162.368 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.671 ' CE2' HG11 ' A' ' 15' ' ' VAL . 68.1 t80 -143.21 159.36 42.46 Favored 'General case' 0 C--O 1.238 0.467 0 C-N-CA 128.224 2.609 . . . . 0.0 108.337 179.24 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -127.66 144.35 50.82 Favored Pre-proline 0 C--O 1.235 0.321 0 C-N-CA 124.576 1.15 . . . . 0.0 108.373 174.229 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 61.9 Cg_endo -75.07 -35.07 3.3 Favored 'Trans proline' 0 N--CA 1.45 -1.057 0 C-N-CA 121.944 1.763 . . . . 0.0 113.324 -173.036 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 3.6 m-80 -83.08 -21.72 33.64 Favored 'General case' 0 CA--C 1.524 -0.056 0 CA-C-N 119.152 0.887 . . . . 0.0 110.91 175.807 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 42.7 t -130.89 89.36 2.74 Favored 'General case' 0 N--CA 1.45 -0.472 0 N-CA-C 107.449 -1.315 . . . . 0.0 107.449 -166.85 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -55.92 -9.25 0.55 Allowed 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.873 1.269 . . . . 0.0 113.255 -177.792 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 11.5 m-85 -62.95 107.04 0.91 Allowed 'General case' 0 N--CA 1.449 -0.486 0 C-N-CA 124.951 1.3 . . . . 0.0 108.807 170.566 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 28.2 m-85 -59.89 156.75 13.76 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 124.756 1.222 . . . . 0.0 109.28 170.915 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 83.0 t80 -117.35 124.45 48.96 Favored 'General case' 0 N--CA 1.447 -0.602 0 C-N-CA 124.508 1.123 . . . . 0.0 108.116 177.74 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 27.1 t30 -98.15 84.65 3.3 Favored 'General case' 0 N--CA 1.446 -0.654 0 C-N-CA 126.754 2.022 . . . . 0.0 107.824 176.084 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -53.85 -26.52 24.89 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 124.324 1.049 . . . . 0.0 112.181 175.639 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -52.49 -41.64 63.58 Favored 'General case' 0 N--CA 1.446 -0.637 0 C-N-CA 124.496 1.118 . . . . 0.0 112.113 176.861 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 14.6 m -128.43 15.91 6.57 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 125.15 1.38 . . . . 0.0 111.726 -179.766 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 40.2 mt-30 50.62 19.01 0.53 Allowed 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 127.091 2.156 . . . . 0.0 114.35 -171.803 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -91.31 159.14 16.17 Favored 'General case' 0 N--CA 1.454 -0.239 0 C-N-CA 124.02 0.928 . . . . 0.0 109.798 -171.071 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -98.49 146.75 25.45 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 108.548 -0.908 . . . . 0.0 108.548 174.849 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.48 HD23 ' HA ' ' A' ' 63' ' ' PRO . 82.7 mt -140.01 -178.03 5.26 Favored 'General case' 0 C--N 1.326 -0.413 0 C-N-CA 125.564 1.546 . . . . 0.0 107.915 -179.386 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 26.5 p90 -143.32 149.69 38.13 Favored 'General case' 0 C--N 1.327 -0.378 0 C-N-CA 125.188 1.395 . . . . 0.0 108.191 168.073 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 42.0 t-105 -85.71 139.38 31.4 Favored 'General case' 0 C--O 1.235 0.337 0 N-CA-C 106.57 -1.641 . . . . 0.0 106.57 168.399 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 7.6 t0 -134.85 113.8 11.95 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 122.899 0.48 . . . . 0.0 110.057 -175.833 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -74.37 -12.01 82.18 Favored Glycine 0 CA--C 1.533 1.183 0 CA-C-O 119.117 -0.824 . . . . 0.0 113.498 176.179 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -67.15 -35.23 79.26 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 119.67 1.735 . . . . 0.0 108.937 176.388 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 43.0 mtt85 -120.21 -4.29 10.0 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 124.556 1.142 . . . . 0.0 112.75 -177.558 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 9.7 mtp85 49.19 51.53 16.08 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 126.695 1.998 . . . . 0.0 110.475 -173.247 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 1.4 t -146.36 173.86 11.89 Favored 'General case' 0 CA--C 1.536 0.424 0 O-C-N 121.345 -0.847 . . . . 0.0 108.793 -179.888 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 99.1 m-85 -111.03 119.66 39.78 Favored 'General case' 0 C--O 1.234 0.276 0 C-N-CA 125.044 1.337 . . . . 0.0 108.547 -179.445 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -126.4 156.84 72.12 Favored Pre-proline 0 N--CA 1.469 0.503 0 C-N-CA 125.946 1.698 . . . . 0.0 111.871 -169.805 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.48 ' HA ' HD23 ' A' ' 52' ' ' LEU . 60.9 Cg_endo -74.43 118.46 5.36 Favored 'Trans proline' 0 N--CA 1.459 -0.553 0 C-N-CA 122.439 2.092 . . . . 0.0 111.947 -175.505 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -81.74 26.28 0.5 Allowed 'General case' 0 N--CA 1.466 0.347 0 O-C-N 121.479 -0.763 . . . . 0.0 112.069 178.159 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 7.4 mp -88.43 -42.55 12.08 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 124.483 1.113 . . . . 0.0 109.347 178.408 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.9 pt-20 -56.21 -43.45 78.54 Favored 'General case' 0 N--CA 1.463 0.205 0 C-N-CA 123.978 0.911 . . . . 0.0 108.929 -175.37 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -85.35 -1.55 57.11 Favored 'General case' 0 N--CA 1.449 -0.486 0 C-N-CA 126.04 1.736 . . . . 0.0 113.533 -175.664 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.43 10.97 23.09 Favored 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 124.634 1.174 . . . . 0.0 112.3 -172.827 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 51.1 66.8 1.07 Allowed 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 124.629 1.172 . . . . 0.0 111.397 -175.386 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -55.21 -34.96 64.39 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 124.671 1.188 . . . . 0.0 109.588 164.069 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 75.29 -81.87 0.92 Allowed Glycine 0 N--CA 1.444 -0.792 0 N-CA-C 107.824 -2.11 . . . . 0.0 107.824 -173.011 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -156.09 31.6 0.34 Allowed 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 126.291 1.836 . . . . 0.0 111.916 -175.197 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 20.9 mtmm -106.99 -171.22 1.84 Allowed 'General case' 0 C--O 1.237 0.445 0 C-N-CA 123.905 0.882 . . . . 0.0 109.915 -175.785 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -146.62 172.53 13.45 Favored 'General case' 0 C--N 1.326 -0.452 0 C-N-CA 127.568 2.347 . . . . 0.0 106.906 -175.162 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -52.18 -0.22 0.01 OUTLIER 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 128.875 2.87 . . . . 0.0 116.383 173.657 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 173.34 -159.74 29.94 Favored Glycine 0 N--CA 1.444 -0.804 0 CA-C-N 119.776 1.171 . . . . 0.0 110.321 -162.571 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -134.33 157.63 77.04 Favored Pre-proline 0 CA--C 1.537 0.473 0 C-N-CA 125.783 1.633 . . . . 0.0 109.479 179.016 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_endo -64.64 136.77 51.39 Favored 'Trans proline' 0 N--CA 1.457 -0.634 0 C-N-CA 122.918 2.412 . . . . 0.0 111.302 -178.892 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 44.8 m 59.49 -176.0 0.1 Allowed 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 125.678 1.591 . . . . 0.0 111.942 -176.785 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 44.5 tttt 56.0 38.78 30.32 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 123.556 0.742 . . . . 0.0 110.623 177.341 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 20.5 pt-20 -147.62 21.69 1.16 Allowed 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 126.183 1.793 . . . . 0.0 111.229 -177.523 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 82.85 -16.53 26.31 Favored Glycine 0 CA--C 1.533 1.167 0 O-C-N 120.937 -1.102 . . . . 0.0 113.205 -175.179 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 54.2 mttt -100.04 10.42 41.31 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 119.636 1.718 . . . . 0.0 114.14 179.049 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -47.44 -23.16 0.55 Allowed 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 126.392 1.877 . . . . 0.0 115.021 178.542 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 7.8 ptmt -134.0 26.32 3.92 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 124.418 1.087 . . . . 0.0 111.593 176.584 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 15.2 mmtp -134.75 28.19 3.59 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 124.652 1.181 . . . . 0.0 111.588 -171.72 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -61.64 -72.03 0.13 Allowed 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 123.44 0.696 . . . . 0.0 110.454 174.406 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 52.61 66.09 1.32 Allowed 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 124.83 1.252 . . . . 0.0 109.871 -165.997 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 62.2 t-80 -59.19 136.52 57.98 Favored 'General case' 0 C--O 1.239 0.516 0 N-CA-C 109.638 -0.505 . . . . 0.0 109.638 172.036 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 9.0 mtpt -131.46 -78.81 0.52 Allowed 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 124.709 1.204 . . . . 0.0 108.841 176.178 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 10.5 m 45.83 54.79 7.54 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 119.215 0.916 . . . . 0.0 108.951 -162.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 44.9 tttp . . . . . 0 C--O 1.248 1.011 0 O-C-N 120.704 -1.248 . . . . 0.0 108.928 178.002 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.635 0 N-CA-C 109.828 -1.309 . . . . 0.0 109.828 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -144.65 146.3 32.19 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 108.074 -1.084 . . . . 0.0 108.074 174.954 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 5.1 ptt? -65.32 165.76 11.16 Favored 'General case' 0 C--O 1.236 0.348 0 N-CA-C 109.912 -0.403 . . . . 0.0 109.912 178.712 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 32.8 mt-30 -63.33 96.7 0.11 Allowed 'General case' 0 C--O 1.234 0.237 0 C-N-CA 124.05 0.94 . . . . 0.0 109.135 172.406 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -143.09 22.24 1.91 Allowed 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 127.33 2.252 . . . . 0.0 109.33 -174.631 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 8.7 t -71.0 108.5 4.6 Favored 'General case' 0 N--CA 1.454 -0.275 0 O-C-N 119.717 -1.864 . . . . 0.0 107.281 171.921 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 44.6 p90 -63.08 -41.56 99.45 Favored 'General case' 0 N--CA 1.456 -0.162 0 C-N-CA 122.771 0.429 . . . . 0.0 111.034 -175.188 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 52.16 78.16 0.13 Allowed 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 126.485 1.914 . . . . 0.0 110.419 177.73 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -69.39 -38.08 77.84 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 114.955 -1.02 . . . . 0.0 111.622 -169.752 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 12.9 m-85 -126.41 165.74 26.11 Favored Pre-proline 0 CA--C 1.539 0.553 0 C-N-CA 126.605 1.962 . . . . 0.0 110.055 176.61 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -59.23 -164.88 0.03 OUTLIER 'Trans proline' 0 CA--C 1.542 0.916 1 C-N-CA 125.769 4.312 . . . . 0.0 113.881 162.268 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 47.0 t -126.2 88.06 55.01 Favored Pre-proline 0 CA--C 1.541 0.613 0 C-N-CA 127.083 2.153 . . . . 0.0 108.804 -176.473 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_endo -65.24 160.0 44.33 Favored 'Trans proline' 0 CA--C 1.539 0.745 0 C-N-CA 123.657 2.905 . . . . 0.0 112.451 -173.468 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 42.5 t0 -148.73 127.64 12.67 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 106.709 -1.589 . . . . 0.0 106.709 175.797 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 11.3 p -60.4 -21.44 22.9 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.534 0 C-N-CA 123.956 0.902 . . . . 0.0 112.123 177.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 42.6 t -62.77 -7.49 5.06 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 125.489 1.516 . . . . 0.0 113.381 -178.882 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 14.5 t -124.29 12.35 8.82 Favored 'General case' 0 CA--C 1.533 0.296 0 O-C-N 120.549 -1.344 . . . . 0.0 111.34 177.142 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 10.9 m-30 -73.88 169.28 17.74 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-O 122.101 0.953 . . . . 0.0 110.8 175.423 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 27.2 mt-30 -113.55 101.72 9.61 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 125.936 1.694 . . . . 0.0 107.49 177.763 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 74.9 t80 -67.17 147.02 53.62 Favored 'General case' 0 C--N 1.328 -0.348 0 O-C-N 121.82 -0.55 . . . . 0.0 110.215 169.828 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -129.17 87.99 2.64 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 123.351 0.661 . . . . 0.0 110.793 179.789 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -58.72 -21.94 56.27 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 114.075 1.139 . . . . 0.0 114.075 -168.967 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 3.2 t -58.61 -19.12 35.85 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.577 1.151 . . . . 0.0 112.41 174.405 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 48.8 m -137.54 -23.51 1.08 Allowed 'General case' 0 CA--C 1.539 0.519 0 N-CA-C 114.563 1.32 . . . . 0.0 114.563 177.43 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 98.6 19.98 20.98 Favored Glycine 0 CA--C 1.536 1.364 0 CA-C-N 120.361 1.437 . . . . 0.0 115.535 170.413 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 7.7 m-85 -122.62 169.55 10.92 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 119.595 1.698 . . . . 0.0 110.395 175.72 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 88.3 m-85 -102.49 153.43 20.06 Favored 'General case' 0 N--CA 1.448 -0.531 0 C-N-CA 125.186 1.395 . . . . 0.0 109.617 173.656 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 55.2 t80 -118.86 143.75 46.78 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 126.107 1.763 . . . . 0.0 108.699 172.147 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 65.7 t0 -106.15 87.29 2.43 Favored Pre-proline 0 C--N 1.33 -0.272 0 C-N-CA 126.749 2.02 . . . . 0.0 111.941 -175.738 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -61.16 -6.74 6.92 Favored 'Trans proline' 0 CA--C 1.535 0.551 0 C-N-CA 123.038 2.492 . . . . 0.0 114.747 176.145 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 54.5 mt-30 -74.98 -19.97 59.87 Favored 'General case' 0 CA--C 1.535 0.366 0 O-C-N 120.731 -1.23 . . . . 0.0 111.057 173.772 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 27.5 p -143.19 -40.75 0.31 Allowed 'General case' 0 C--O 1.235 0.339 0 C-N-CA 123.687 0.795 . . . . 0.0 112.791 -166.364 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 96.03 40.25 4.09 Favored Glycine 0 CA--C 1.525 0.663 0 C-N-CA 124.606 1.098 . . . . 0.0 111.744 -176.046 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 10.8 mt -115.56 167.01 11.27 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 124.961 1.305 . . . . 0.0 108.997 172.853 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 37.2 m-85 -106.88 160.57 15.41 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 118.801 0.728 . . . . 0.0 110.359 166.37 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 38.3 t80 -141.95 152.02 43.12 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 126.593 1.957 . . . . 0.0 109.23 -174.78 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -124.63 143.71 44.23 Favored Pre-proline 0 CA--C 1.535 0.402 0 C-N-CA 125.762 1.625 . . . . 0.0 108.797 174.863 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 95.5 Cg_endo -77.46 -21.27 11.74 Favored 'Trans proline' 0 CA--C 1.535 0.535 0 C-N-CA 123.089 2.526 . . . . 0.0 115.159 -172.553 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 81.9 m-20 -92.31 -33.94 14.41 Favored 'General case' 0 N--CA 1.447 -0.622 0 C-N-CA 125.513 1.525 . . . . 0.0 110.018 174.731 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 41.5 p -125.19 84.1 2.24 Favored 'General case' 0 N--CA 1.451 -0.375 0 C-N-CA 123.861 0.864 . . . . 0.0 108.806 -165.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 21.0 mp0 -57.87 -1.09 0.09 Allowed 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 127.149 2.18 . . . . 0.0 114.726 -175.666 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 45.3 m-85 -65.4 107.48 1.67 Allowed 'General case' 0 C--O 1.236 0.35 0 C-N-CA 125.529 1.532 . . . . 0.0 107.807 169.764 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 68.9 m-85 -65.72 140.83 58.48 Favored 'General case' 0 C--O 1.235 0.312 0 C-N-CA 123.87 0.868 . . . . 0.0 108.846 -178.96 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 64.8 t80 -95.29 109.72 21.82 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-O 122.752 1.263 . . . . 0.0 108.2 175.246 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 35.9 t30 -83.29 80.32 9.11 Favored 'General case' 0 N--CA 1.44 -0.946 0 CA-C-N 114.171 -1.377 . . . . 0.0 108.509 173.966 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -46.25 -35.3 5.11 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 125.095 1.358 . . . . 0.0 112.225 178.444 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -44.41 -50.62 9.18 Favored 'General case' 0 N--CA 1.444 -0.756 0 C-N-CA 127.942 2.497 . . . . 0.0 111.908 177.624 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 13.9 m -126.09 19.4 7.67 Favored 'General case' 0 C--N 1.332 -0.169 0 C-N-CA 124.845 1.258 . . . . 0.0 111.065 -178.345 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 11.1 mp0 50.88 18.67 0.54 Allowed 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 127.75 2.42 . . . . 0.0 113.275 -174.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -84.82 164.07 18.68 Favored 'General case' 0 N--CA 1.447 -0.578 0 C-N-CA 125.145 1.378 . . . . 0.0 111.303 -170.463 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 4.9 m-85 -118.57 121.57 40.54 Favored 'General case' 0 N--CA 1.449 -0.516 0 N-CA-C 105.62 -1.993 . . . . 0.0 105.62 -177.119 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 63.7 mt -124.4 176.56 6.4 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 125.076 1.35 . . . . 0.0 108.223 -170.895 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 13.5 p90 -135.4 148.21 49.28 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 108.121 -1.066 . . . . 0.0 108.121 168.604 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 57.8 t-105 -74.89 135.44 41.5 Favored 'General case' 0 C--O 1.236 0.359 0 N-CA-C 106.395 -1.706 . . . . 0.0 106.395 165.898 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 35.3 t0 -129.05 95.05 3.97 Favored 'General case' 0 N--CA 1.448 -0.564 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 177.567 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -66.09 -17.98 66.35 Favored Glycine 0 CA--C 1.526 0.744 0 CA-C-O 119.232 -0.76 . . . . 0.0 112.381 176.647 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 -68.33 -30.29 69.23 Favored 'General case' 0 C--N 1.34 0.166 0 CA-C-N 119.206 1.503 . . . . 0.0 109.366 174.559 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 47.6 mtt180 -102.86 -9.9 19.52 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.67 1.188 . . . . 0.0 112.106 178.327 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 11.8 mtm-85 44.68 54.94 6.23 Favored 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 127.539 2.335 . . . . 0.0 111.111 -167.297 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 7.5 t -154.94 178.15 10.5 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 124.092 0.957 . . . . 0.0 109.104 177.995 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 97.3 m-85 -109.36 128.28 54.99 Favored 'General case' 0 C--O 1.233 0.221 0 N-CA-C 107.571 -1.27 . . . . 0.0 107.571 168.349 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -126.73 158.34 68.4 Favored Pre-proline 0 C--N 1.324 -0.525 0 C-N-CA 126.494 1.918 . . . . 0.0 110.64 -173.692 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -72.61 136.93 26.74 Favored 'Trans proline' 0 N--CA 1.455 -0.778 0 C-N-CA 122.421 2.081 . . . . 0.0 110.135 -178.057 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -103.12 17.13 24.81 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 123.521 0.728 . . . . 0.0 111.959 -176.824 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 27.1 mt -71.47 -29.08 64.42 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 123.831 0.852 . . . . 0.0 110.019 -173.513 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 12.9 mt-10 -66.17 -18.75 65.54 Favored 'General case' 0 C--O 1.235 0.325 0 C-N-CA 125.592 1.557 . . . . 0.0 112.89 176.281 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 13.4 tt0 -76.94 71.03 3.43 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-N 119.805 1.184 . . . . 0.0 112.534 -169.192 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 1.4 t -137.13 50.31 2.0 Allowed 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 126.246 1.819 . . . . 0.0 107.905 173.381 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -58.07 103.65 0.15 Allowed 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 125.74 1.616 . . . . 0.0 107.243 165.269 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -148.25 1.92 0.64 Allowed 'General case' 0 N--CA 1.466 0.352 0 N-CA-C 113.574 0.953 . . . . 0.0 113.574 -175.073 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 105.0 69.0 0.75 Allowed Glycine 0 C--N 1.333 0.397 0 N-CA-C 109.72 -1.352 . . . . 0.0 109.72 -174.373 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 12.6 m170 48.76 58.78 4.93 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 125.627 1.571 . . . . 0.0 110.241 -179.053 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 48.4 mttm -131.53 27.99 4.66 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 125.726 1.61 . . . . 0.0 109.96 173.745 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -65.0 166.2 9.72 Favored 'General case' 0 C--O 1.24 0.594 0 O-C-N 121.445 -0.785 . . . . 0.0 109.537 176.55 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 2.2 m -48.87 -37.57 19.96 Favored 'General case' 0 N--CA 1.444 -0.742 0 C-N-CA 126.968 2.107 . . . . 0.0 112.643 -178.777 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -65.11 -47.49 80.99 Favored Glycine 0 CA--C 1.521 0.434 0 N-CA-C 111.423 -0.671 . . . . 0.0 111.423 -169.967 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . 43.66 63.9 7.48 Favored Pre-proline 0 C--O 1.238 0.492 0 C-N-CA 126.666 1.986 . . . . 0.0 113.568 173.885 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo -72.54 -6.58 19.32 Favored 'Trans proline' 0 N--CA 1.455 -0.771 0 C-N-CA 123.313 2.676 . . . . 0.0 112.658 177.124 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 22.7 t -141.91 154.93 45.45 Favored 'General case' 0 N--CA 1.447 -0.602 0 N-CA-C 106.429 -1.693 . . . . 0.0 106.429 160.501 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 72.5 mttt -137.96 19.32 2.82 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.567 1.147 . . . . 0.0 110.124 159.948 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 68.56 104.33 0.05 Allowed 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 126.248 1.819 . . . . 0.0 111.076 -172.673 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 110.63 -26.08 13.71 Favored Glycine 0 CA--C 1.527 0.816 0 C-N-CA 125.6 1.571 . . . . 0.0 112.844 173.123 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 6.9 mtpt -131.18 20.13 4.88 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 118.337 1.068 . . . . 0.0 112.378 -172.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -47.4 117.39 1.76 Allowed 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 119.554 1.07 . . . . 0.0 111.772 178.095 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 12.8 mtmt 61.03 -12.78 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 127.039 2.136 . . . . 0.0 114.147 -176.439 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -83.6 52.39 2.24 Favored 'General case' 0 N--CA 1.462 0.16 0 O-C-N 119.773 -1.829 . . . . 0.0 108.71 178.778 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -125.99 8.76 7.42 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 124.611 1.165 . . . . 0.0 111.945 -177.854 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . 0.257 0.2 OUTLIER 58.85 -178.97 0.08 Allowed 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 127.799 2.44 . . . . 0.0 112.424 -159.49 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -140.53 163.65 32.28 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 107.554 -1.276 . . . . 0.0 107.554 163.189 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 3.0 tttp -86.6 21.15 2.25 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 123.285 0.634 . . . . 0.0 111.12 175.451 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 4.2 m 64.42 85.13 0.14 Allowed 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 125.288 1.435 . . . . 0.0 109.04 -158.904 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 8.7 mttm . . . . . 0 C--O 1.25 1.124 0 C-N-CA 127.953 2.501 . . . . 0.0 105.998 174.579 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.573 0 N-CA-C 109.451 -1.46 . . . . 0.0 109.451 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 31.7 m170 -123.54 -172.64 2.56 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 126.407 1.883 . . . . 0.0 109.172 -177.578 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 46.3 mtt -130.57 161.51 31.37 Favored 'General case' 0 N--CA 1.467 0.383 0 O-C-N 121.274 -0.891 . . . . 0.0 108.817 178.631 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 5.5 tp60 -102.24 27.28 6.83 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.385 1.474 . . . . 0.0 110.607 -168.715 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 20.1 pt-20 -62.41 -20.43 64.47 Favored 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 114.018 1.118 . . . . 0.0 114.018 -169.768 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 3.1 m 52.12 56.61 7.51 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.834 1.254 . . . . 0.0 112.238 176.474 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -74.5 121.91 22.25 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 177.646 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 88.7 p -160.53 148.79 16.44 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 118.119 -0.944 . . . . 0.0 112.247 176.24 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 6.0 pt20 -153.54 -22.71 0.14 Allowed 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 116.498 2.036 . . . . 0.0 116.498 172.08 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 37.8 m-85 -94.89 165.19 17.59 Favored Pre-proline 0 C--O 1.241 0.614 0 O-C-N 120.958 -1.089 . . . . 0.0 109.202 172.256 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 29.5 Cg_endo -65.29 -178.25 0.81 Allowed 'Trans proline' 0 CA--C 1.54 0.824 0 C-N-CA 122.965 2.443 . . . . 0.0 111.422 160.202 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 59.1 t -111.34 87.99 8.31 Favored Pre-proline 0 CA--C 1.537 0.465 0 C-N-CA 127.653 2.381 . . . . 0.0 107.584 -173.242 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -68.82 164.92 31.57 Favored 'Trans proline' 0 CA--C 1.539 0.74 0 C-N-CA 123.467 2.778 . . . . 0.0 111.751 -179.109 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.9 t0 -143.25 130.58 20.96 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 108.003 -1.11 . . . . 0.0 108.003 167.653 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 14.0 p -58.68 -17.3 10.26 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.769 0 C-N-CA 124.25 1.02 . . . . 0.0 112.047 176.456 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 32.2 t -53.55 -26.2 20.28 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 125.708 1.603 . . . . 0.0 113.061 173.535 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 5.9 t -119.77 17.68 12.68 Favored 'General case' 0 CA--C 1.545 0.774 0 CA-C-N 119.33 0.968 . . . . 0.0 111.738 -175.18 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 8.1 m-30 -73.64 -168.98 0.63 Allowed 'General case' 0 C--O 1.237 0.398 0 C-N-CA 125.305 1.442 . . . . 0.0 110.456 171.741 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 6.8 mt-30 -122.43 150.86 41.9 Favored 'General case' 0 N--CA 1.446 -0.637 0 N-CA-C 107.018 -1.475 . . . . 0.0 107.018 163.81 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 78.2 t80 -93.95 152.42 18.86 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 108.122 -1.066 . . . . 0.0 108.122 163.909 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -136.05 86.52 2.24 Favored 'General case' 0 CA--C 1.511 -0.539 0 N-CA-C 107.477 -1.305 . . . . 0.0 107.477 175.114 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -47.03 -30.89 2.91 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 126.773 2.029 . . . . 0.0 112.773 179.773 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 1.3 t -65.9 -26.78 67.77 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 123.844 0.858 . . . . 0.0 110.682 -176.78 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 30.2 m -109.15 -24.15 11.28 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.599 1.159 . . . . 0.0 111.641 167.544 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 79.93 27.62 52.77 Favored Glycine 0 CA--C 1.526 0.757 0 C-N-CA 124.558 1.075 . . . . 0.0 112.162 -178.384 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 31.4 m-85 -118.09 169.1 9.95 Favored 'General case' 0 CA--C 1.521 -0.169 0 C-N-CA 124.965 1.306 . . . . 0.0 108.426 179.51 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 73.6 m-85 -94.17 154.46 17.56 Favored 'General case' 0 N--CA 1.449 -0.499 0 N-CA-C 108.25 -1.018 . . . . 0.0 108.25 159.848 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 20.1 t80 -117.93 137.1 53.06 Favored 'General case' 0 N--CA 1.447 -0.624 0 C-N-CA 127.845 2.458 . . . . 0.0 106.472 174.636 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 47.9 t0 -100.62 86.72 0.69 Allowed Pre-proline 0 C--N 1.327 -0.384 0 C-N-CA 128.088 2.555 . . . . 0.0 108.359 -179.648 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_endo -66.0 -11.9 33.03 Favored 'Trans proline' 0 N--CA 1.458 -0.593 0 C-N-CA 122.162 1.908 . . . . 0.0 114.244 177.646 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 56.7 mm-40 -63.51 -52.99 58.86 Favored 'General case' 0 C--O 1.233 0.196 0 N-CA-C 107.164 -1.421 . . . . 0.0 107.164 173.276 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 45.4 p -110.35 -32.53 6.92 Favored 'General case' 0 CA--C 1.532 0.274 0 N-CA-C 114.112 1.153 . . . . 0.0 114.112 -169.564 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 106.74 12.16 25.06 Favored Glycine 0 CA--C 1.529 0.968 0 C-N-CA 124.994 1.283 . . . . 0.0 113.378 -175.816 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 50.7 mt -87.58 169.52 12.1 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 118.57 1.185 . . . . 0.0 109.701 178.453 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 42.7 m-85 -112.02 161.53 16.36 Favored 'General case' 0 C--O 1.234 0.284 0 O-C-N 121.454 -0.779 . . . . 0.0 109.062 163.076 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 93.3 t80 -142.63 152.67 42.72 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 126.077 1.751 . . . . 0.0 108.685 -176.384 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -124.15 144.18 44.68 Favored Pre-proline 0 N--CA 1.467 0.38 0 CA-C-N 118.777 0.717 . . . . 0.0 109.892 177.11 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -72.99 -34.25 6.65 Favored 'Trans proline' 0 N--CA 1.456 -0.727 0 C-N-CA 122.263 1.975 . . . . 0.0 114.271 -177.366 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -77.65 -27.59 51.04 Favored 'General case' 0 CA--C 1.517 -0.323 0 CA-C-N 120.043 1.292 . . . . 0.0 112.617 172.791 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -134.08 83.66 2.06 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 106.833 -1.543 . . . . 0.0 106.833 -153.522 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -60.23 -6.77 1.59 Allowed 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 126.167 1.787 . . . . 0.0 114.18 -165.754 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 39.1 m-85 -65.04 123.57 19.82 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 123.956 0.902 . . . . 0.0 110.048 171.766 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 38.8 m-85 -75.44 152.86 37.9 Favored 'General case' 0 N--CA 1.45 -0.451 0 N-CA-C 108.688 -0.856 . . . . 0.0 108.688 174.046 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 9.0 t80 -114.42 109.12 17.83 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 126.099 1.76 . . . . 0.0 106.641 -177.885 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 44.7 t30 -83.62 77.15 9.9 Favored 'General case' 0 N--CA 1.445 -0.688 0 C-N-CA 125.272 1.429 . . . . 0.0 107.357 171.129 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -52.18 -33.14 39.37 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 123.017 0.527 . . . . 0.0 110.32 178.667 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -47.78 -32.04 5.55 Favored 'General case' 0 N--CA 1.448 -0.548 0 C-N-CA 127.663 2.385 . . . . 0.0 114.74 178.069 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 19.9 m -138.36 25.96 2.64 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 123.851 0.86 . . . . 0.0 110.039 170.12 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 24.5 mt-30 52.35 18.44 0.92 Allowed 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 127.503 2.321 . . . . 0.0 114.893 -176.859 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -95.52 159.58 14.92 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 123.638 0.775 . . . . 0.0 110.535 -166.942 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 9.5 m-85 -114.12 127.15 55.78 Favored 'General case' 0 CA--C 1.516 -0.358 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 -169.947 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 53.2 mt -126.53 174.63 8.51 Favored 'General case' 0 C--N 1.324 -0.54 0 C-N-CA 124.415 1.086 . . . . 0.0 108.691 -170.066 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 13.5 p90 -134.59 153.49 51.94 Favored 'General case' 0 N--CA 1.447 -0.608 0 N-CA-C 106.881 -1.526 . . . . 0.0 106.881 162.072 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 46.9 t-105 -78.28 127.69 32.61 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 105.713 -1.958 . . . . 0.0 105.713 164.703 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 19.9 t0 -110.24 108.78 19.02 Favored 'General case' 0 CA--C 1.515 -0.378 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 166.475 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -72.57 -15.39 77.57 Favored Glycine 0 N--CA 1.441 -1.003 0 CA-C-O 116.84 -2.089 . . . . 0.0 112.831 176.266 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -69.87 -56.18 7.76 Favored 'General case' 0 C--N 1.346 0.442 0 CA-C-N 121.021 2.411 . . . . 0.0 107.596 176.667 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 62.3 mtt85 -80.96 -3.97 53.41 Favored 'General case' 0 N--CA 1.456 -0.136 0 C-N-CA 124.047 0.939 . . . . 0.0 113.148 178.937 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 42.0 mtt180 43.36 58.18 3.52 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 126.982 2.113 . . . . 0.0 109.7 -175.276 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 6.2 t -153.88 157.45 39.29 Favored 'General case' 0 N--CA 1.448 -0.563 0 N-CA-C 107.143 -1.428 . . . . 0.0 107.143 176.759 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 71.7 m-85 -86.88 132.07 33.92 Favored 'General case' 0 C--O 1.237 0.398 0 N-CA-C 106.202 -1.777 . . . . 0.0 106.202 169.662 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -125.8 154.48 73.38 Favored Pre-proline 0 C--N 1.322 -0.627 0 C-N-CA 125.124 1.37 . . . . 0.0 110.391 -176.682 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -72.22 130.3 16.21 Favored 'Trans proline' 0 N--CA 1.454 -0.834 0 C-N-CA 122.523 2.149 . . . . 0.0 110.253 -178.112 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -91.36 14.54 14.31 Favored 'General case' 0 C--O 1.235 0.297 0 N-CA-C 112.992 0.738 . . . . 0.0 112.992 -178.539 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 5.7 mp -71.33 -44.44 65.11 Favored 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 124.869 1.268 . . . . 0.0 112.005 -169.461 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -152.27 -49.74 0.11 Allowed 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 107.302 -1.369 . . . . 0.0 107.302 -165.56 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 61.91 26.85 16.28 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 124.954 1.302 . . . . 0.0 111.273 173.659 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 27.2 m -163.6 96.45 0.84 Allowed 'General case' 0 N--CA 1.453 -0.317 0 N-CA-C 106.456 -1.683 . . . . 0.0 106.456 -177.308 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -156.92 170.23 22.98 Favored 'General case' 0 N--CA 1.448 -0.569 0 N-CA-C 108.04 -1.096 . . . . 0.0 108.04 173.176 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -72.3 -17.96 61.83 Favored 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 124.171 0.988 . . . . 0.0 112.795 -169.175 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 150.0 -15.98 1.04 Allowed Glycine 0 CA--C 1.525 0.692 0 C-N-CA 124.704 1.145 . . . . 0.0 113.068 175.016 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 14.6 m-70 -61.39 -50.35 73.21 Favored 'General case' 0 C--O 1.226 -0.168 0 CA-C-N 118.222 1.011 . . . . 0.0 109.695 165.857 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . 0.305 0.0 OUTLIER 52.28 9.42 0.1 Allowed 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 128.861 2.864 . . . . 0.0 116.34 174.07 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -77.95 -40.79 38.37 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 125.504 1.522 . . . . 0.0 110.652 -173.165 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -157.62 -40.83 0.07 Allowed 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 124.629 1.172 . . . . 0.0 109.328 -177.857 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 174.89 -145.76 8.09 Favored Glycine 0 CA--C 1.524 0.623 0 N-CA-C 111.197 -0.761 . . . . 0.0 111.197 -167.6 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -144.48 165.34 23.67 Favored Pre-proline 0 CA--C 1.538 0.515 0 C-N-CA 125.887 1.675 . . . . 0.0 110.282 -175.208 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 98.9 Cg_endo -69.55 -164.34 0.12 Allowed 'Trans proline' 0 CA--C 1.543 0.946 0 C-N-CA 123.888 3.058 . . . . 0.0 109.824 155.557 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 63.25 8.44 3.39 Favored 'General case' 0 CA--C 1.549 0.918 0 O-C-N 120.415 -1.428 . . . . 0.0 112.543 179.367 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.99 -6.21 51.63 Favored 'General case' 0 N--CA 1.467 0.409 0 O-C-N 120.124 -1.61 . . . . 0.0 112.517 178.188 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 177.11 -46.3 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.131 0 C-N-CA 126.486 1.914 . . . . 0.0 106.12 -168.861 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -78.92 76.41 1.91 Allowed Glycine 0 N--CA 1.447 -0.573 0 C-N-CA 126.268 1.89 . . . . 0.0 110.344 -165.09 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 37.8 mttm 60.84 49.01 6.36 Favored 'General case' 0 N--CA 1.466 0.332 0 C-N-CA 126.288 1.835 . . . . 0.0 110.149 172.878 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.03 -57.19 13.17 Favored 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 127.337 2.255 . . . . 0.0 112.586 166.472 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 46.4 pttt -130.04 12.55 5.66 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 124.023 0.929 . . . . 0.0 113.197 -163.293 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 34.4 mmtp -133.03 93.56 3.21 Favored 'General case' 0 CA--C 1.516 -0.332 0 N-CA-C 106.724 -1.584 . . . . 0.0 106.724 -179.888 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -79.2 10.87 3.2 Favored 'General case' 0 CA--C 1.536 0.433 0 N-CA-C 113.099 0.777 . . . . 0.0 113.099 -176.08 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . 0.256 23.7 pttm 48.34 -153.63 0.09 Allowed 'General case' 0 N--CA 1.474 0.734 0 CA-C-N 119.661 1.119 . . . . 0.0 108.441 -173.784 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -133.1 49.88 2.28 Favored 'General case' 0 CA--C 1.535 0.371 0 O-C-N 120.901 -1.124 . . . . 0.0 108.03 172.575 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.414 ' HG3' ' H ' ' A' ' 91' ' ' THR . 18.3 tptt 49.31 -164.61 0.03 OUTLIER 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 107.884 -1.154 . . . . 0.0 107.884 -142.927 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . 0.414 ' H ' ' HG3' ' A' ' 90' ' ' LYS . 1.8 m -152.92 111.7 3.75 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 102.144 -3.28 . . . . 0.0 102.144 153.214 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . 0.457 ' HE2' ' C ' ' A' ' 92' ' ' LYS . 0.2 OUTLIER . . . . . 0 C--O 1.245 0.824 0 N-CA-C 103.559 -2.756 . . . . 0.0 103.559 172.787 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.121 0 N-CA-C 108.397 -1.881 . . . . 0.0 108.397 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 30.0 m170 -64.38 -23.45 67.3 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-N 118.813 1.307 . . . . 0.0 110.457 162.453 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 17.5 ptt? -136.26 175.94 9.14 Favored 'General case' 0 C--O 1.243 0.758 0 C-N-CA 127.85 2.46 . . . . 0.0 107.017 170.506 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -151.88 125.48 8.93 Favored 'General case' 0 N--CA 1.453 -0.287 0 N-CA-C 105.812 -1.921 . . . . 0.0 105.812 153.152 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -131.11 -74.39 0.53 Allowed 'General case' 0 C--O 1.237 0.443 0 N-CA-C 105.727 -1.953 . . . . 0.0 105.727 174.56 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.5 t 60.93 30.43 19.62 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 125.213 1.405 . . . . 0.0 110.093 -178.238 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 18.2 p90 -152.15 160.12 43.47 Favored 'General case' 0 N--CA 1.443 -0.782 0 C-N-CA 125.321 1.448 . . . . 0.0 108.255 168.748 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -144.39 -177.49 5.5 Favored 'General case' 0 C--O 1.24 0.557 0 O-C-N 121.742 -0.598 . . . . 0.0 111.326 171.306 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -105.36 -175.58 2.83 Favored 'General case' 0 N--CA 1.443 -0.808 0 C-N-CA 125.018 1.327 . . . . 0.0 108.928 164.117 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 36.6 m-85 -80.09 161.22 66.37 Favored Pre-proline 0 CA--C 1.539 0.52 0 CA-C-O 119.119 -0.467 . . . . 0.0 110.0 -173.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -66.09 169.55 13.37 Favored 'Trans proline' 0 C--N 1.349 0.57 0 C-N-CA 123.78 2.987 . . . . 0.0 109.828 172.803 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 38.8 t -111.94 85.4 6.42 Favored Pre-proline 0 CA--C 1.539 0.547 0 N-CA-C 107.659 -1.237 . . . . 0.0 107.659 177.668 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -72.92 178.38 6.52 Favored 'Trans proline' 0 N--CA 1.457 -0.643 0 C-N-CA 123.669 2.913 . . . . 0.0 111.035 177.285 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -159.3 32.21 0.2 Allowed 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 113.367 0.877 . . . . 0.0 113.367 -177.285 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . 0.373 11.9 p 42.88 23.25 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.553 1.08 0 C-N-CA 128.072 2.549 . . . . 0.0 113.085 -173.805 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 7.5 t -113.51 -12.73 12.88 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 127.795 2.438 . . . . 0.0 109.287 -174.746 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 2.8 p -112.7 1.57 15.73 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 124.516 1.127 . . . . 0.0 111.08 -179.945 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 11.5 m-30 -85.0 173.27 10.65 Favored 'General case' 0 C--N 1.341 0.235 0 C-N-CA 124.597 1.159 . . . . 0.0 111.344 -167.294 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 68.5 mt-30 -119.89 99.1 6.43 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 126.023 1.729 . . . . 0.0 108.541 -174.297 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 87.1 t80 -58.18 143.82 42.83 Favored 'General case' 0 C--N 1.326 -0.422 0 O-C-N 122.302 -0.249 . . . . 0.0 111.012 171.246 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 4.1 t0 -122.64 112.68 18.26 Favored 'General case' 0 CA--C 1.515 -0.379 0 C-N-CA 123.902 0.881 . . . . 0.0 109.802 172.716 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -63.46 -19.36 64.66 Favored 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 124.794 1.238 . . . . 0.0 112.974 176.875 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 3.2 t -59.48 -32.81 70.61 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 123.445 0.698 . . . . 0.0 111.643 176.62 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 66.6 m -132.6 -20.54 2.3 Favored 'General case' 0 N--CA 1.462 0.162 0 C-N-CA 123.953 0.901 . . . . 0.0 112.209 -173.781 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 86.83 10.9 71.6 Favored Glycine 0 CA--C 1.526 0.737 0 C-N-CA 124.084 0.849 . . . . 0.0 111.942 -179.684 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 5.0 m-85 -96.87 168.74 10.3 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-N 118.429 1.115 . . . . 0.0 108.438 -177.313 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 93.8 m-85 -100.94 141.18 34.2 Favored 'General case' 0 N--CA 1.45 -0.44 0 N-CA-C 107.404 -1.332 . . . . 0.0 107.404 171.205 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 39.0 t80 -107.6 139.79 41.59 Favored 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 125.532 1.533 . . . . 0.0 107.634 175.03 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 62.3 t0 -104.1 87.27 1.53 Allowed Pre-proline 0 C--N 1.328 -0.347 0 C-N-CA 126.108 1.763 . . . . 0.0 111.672 -178.734 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -61.5 -12.48 24.61 Favored 'Trans proline' 0 N--CA 1.457 -0.659 0 C-N-CA 122.505 2.137 . . . . 0.0 114.289 176.959 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 22.4 mm-40 -72.7 -30.12 63.95 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-N 119.205 0.911 . . . . 0.0 110.599 178.65 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 22.0 p -120.54 -50.28 2.21 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 124.657 1.183 . . . . 0.0 109.276 -166.947 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 101.12 46.11 1.77 Allowed Glycine 0 CA--C 1.525 0.709 0 N-CA-C 108.995 -1.642 . . . . 0.0 108.995 -168.68 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 20.9 mt -126.57 171.19 11.31 Favored 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 125.384 1.474 . . . . 0.0 109.295 176.682 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 51.0 m-85 -114.69 164.79 13.56 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 124.69 1.196 . . . . 0.0 108.672 166.18 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 50.3 t80 -145.64 152.11 39.13 Favored 'General case' 0 C--O 1.239 0.518 0 C-N-CA 126.873 2.069 . . . . 0.0 107.576 179.025 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -121.9 143.83 39.54 Favored Pre-proline 0 CA--C 1.535 0.39 0 C-N-CA 123.421 0.689 . . . . 0.0 109.636 175.219 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo -76.33 -25.68 9.62 Favored 'Trans proline' 0 N--CA 1.458 -0.593 0 C-N-CA 121.953 1.768 . . . . 0.0 113.236 -176.093 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 26.8 m-20 -90.9 -21.21 21.51 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 119.538 1.063 . . . . 0.0 112.676 175.262 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 86.4 p -129.26 91.12 3.13 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 123.861 0.864 . . . . 0.0 109.597 179.406 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -56.02 -5.96 0.21 Allowed 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 128.71 2.804 . . . . 0.0 115.63 -171.71 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 54.5 m-85 -68.95 158.47 34.6 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 123.861 0.864 . . . . 0.0 108.851 172.755 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 31.6 m-85 -105.26 133.16 50.48 Favored 'General case' 0 N--CA 1.449 -0.518 0 N-CA-C 108.286 -1.005 . . . . 0.0 108.286 179.788 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 74.6 t80 -90.28 118.18 29.59 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 107.982 -1.118 . . . . 0.0 107.982 175.517 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 20.9 t30 -96.49 86.2 4.09 Favored 'General case' 0 N--CA 1.442 -0.831 0 C-N-CA 126.328 1.851 . . . . 0.0 107.941 179.08 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -50.3 -36.27 31.03 Favored 'General case' 0 N--CA 1.463 0.223 0 C-N-CA 123.957 0.903 . . . . 0.0 111.544 179.584 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 3.8 tt0 -47.19 -37.97 11.15 Favored 'General case' 0 N--CA 1.446 -0.633 0 C-N-CA 127.284 2.234 . . . . 0.0 113.126 -176.764 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 13.6 m -135.79 24.3 3.36 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 124.588 1.155 . . . . 0.0 109.76 176.422 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . 0.364 4.6 pt20 44.65 23.72 0.08 Allowed 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 129.052 2.941 . . . . 0.0 114.403 -175.36 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -92.43 172.18 8.56 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 126.507 1.923 . . . . 0.0 111.361 -171.186 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 4.9 m-85 -118.28 131.55 56.34 Favored 'General case' 0 N--CA 1.45 -0.428 0 N-CA-C 106.965 -1.495 . . . . 0.0 106.965 -177.77 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 48.9 mt -125.92 176.69 6.8 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 126.156 1.782 . . . . 0.0 107.859 -177.063 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 13.9 p90 -139.83 149.35 43.36 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 107.706 -1.22 . . . . 0.0 107.706 168.274 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 39.7 t-105 -78.13 127.19 31.92 Favored 'General case' 0 C--O 1.239 0.506 0 N-CA-C 107.46 -1.311 . . . . 0.0 107.46 172.277 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -120.81 86.88 2.65 Favored 'General case' 0 CA--C 1.512 -0.496 0 CA-C-O 121.631 0.729 . . . . 0.0 109.516 -179.634 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -58.71 -19.33 42.33 Favored Glycine 0 CA--C 1.526 0.778 0 CA-C-O 118.648 -1.085 . . . . 0.0 111.996 175.891 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -59.6 -34.75 73.14 Favored 'General case' 0 C--N 1.342 0.28 0 CA-C-N 118.989 1.395 . . . . 0.0 109.368 176.553 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 21.6 mtt180 -121.77 -1.55 9.44 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 127.232 2.213 . . . . 0.0 111.509 -171.997 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 60.1 mtt180 44.26 54.39 6.16 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 127.715 2.406 . . . . 0.0 111.489 -171.17 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 10.2 t -148.68 175.56 11.1 Favored 'General case' 0 C--N 1.328 -0.357 0 O-C-N 122.047 -0.408 . . . . 0.0 109.947 175.473 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 87.9 m-85 -98.96 134.78 41.32 Favored 'General case' 0 C--O 1.237 0.405 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 168.149 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -126.44 154.81 75.05 Favored Pre-proline 0 C--N 1.322 -0.627 0 C-N-CA 125.667 1.587 . . . . 0.0 109.359 176.841 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_endo -76.65 122.46 6.43 Favored 'Trans proline' 0 N--CA 1.46 -0.499 0 C-N-CA 123.099 2.533 . . . . 0.0 112.26 -174.276 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -82.64 24.92 0.68 Allowed 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 124.691 1.196 . . . . 0.0 112.999 -178.219 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -57.34 114.43 2.19 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 124.82 1.248 . . . . 0.0 108.215 174.626 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.417 ' HG3' ' H ' ' A' ' 68' ' ' SER 0.258 4.9 tp10 64.33 -74.53 0.05 OUTLIER 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 128.31 2.644 . . . . 0.0 111.831 -176.712 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 53.55 32.77 14.87 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 128.17 2.588 . . . . 0.0 113.321 -171.336 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . 0.417 ' H ' ' HG3' ' A' ' 66' ' ' GLU . 0.5 OUTLIER -156.25 -5.24 0.11 Allowed 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 114.955 1.465 . . . . 0.0 114.955 -178.764 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -165.16 179.45 6.32 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 125.05 1.34 . . . . 0.0 109.663 -175.848 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -69.64 -52.18 28.16 Favored 'General case' 0 CA--C 1.534 0.341 0 O-C-N 121.722 -0.612 . . . . 0.0 110.685 -174.973 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 152.99 -115.92 0.71 Allowed Glycine 0 CA--C 1.527 0.804 0 C-N-CA 124.531 1.063 . . . . 0.0 111.079 173.687 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER 67.93 11.21 8.27 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 128.071 2.548 . . . . 0.0 111.494 -162.981 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 8.7 pttt -165.48 153.99 11.62 Favored 'General case' 0 C--O 1.235 0.302 0 O-C-N 120.359 -1.463 . . . . 0.0 109.186 -173.111 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -84.86 121.35 27.6 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 106.66 -1.607 . . . . 0.0 106.66 160.812 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 3.8 m 46.03 -74.9 0.0 OUTLIER 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 128.167 2.587 . . . . 0.0 115.549 158.761 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -152.89 -75.22 0.01 OUTLIER Glycine 0 N--CA 1.449 -0.493 0 C-N-CA 127.028 2.251 . . . . 0.0 107.99 -173.565 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . 74.95 154.28 0.15 Allowed Pre-proline 0 CA--C 1.548 0.891 0 C-N-CA 129.084 2.954 . . . . 0.0 111.141 -170.151 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 90.8 Cg_endo -86.03 -14.44 5.09 Favored 'Trans proline' 0 C--N 1.351 0.693 0 C-N-CA 124.692 3.594 . . . . 0.0 113.683 178.865 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 1.7 p -61.75 -178.74 0.16 Allowed 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 125.503 1.521 . . . . 0.0 109.526 160.329 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 29.1 tttt 72.36 46.37 0.31 Allowed 'General case' 0 N--CA 1.453 -0.279 0 CA-C-O 123.424 1.583 . . . . 0.0 109.071 168.513 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 73.33 72.12 0.13 Allowed 'General case' 0 CA--C 1.521 -0.168 0 C-N-CA 126.507 1.923 . . . . 0.0 108.15 163.346 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -169.93 -46.84 0.03 OUTLIER Glycine 0 C--N 1.332 0.333 0 CA-C-N 115.725 -0.671 . . . . 0.0 112.273 175.213 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 48.5 tttp -151.86 25.65 0.65 Allowed 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 117.951 0.876 . . . . 0.0 110.567 -173.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.73 -23.33 66.72 Favored 'General case' 0 CA--C 1.551 0.995 0 O-C-N 120.724 -1.235 . . . . 0.0 114.276 -162.504 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -119.5 1.91 11.2 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 127.522 2.329 . . . . 0.0 111.438 166.199 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . 0.304 0.0 OUTLIER 44.0 -168.25 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 127.296 2.238 . . . . 0.0 111.064 -150.431 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -109.99 -85.52 0.54 Allowed 'General case' 0 C--O 1.236 0.361 0 N-CA-C 108.418 -0.956 . . . . 0.0 108.418 -176.647 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -134.45 157.76 45.65 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 119.681 1.128 . . . . 0.0 110.561 177.018 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -82.57 -78.29 0.21 Allowed 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 108.075 -1.083 . . . . 0.0 108.075 172.951 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -157.64 8.34 0.16 Allowed 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 125.46 1.504 . . . . 0.0 111.577 -162.91 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 10.9 m 69.25 90.16 0.1 Allowed 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 125.609 1.563 . . . . 0.0 108.215 -165.082 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.104 0 C-N-CA 127.449 2.3 . . . . 0.0 107.065 172.634 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.72 0 N-CA-C 110.623 -0.991 . . . . 0.0 110.623 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 5.1 t60 75.38 97.92 0.07 Allowed 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 126.269 1.827 . . . . 0.0 110.006 -172.788 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 2.7 tpt 49.44 65.51 1.38 Allowed 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 126.449 1.899 . . . . 0.0 112.138 -178.025 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 68.5 mt-30 -66.58 117.9 9.42 Favored 'General case' 0 CA--C 1.534 0.338 0 O-C-N 121.514 -0.741 . . . . 0.0 109.26 168.307 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -79.36 -80.33 0.12 Allowed 'General case' 0 CA--C 1.532 0.273 0 N-CA-C 107.633 -1.247 . . . . 0.0 107.633 160.443 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 57.9 m 45.4 70.28 0.37 Allowed 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 125.256 1.422 . . . . 0.0 110.821 -163.32 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 3.3 p90 43.96 70.12 0.35 Allowed 'General case' 0 CA--C 1.515 -0.376 0 C-N-CA 127.095 2.158 . . . . 0.0 112.135 159.899 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -141.53 105.91 4.84 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-N 113.11 -1.859 . . . . 0.0 107.246 -173.053 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 1.4 pt20 -152.32 -171.78 4.04 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 126.162 1.785 . . . . 0.0 107.679 168.145 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 32.6 m-85 -88.47 159.36 47.2 Favored Pre-proline 0 CA--C 1.532 0.282 0 O-C-N 120.814 -1.179 . . . . 0.0 109.979 174.438 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 95.5 Cg_endo -67.91 177.7 4.06 Favored 'Trans proline' 0 N--CA 1.454 -0.834 0 C-N-CA 121.782 1.654 . . . . 0.0 109.023 161.282 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 45.7 t -104.71 86.27 1.4 Allowed Pre-proline 0 CA--C 1.537 0.46 0 C-N-CA 124.27 1.028 . . . . 0.0 109.162 -173.093 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_endo -69.62 153.69 69.25 Favored 'Trans proline' 0 N--CA 1.456 -0.694 0 C-N-CA 122.015 1.81 . . . . 0.0 110.386 -178.302 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -136.3 133.17 36.63 Favored 'General case' 0 C--O 1.235 0.305 0 C-N-CA 123.193 0.597 . . . . 0.0 111.808 -176.231 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.401 ' HA ' ' CD2' ' A' ' 18' ' ' TYR . 10.8 p -56.62 -25.95 22.33 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.407 0 C-N-CA 125.382 1.473 . . . . 0.0 113.544 -178.968 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 2.0 t -61.8 -12.3 16.52 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.999 0.919 . . . . 0.0 112.039 174.576 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 37.0 p -113.41 1.06 14.96 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.633 1.173 . . . . 0.0 111.723 -179.648 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.401 ' CD2' ' HA ' ' A' ' 15' ' ' VAL . 15.3 m-30 -79.77 166.56 21.62 Favored 'General case' 0 C--O 1.238 0.499 0 O-C-N 120.858 -1.151 . . . . 0.0 110.159 179.984 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 28.0 mt-30 -105.31 112.55 25.7 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 124.728 1.211 . . . . 0.0 108.573 175.356 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 61.5 t80 -61.34 137.66 58.24 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 108.558 -0.904 . . . . 0.0 108.558 169.86 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 22.2 t0 -117.74 70.44 0.79 Allowed 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 125.932 1.693 . . . . 0.0 109.436 -172.389 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.55 -3.79 1.63 Allowed 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 115.527 1.677 . . . . 0.0 115.527 -169.224 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 1.3 t -65.94 -27.17 67.97 Favored 'General case' 0 C--N 1.315 -0.897 0 C-N-CA 126.659 1.984 . . . . 0.0 111.795 164.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 25.0 p -127.78 -25.83 3.04 Favored 'General case' 0 C--O 1.237 0.419 0 CA-C-N 120.169 1.35 . . . . 0.0 112.464 174.914 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 96.64 9.5 56.39 Favored Glycine 0 CA--C 1.533 1.201 0 CA-C-N 118.737 0.698 . . . . 0.0 112.39 177.206 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 8.3 m-85 -100.58 177.29 5.05 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.774 1.63 . . . . 0.0 109.1 178.119 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 77.9 m-85 -101.59 139.55 37.1 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 106.997 -1.483 . . . . 0.0 106.997 166.698 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 17.4 t80 -101.97 135.62 43.21 Favored 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 125.827 1.651 . . . . 0.0 107.099 172.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -110.55 85.08 4.42 Favored Pre-proline 0 N--CA 1.442 -0.863 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 -171.004 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_endo -61.36 -13.5 29.25 Favored 'Trans proline' 0 C--N 1.348 0.511 0 C-N-CA 122.388 2.059 . . . . 0.0 113.362 -179.919 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 98.6 mm-40 -60.64 -28.96 68.95 Favored 'General case' 0 N--CA 1.448 -0.567 0 C-N-CA 124.877 1.271 . . . . 0.0 111.423 178.697 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 12.6 p -145.96 -18.17 0.45 Allowed 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 113.664 0.987 . . . . 0.0 113.664 -176.745 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 99.53 7.57 53.71 Favored Glycine 0 CA--C 1.531 1.059 0 CA-C-N 119.446 1.021 . . . . 0.0 114.065 179.23 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 40.0 mt -85.69 179.51 7.07 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 124.847 1.259 . . . . 0.0 109.612 175.249 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 25.0 m-85 -118.91 159.79 23.14 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 124.329 1.052 . . . . 0.0 109.35 162.815 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 71.1 t80 -127.19 165.68 19.15 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 128.402 2.681 . . . . 0.0 109.128 173.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 6.1 t0 -137.77 144.1 42.97 Favored Pre-proline 0 N--CA 1.465 0.283 0 O-C-N 120.735 -1.228 . . . . 0.0 108.294 177.829 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 68.9 Cg_endo -71.62 -30.49 14.69 Favored 'Trans proline' 0 N--CA 1.454 -0.808 0 C-N-CA 121.354 1.37 . . . . 0.0 113.422 -175.281 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 77.2 m-20 -87.77 -28.53 21.65 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 125.139 1.375 . . . . 0.0 110.483 175.411 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 1.6 m -117.76 95.47 4.94 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 123.775 0.83 . . . . 0.0 109.572 -176.084 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 20.4 mp0 -62.18 -2.79 1.05 Allowed 'General case' 0 CA--C 1.547 0.843 0 O-C-N 121.387 -0.821 . . . . 0.0 111.758 166.676 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 17.8 m-85 -70.57 98.87 1.55 Allowed 'General case' 0 N--CA 1.444 -0.736 0 C-N-CA 125.39 1.476 . . . . 0.0 107.538 162.736 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 34.3 m-85 -59.27 153.85 17.73 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 125.204 1.402 . . . . 0.0 110.072 175.418 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 76.8 t80 -110.19 113.45 26.14 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 125.011 1.324 . . . . 0.0 108.514 177.826 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 38.7 t30 -87.45 81.58 7.77 Favored 'General case' 0 N--CA 1.445 -0.695 0 C-N-CA 125.22 1.408 . . . . 0.0 108.888 177.553 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -44.9 -38.46 4.66 Favored 'General case' 0 C--N 1.341 0.202 0 C-N-CA 124.273 1.029 . . . . 0.0 111.723 176.07 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 4.4 tt0 -44.41 -38.85 4.29 Favored 'General case' 0 N--CA 1.446 -0.626 0 C-N-CA 127.843 2.457 . . . . 0.0 113.054 -177.376 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 70.8 m -136.61 16.17 3.13 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 124.305 1.042 . . . . 0.0 111.726 176.852 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 25.7 mt-30 58.77 14.89 3.44 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 126.855 2.062 . . . . 0.0 113.494 -173.297 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 41.2 mm-40 -77.31 167.06 22.34 Favored 'General case' 0 C--N 1.334 -0.07 0 O-C-N 121.139 -0.976 . . . . 0.0 111.459 -177.209 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 37.0 m-85 -114.27 132.8 56.02 Favored 'General case' 0 C--O 1.236 0.347 0 C-N-CA 124.145 0.978 . . . . 0.0 109.97 172.141 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 66.6 mt -129.81 179.91 5.57 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 126.55 1.94 . . . . 0.0 108.801 -173.609 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 23.6 p90 -144.64 157.98 43.97 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 124.012 0.925 . . . . 0.0 109.685 165.425 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 54.5 t-105 -89.18 125.49 35.08 Favored 'General case' 0 C--O 1.237 0.434 0 N-CA-C 107.121 -1.437 . . . . 0.0 107.121 170.276 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -120.99 108.69 14.18 Favored 'General case' 0 CA--C 1.516 -0.328 0 CA-C-O 121.304 0.573 . . . . 0.0 110.578 177.557 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -72.6 -1.75 53.84 Favored Glycine 0 CA--C 1.526 0.723 0 CA-C-O 117.99 -1.45 . . . . 0.0 114.294 -172.792 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 2.9 pt-20 -76.23 -54.49 6.72 Favored 'General case' 0 C--N 1.339 0.138 0 CA-C-N 120.072 1.936 . . . . 0.0 110.255 171.511 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 13.0 mtt180 -88.42 -8.11 55.51 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 124.17 0.988 . . . . 0.0 110.567 -177.856 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 3.3 mpt_? 44.88 59.46 3.41 Favored 'General case' 0 C--N 1.342 0.263 0 C-N-CA 125.988 1.715 . . . . 0.0 109.321 -174.326 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 8.4 t -148.88 179.49 7.81 Favored 'General case' 0 C--O 1.238 0.457 0 N-CA-C 108.766 -0.828 . . . . 0.0 108.766 175.917 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 72.0 m-85 -104.32 132.29 50.74 Favored 'General case' 0 C--O 1.241 0.641 0 C-N-CA 123.878 0.871 . . . . 0.0 109.656 172.853 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -127.57 154.96 77.62 Favored Pre-proline 0 C--N 1.326 -0.421 0 C-N-CA 126.638 1.975 . . . . 0.0 110.631 -178.671 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_endo -70.12 131.18 20.2 Favored 'Trans proline' 0 CA--C 1.534 0.5 0 C-N-CA 123.321 2.681 . . . . 0.0 111.732 174.483 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -95.87 63.97 2.4 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 124.729 1.211 . . . . 0.0 108.981 178.693 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 90.7 mt -125.75 97.68 5.24 Favored 'General case' 0 CA--C 1.519 -0.242 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 -166.395 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 75.21 -14.35 0.77 Allowed 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 127.219 2.208 . . . . 0.0 113.112 -171.093 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 4.0 tm0? -45.1 120.04 2.25 Favored 'General case' 0 C--O 1.238 0.487 0 C-N-CA 125.622 1.569 . . . . 0.0 109.382 165.268 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 4.1 m -177.01 108.68 0.07 Allowed 'General case' 0 N--CA 1.447 -0.585 0 C-N-CA 129.012 2.925 . . . . 0.0 106.388 179.519 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 58.02 -174.78 0.08 Allowed 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 126.1 1.76 . . . . 0.0 113.923 176.807 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -106.66 116.81 32.58 Favored 'General case' 0 C--O 1.239 0.533 0 C-N-CA 125.492 1.517 . . . . 0.0 107.727 -166.93 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -140.95 20.73 2.68 Favored Glycine 0 CA--C 1.538 1.525 0 C-N-CA 126.472 1.987 . . . . 0.0 112.894 -178.826 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 9.2 t-160 51.56 52.53 14.49 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 127.959 2.503 . . . . 0.0 112.069 179.602 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 40.5 mtmt -135.63 151.8 50.6 Favored 'General case' 0 C--O 1.234 0.252 0 C-N-CA 124.667 1.187 . . . . 0.0 108.402 177.587 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . 0.402 ' O ' ' HB ' ' A' ' 75' ' ' THR . 0.2 OUTLIER -72.12 73.14 0.91 Allowed 'General case' 0 C--O 1.233 0.212 0 N-CA-C 107.846 -1.168 . . . . 0.0 107.846 171.303 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . 0.402 ' HB ' ' O ' ' A' ' 74' ' ' GLU . 77.2 m 72.64 -46.51 0.65 Allowed 'General case' 0 CA--C 1.536 0.418 0 O-C-N 120.861 -1.15 . . . . 0.0 112.314 172.804 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 166.81 46.86 0.02 OUTLIER Glycine 0 N--CA 1.444 -0.809 0 O-C-N 121.311 -0.868 . . . . 0.0 111.68 -153.222 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -116.63 69.11 4.27 Favored Pre-proline 0 CA--C 1.541 0.628 0 CA-C-N 117.93 0.865 . . . . 0.0 111.093 172.07 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 64.9 Cg_endo -74.03 -4.04 14.76 Favored 'Trans proline' 0 CA--C 1.541 0.86 1 C-N-CA 125.478 4.119 . . . . 0.0 114.815 -175.743 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 70.1 m 50.73 28.69 3.73 Favored 'General case' 0 CA--C 1.544 0.725 0 N-CA-C 116.656 2.095 . . . . 0.0 116.656 165.755 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 1.3 mtpt -127.93 28.88 5.51 Favored 'General case' 0 N--CA 1.473 0.678 0 O-C-N 121.058 -1.026 . . . . 0.0 111.068 170.031 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 12.6 tp10 -124.13 15.98 9.16 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.56 1.144 . . . . 0.0 110.779 174.072 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 82.32 -0.31 89.07 Favored Glycine 0 CA--C 1.529 0.946 0 O-C-N 120.888 -1.132 . . . . 0.0 113.853 170.358 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 9.3 ptmt -98.16 11.17 38.62 Favored 'General case' 0 C--O 1.222 -0.382 0 CA-C-N 119.428 1.614 . . . . 0.0 110.254 168.534 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -52.13 -13.8 0.36 Allowed 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 129.816 3.246 . . . . 0.0 115.298 174.928 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 44.8 pttt -114.86 3.5 14.63 Favored 'General case' 0 C--O 1.233 0.232 0 C-N-CA 125.805 1.642 . . . . 0.0 111.117 -178.333 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 40.2 pttt -148.26 33.98 0.81 Allowed 'General case' 0 N--CA 1.453 -0.307 0 CA-C-O 117.622 -1.18 . . . . 0.0 112.853 -170.032 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -44.26 -58.57 2.82 Favored 'General case' 0 C--O 1.233 0.236 0 C-N-CA 125.149 1.379 . . . . 0.0 111.416 -171.926 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -73.82 -76.88 0.12 Allowed 'General case' 0 C--N 1.343 0.309 0 CA-C-N 119.42 1.009 . . . . 0.0 109.977 173.03 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 23.6 t-80 -152.95 33.44 0.48 Allowed 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 123.766 0.826 . . . . 0.0 110.74 -175.011 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 3.6 ttpm? 60.55 21.96 11.72 Favored 'General case' 0 N--CA 1.474 0.749 0 O-C-N 120.662 -1.274 . . . . 0.0 110.86 -172.901 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -66.98 164.86 16.76 Favored 'General case' 0 N--CA 1.448 -0.548 0 C-N-CA 124.914 1.286 . . . . 0.0 109.964 -176.179 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 38.7 mttp . . . . . 0 C--O 1.252 1.197 0 N-CA-C 104.252 -2.499 . . . . 0.0 104.252 161.418 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.901 0 N-CA-C 109.092 -1.603 . . . . 0.0 109.092 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 53.8 m170 -74.31 152.6 39.6 Favored 'General case' 0 C--O 1.241 0.615 0 CA-C-N 119.04 1.42 . . . . 0.0 108.391 161.895 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -123.99 163.81 20.63 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 125.63 1.572 . . . . 0.0 109.113 -178.269 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 12.4 mt-30 -141.59 -61.64 0.47 Allowed 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 125.773 1.629 . . . . 0.0 107.49 168.548 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 4.8 pt-20 -98.34 -27.3 14.17 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 123.84 0.856 . . . . 0.0 111.577 -169.637 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 20.2 m 44.34 70.75 0.3 Allowed 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 126.451 1.9 . . . . 0.0 112.295 -176.061 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -105.33 152.92 22.32 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-O 121.642 0.734 . . . . 0.0 109.535 169.641 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 5.4 t -166.57 -167.22 0.96 Allowed 'General case' 0 N--CA 1.447 -0.606 0 C-N-CA 124.184 0.993 . . . . 0.0 108.666 -172.527 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 88.4 mt-30 -67.56 164.92 17.95 Favored 'General case' 0 N--CA 1.447 -0.59 0 CA-C-O 121.941 0.877 . . . . 0.0 110.607 167.159 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 18.4 m-85 -94.22 163.03 24.57 Favored Pre-proline 0 CA--C 1.543 0.68 0 C-N-CA 126.511 1.924 . . . . 0.0 110.161 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 79.0 Cg_endo -73.53 -174.31 1.61 Allowed 'Trans proline' 0 CA--C 1.539 0.726 0 C-N-CA 123.989 3.126 . . . . 0.0 111.619 176.396 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 21.2 t -106.93 86.54 2.43 Favored Pre-proline 0 CA--C 1.532 0.276 0 C-N-CA 125.56 1.544 . . . . 0.0 108.452 176.589 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 91.7 Cg_endo -66.66 159.06 52.81 Favored 'Trans proline' 0 N--CA 1.457 -0.67 0 C-N-CA 122.161 1.907 . . . . 0.0 109.335 173.754 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.2 t0 -131.02 134.3 46.56 Favored 'General case' 0 C--O 1.234 0.249 0 N-CA-C 108.333 -0.988 . . . . 0.0 108.333 171.133 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.497 ' HA ' ' CD2' ' A' ' 18' ' ' TYR . 2.9 p -57.02 -25.18 22.0 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.472 0 C-N-CA 123.999 0.92 . . . . 0.0 111.864 178.002 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 56.6 m -59.08 -20.04 49.74 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 119.305 0.957 . . . . 0.0 113.51 173.222 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 12.2 p -119.07 16.33 13.28 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 119.805 1.184 . . . . 0.0 111.914 -176.761 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.497 ' CD2' ' HA ' ' A' ' 15' ' ' VAL . 20.2 m-30 -71.89 159.57 34.05 Favored 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 160.614 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 26.4 mt-30 -111.12 114.6 27.98 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 125.787 1.635 . . . . 0.0 111.788 177.479 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 49.5 t80 -67.08 156.76 35.27 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 120.618 1.554 . . . . 0.0 113.341 -177.654 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -129.47 102.98 6.63 Favored 'General case' 0 C--N 1.342 0.273 0 N-CA-C 107.561 -1.274 . . . . 0.0 107.561 166.075 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -52.75 -29.89 29.72 Favored 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 124.795 1.238 . . . . 0.0 112.063 171.368 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 1.4 t -67.1 -20.73 65.83 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-O 117.899 -1.048 . . . . 0.0 111.987 -174.461 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 72.9 m -136.0 -9.79 2.04 Favored 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 113.795 1.035 . . . . 0.0 113.795 177.505 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 81.54 6.3 89.27 Favored Glycine 0 CA--C 1.526 0.721 0 C-N-CA 124.469 1.033 . . . . 0.0 114.007 169.243 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 5.3 m-85 -97.97 169.26 9.76 Favored 'General case' 0 C--O 1.238 0.485 0 CA-C-N 118.328 1.064 . . . . 0.0 108.746 174.819 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 56.5 m-85 -104.04 140.26 38.0 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 125.799 1.639 . . . . 0.0 108.33 175.379 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 41.6 t80 -107.58 142.42 37.53 Favored 'General case' 0 CA--C 1.512 -0.497 0 N-CA-C 107.386 -1.339 . . . . 0.0 107.386 179.666 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 11.8 m-20 -117.4 78.02 10.64 Favored Pre-proline 0 N--CA 1.441 -0.913 0 N-CA-C 107.71 -1.219 . . . . 0.0 107.71 -160.753 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 22.3 Cg_endo -64.57 -4.69 8.74 Favored 'Trans proline' 0 C--N 1.348 0.513 0 C-N-CA 124.044 3.163 . . . . 0.0 113.989 -173.706 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 99.6 mm-40 -71.89 -24.37 61.64 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-O 118.823 -0.608 . . . . 0.0 111.008 172.421 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 1.1 p -143.57 -15.9 0.64 Allowed 'General case' 0 CA--C 1.532 0.274 0 N-CA-C 114.747 1.388 . . . . 0.0 114.747 -176.061 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 89.69 12.25 62.76 Favored Glycine 0 CA--C 1.531 1.043 0 CA-C-N 119.848 1.204 . . . . 0.0 113.563 -176.198 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 55.0 mt -88.83 178.83 6.34 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.574 1.149 . . . . 0.0 109.256 178.253 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 39.3 m-85 -124.19 149.74 46.0 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 123.577 0.751 . . . . 0.0 109.164 163.583 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 41.0 t80 -118.39 150.26 39.85 Favored 'General case' 0 C--O 1.24 0.56 0 C-N-CA 126.822 2.049 . . . . 0.0 109.628 178.0 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -116.85 143.54 31.69 Favored Pre-proline 0 CA--C 1.537 0.477 0 C-N-CA 123.444 0.698 . . . . 0.0 109.516 171.784 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_endo -81.51 -22.43 5.61 Favored 'Trans proline' 0 N--CA 1.458 -0.617 0 C-N-CA 122.509 2.139 . . . . 0.0 114.922 -174.098 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 56.5 m-80 -77.38 -40.66 42.99 Favored 'General case' 0 N--CA 1.445 -0.681 0 O-C-N 120.915 -1.116 . . . . 0.0 108.675 164.406 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 38.5 m -124.54 95.61 4.59 Favored 'General case' 0 N--CA 1.452 -0.375 0 CA-C-O 122.028 0.918 . . . . 0.0 110.536 -156.965 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 20.2 mp0 -62.55 3.62 0.2 Allowed 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 125.758 1.623 . . . . 0.0 113.871 -174.388 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 19.0 m-85 -79.41 98.63 6.84 Favored 'General case' 0 N--CA 1.438 -1.034 0 C-N-CA 125.333 1.453 . . . . 0.0 108.17 -179.604 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 48.6 m-85 -59.17 120.25 8.84 Favored 'General case' 0 N--CA 1.445 -0.7 0 C-N-CA 125.706 1.603 . . . . 0.0 109.014 177.949 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 79.5 t80 -78.65 138.52 38.35 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 124.242 1.017 . . . . 0.0 108.385 176.77 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 24.4 t30 -116.65 85.79 2.38 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 127.033 2.133 . . . . 0.0 107.256 175.025 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -45.41 -40.26 7.93 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 127.65 2.38 . . . . 0.0 111.736 178.004 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -44.63 -41.74 6.88 Favored 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 127.397 2.279 . . . . 0.0 112.704 179.823 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 4.0 m -129.87 14.21 5.82 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 125.495 1.518 . . . . 0.0 109.774 -176.723 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . 0.411 4.5 pt20 44.38 30.64 0.49 Allowed 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 128.732 2.813 . . . . 0.0 113.989 -172.745 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -90.77 162.83 14.69 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 127.402 2.281 . . . . 0.0 110.633 -169.435 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 3.4 m-85 -110.44 131.8 54.74 Favored 'General case' 0 C--O 1.233 0.234 0 C-N-CA 124.558 1.143 . . . . 0.0 108.991 174.019 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 60.7 mt -128.67 178.08 6.58 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 126.91 2.084 . . . . 0.0 108.218 -178.129 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 9.6 p90 -138.03 148.38 45.05 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 106.807 -1.553 . . . . 0.0 106.807 166.922 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 43.8 t-105 -71.96 136.92 46.97 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 105.42 -2.067 . . . . 0.0 105.42 162.412 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -131.07 95.85 3.9 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 178.403 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -71.25 -5.5 59.26 Favored Glycine 0 CA--C 1.528 0.851 0 CA-C-O 118.722 -1.043 . . . . 0.0 112.538 -178.373 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -71.9 -58.77 3.17 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 119.496 1.648 . . . . 0.0 107.096 173.182 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 75.6 mtt-85 -80.36 -18.54 48.74 Favored 'General case' 0 C--O 1.232 0.173 0 C-N-CA 125.381 1.472 . . . . 0.0 112.636 -179.804 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 97.6 mtt180 55.93 58.84 4.12 Favored 'General case' 0 C--O 1.234 0.239 0 C-N-CA 127.094 2.157 . . . . 0.0 109.457 -173.912 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 6.2 t -155.22 -177.69 6.72 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 125.195 1.398 . . . . 0.0 108.55 175.045 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 76.0 m-85 -112.61 129.9 56.22 Favored 'General case' 0 C--O 1.238 0.477 0 C-N-CA 124.321 1.048 . . . . 0.0 108.791 172.462 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -126.29 154.74 74.66 Favored Pre-proline 0 C--N 1.326 -0.441 0 C-N-CA 126.4 1.88 . . . . 0.0 110.499 -171.53 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_endo -75.28 124.84 8.74 Favored 'Trans proline' 0 C--N 1.348 0.506 0 C-N-CA 122.927 2.418 . . . . 0.0 111.204 -178.299 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -85.97 14.59 5.92 Favored 'General case' 0 N--CA 1.467 0.411 0 N-CA-C 115.896 1.813 . . . . 0.0 115.896 -167.18 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 6.6 mp -82.35 -85.3 0.11 Allowed 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 108.817 -0.808 . . . . 0.0 108.817 -168.53 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 16.3 mt-10 -66.59 -45.75 78.22 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 118.289 0.495 . . . . 0.0 110.612 177.316 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 68.9 mt-30 48.58 36.22 7.24 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 123.77 0.828 . . . . 0.0 110.523 -166.327 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 1.4 t -169.18 49.02 0.04 OUTLIER 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 126.571 1.948 . . . . 0.0 107.815 -179.009 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -131.55 148.51 52.63 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 126.074 1.749 . . . . 0.0 110.584 -173.709 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -67.73 -47.51 69.09 Favored 'General case' 0 CA--C 1.529 0.137 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.973 174.497 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -125.08 -166.14 12.29 Favored Glycine 0 CA--C 1.522 0.478 0 C-N-CA 125.669 1.604 . . . . 0.0 110.228 -174.849 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -58.56 -59.22 5.73 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.028 0.931 . . . . 0.0 111.943 -175.897 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 99.5 mttt 49.53 -171.35 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 126.034 1.734 . . . . 0.0 112.009 -169.286 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 87.6 mt-10 -134.45 -176.76 4.32 Favored 'General case' 0 C--O 1.236 0.355 0 N-CA-C 107.438 -1.319 . . . . 0.0 107.438 172.626 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.52 -38.8 75.25 Favored 'General case' 0 CA--C 1.533 0.323 0 O-C-N 121.397 -0.814 . . . . 0.0 111.458 -178.44 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -153.48 -73.85 0.01 OUTLIER Glycine 0 N--CA 1.446 -0.692 0 N-CA-C 108.623 -1.791 . . . . 0.0 108.623 -179.716 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . 58.62 165.14 0.08 OUTLIER Pre-proline 0 CA--C 1.545 0.779 0 C-N-CA 127.193 2.197 . . . . 0.0 112.493 -171.886 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_endo -73.26 118.5 5.55 Favored 'Trans proline' 0 N--CA 1.458 -0.575 0 C-N-CA 121.48 1.453 . . . . 0.0 108.707 172.346 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 62.5 m 44.69 72.43 0.2 Allowed 'General case' 0 C--O 1.235 0.331 0 C-N-CA 125.23 1.412 . . . . 0.0 112.306 177.981 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 18.3 tptt -140.65 -12.57 1.0 Allowed 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 112.678 0.622 . . . . 0.0 112.678 176.377 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 3.0 pm0 -66.13 -4.56 7.69 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 124.196 0.999 . . . . 0.0 113.571 -178.011 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 95.29 -16.45 61.27 Favored Glycine 0 CA--C 1.531 1.062 0 O-C-N 120.373 -1.454 . . . . 0.0 112.894 -177.574 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 20.6 mmtp -77.86 5.28 9.93 Favored 'General case' 0 CA--C 1.531 0.24 0 O-C-N 120.699 -1.471 . . . . 0.0 110.255 158.076 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.491 ' HG3' ' H ' ' A' ' 85' ' ' LYS . 1.6 pt-20 -44.18 -57.32 3.5 Favored 'General case' 0 C--O 1.234 0.245 0 C-N-CA 127.745 2.418 . . . . 0.0 112.075 -160.518 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.491 ' H ' ' HG3' ' A' ' 84' ' ' GLU . 11.8 pttt -123.57 32.37 5.64 Favored 'General case' 0 N--CA 1.45 -0.425 0 C-N-CA 127.694 2.398 . . . . 0.0 109.319 -178.308 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 18.6 pttt 53.66 -163.04 0.11 Allowed 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 124.738 1.215 . . . . 0.0 112.156 -172.245 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 44.78 67.03 0.76 Allowed 'General case' 0 C--O 1.239 0.541 0 C-N-CA 128.045 2.538 . . . . 0.0 112.473 175.927 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 16.6 mtpt -65.87 132.22 48.13 Favored 'General case' 0 C--O 1.238 0.498 0 N-CA-C 108.273 -1.01 . . . . 0.0 108.273 166.823 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -145.56 -176.15 5.01 Favored 'General case' 0 C--N 1.323 -0.562 0 C-N-CA 126.016 1.726 . . . . 0.0 108.104 174.982 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 6.9 tttm -77.2 -167.17 0.84 Allowed 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 119.068 0.849 . . . . 0.0 110.931 -178.031 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 11.8 t -156.26 149.68 24.6 Favored 'General case' 0 C--O 1.238 0.459 0 N-CA-C 107.092 -1.447 . . . . 0.0 107.092 177.116 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 21.7 ttpt . . . . . 0 C--O 1.251 1.142 0 C-N-CA 125.913 1.685 . . . . 0.0 111.186 -176.721 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.603 0 N-CA-C 109.357 -1.497 . . . . 0.0 109.357 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 49.7 m-70 74.3 146.34 0.08 Allowed 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 127.676 2.39 . . . . 0.0 110.251 -176.942 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 77.2 mtp -149.79 -153.57 0.5 Allowed 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 123.538 0.735 . . . . 0.0 109.592 -170.334 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 20.0 pt20 -137.42 -178.04 5.05 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 129.093 2.957 . . . . 0.0 107.772 -176.365 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -78.01 -21.96 50.0 Favored 'General case' 0 CA--C 1.541 0.609 0 O-C-N 121.035 -1.041 . . . . 0.0 111.359 173.528 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.7 m 53.47 18.46 1.38 Allowed 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 124.346 1.058 . . . . 0.0 112.75 -161.225 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 45.6 t80 73.51 116.56 0.05 Allowed 'General case' 0 N--CA 1.446 -0.669 0 C-N-CA 129.797 3.239 . . . . 0.0 112.518 170.16 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 57.2 m -147.03 26.37 1.1 Allowed 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 115.296 -0.865 . . . . 0.0 113.089 -167.904 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 83.0 mt-30 -141.52 -178.48 5.65 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 125.371 1.468 . . . . 0.0 109.264 172.647 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 33.7 m-85 -131.21 166.05 30.66 Favored Pre-proline 0 CA--C 1.538 0.509 0 C-N-CA 127.066 2.146 . . . . 0.0 109.596 -175.489 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_endo -65.68 -171.4 0.21 Allowed 'Trans proline' 0 CA--C 1.537 0.646 0 C-N-CA 122.695 2.263 . . . . 0.0 110.339 164.031 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 61.7 t -104.92 87.29 1.79 Allowed Pre-proline 0 C--N 1.329 -0.304 0 N-CA-C 106.646 -1.612 . . . . 0.0 106.646 171.961 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.408 ' HD2' ' CZ2' ' A' ' 54' ' ' TRP . 96.8 Cg_endo -64.15 156.23 60.41 Favored 'Trans proline' 0 N--CA 1.451 -1.005 0 C-N-CA 122.226 1.951 . . . . 0.0 110.05 -177.547 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -135.12 129.29 33.67 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 123.898 0.879 . . . . 0.0 109.064 177.926 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 9.1 p -63.94 -26.44 40.56 Favored 'Isoleucine or valine' 0 C--O 1.234 0.266 0 C-N-CA 124.586 1.154 . . . . 0.0 111.531 178.758 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 41.5 m -69.6 1.77 3.82 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 119.908 1.231 . . . . 0.0 112.726 -178.103 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 7.0 t -125.9 11.0 7.7 Favored 'General case' 0 CA--C 1.545 0.777 0 O-C-N 120.899 -1.125 . . . . 0.0 111.773 169.757 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 15.0 m-30 -70.02 159.48 33.73 Favored 'General case' 0 C--O 1.24 0.581 0 O-C-N 120.525 -1.359 . . . . 0.0 111.694 172.346 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 54.6 mt-30 -82.59 135.07 35.16 Favored 'General case' 0 C--O 1.225 -0.234 0 N-CA-C 107.1 -1.444 . . . . 0.0 107.1 167.292 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 45.7 t80 -75.81 164.57 26.1 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 118.796 0.726 . . . . 0.0 109.145 160.246 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -143.04 108.82 5.13 Favored 'General case' 0 CA--C 1.51 -0.596 0 N-CA-C 108.868 -0.79 . . . . 0.0 108.868 159.696 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -59.72 -19.81 52.4 Favored 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 113.154 0.798 . . . . 0.0 113.154 174.628 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 1.4 t -55.29 -35.61 65.25 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 123.59 0.756 . . . . 0.0 110.694 -179.964 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 15.8 m -114.21 -28.06 7.42 Favored 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 125.147 1.379 . . . . 0.0 110.663 173.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 87.19 25.09 34.89 Favored Glycine 0 CA--C 1.528 0.898 0 N-CA-C 110.318 -1.113 . . . . 0.0 110.318 -173.432 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 6.7 m-85 -117.97 175.25 5.76 Favored 'General case' 0 C--O 1.232 0.176 0 C-N-CA 126.103 1.761 . . . . 0.0 107.776 -170.807 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -110.4 151.19 27.78 Favored 'General case' 0 CA--C 1.521 -0.157 0 N-CA-C 109.084 -0.71 . . . . 0.0 109.084 172.77 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 44.7 t80 -118.81 137.84 53.11 Favored 'General case' 0 N--CA 1.446 -0.633 0 C-N-CA 127.612 2.365 . . . . 0.0 107.79 179.761 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 37.3 t0 -106.95 86.22 2.29 Favored Pre-proline 0 C--N 1.33 -0.268 0 C-N-CA 126.129 1.772 . . . . 0.0 111.28 -175.612 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 22.9 Cg_endo -60.81 -14.25 31.13 Favored 'Trans proline' 0 CA--C 1.537 0.664 0 C-N-CA 121.903 1.735 . . . . 0.0 113.798 177.918 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 4.7 tt0 -67.81 -16.33 64.06 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 119.399 0.999 . . . . 0.0 111.276 176.731 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 40.1 p -131.48 -63.12 0.85 Allowed 'General case' 0 N--CA 1.447 -0.612 0 C-N-CA 125.271 1.428 . . . . 0.0 107.896 177.351 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 124.5 12.61 4.12 Favored Glycine 0 CA--C 1.531 1.05 0 C-N-CA 127.041 2.258 . . . . 0.0 112.025 -167.65 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 32.0 mt -87.22 175.59 7.97 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 126.119 1.768 . . . . 0.0 109.85 176.964 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 42.7 m-85 -117.42 167.41 11.29 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 125.097 1.359 . . . . 0.0 109.617 166.775 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 31.3 t80 -144.66 156.27 44.02 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 128.158 2.583 . . . . 0.0 108.345 -179.565 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 42.6 t0 -126.17 142.33 42.34 Favored Pre-proline 0 N--CA 1.473 0.722 0 N-CA-C 107.716 -1.216 . . . . 0.0 107.716 175.287 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 41.5 Cg_endo -73.15 -38.9 2.45 Favored 'Trans proline' 0 C--N 1.345 0.391 0 CA-C-N 120.952 1.376 . . . . 0.0 112.826 -176.15 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 30.5 m-20 -75.69 -25.66 56.91 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-O 118.533 -0.746 . . . . 0.0 111.383 -178.416 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 67.2 m -131.73 94.38 3.5 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 125.809 1.643 . . . . 0.0 109.434 -174.715 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 12.1 mp0 -59.43 -3.12 0.39 Allowed 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.974 1.31 . . . . 0.0 114.163 -178.119 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 68.4 m-85 -61.25 111.07 1.59 Allowed 'General case' 0 N--CA 1.446 -0.632 0 CA-C-N 119.189 0.904 . . . . 0.0 108.887 171.934 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 30.4 m-85 -62.1 153.63 29.38 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 123.519 0.727 . . . . 0.0 109.45 174.744 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 68.8 t80 -119.69 117.55 28.56 Favored 'General case' 0 N--CA 1.443 -0.811 0 CA-C-O 122.476 1.131 . . . . 0.0 108.802 -179.325 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 21.2 t30 -95.95 89.7 5.32 Favored 'General case' 0 N--CA 1.442 -0.863 0 C-N-CA 125.715 1.606 . . . . 0.0 107.354 175.252 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -48.1 -42.24 28.4 Favored 'General case' 0 CA--C 1.529 0.157 0 C-N-CA 124.838 1.255 . . . . 0.0 112.169 174.819 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -44.49 -48.64 10.11 Favored 'General case' 0 N--CA 1.448 -0.572 0 C-N-CA 126.213 1.805 . . . . 0.0 112.232 -175.621 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -118.43 12.78 13.39 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 125.207 1.403 . . . . 0.0 110.507 -177.052 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 31.2 mt-30 44.24 45.72 7.23 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 128.646 2.778 . . . . 0.0 112.755 -175.925 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -117.24 143.65 45.66 Favored 'General case' 0 N--CA 1.448 -0.557 0 C-N-CA 125.483 1.513 . . . . 0.0 110.233 -171.504 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.647 ' C ' HD23 ' A' ' 52' ' ' LEU . 58.3 m-85 -101.73 132.29 47.53 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 123.441 0.696 . . . . 0.0 111.704 176.432 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.647 HD23 ' C ' ' A' ' 51' ' ' TYR . 1.1 mt -135.87 -177.89 4.89 Favored 'General case' 0 C--N 1.323 -0.555 0 C-N-CA 126.779 2.031 . . . . 0.0 108.739 -165.414 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.474 ' CE2' HG23 ' A' ' 62' ' ' VAL . 25.7 p90 -135.02 164.76 26.91 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 124.179 0.992 . . . . 0.0 109.219 173.182 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' TRP . . . . . 0.408 ' CZ2' ' HD2' ' A' ' 13' ' ' PRO . 21.4 t-105 -109.23 137.82 46.53 Favored 'General case' 0 CA--C 1.504 -0.794 0 C-N-CA 125.955 1.702 . . . . 0.0 108.501 172.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 22.7 p-10 -133.56 77.29 1.71 Allowed 'General case' 0 N--CA 1.42 -1.958 0 C-N-CA 126.822 2.049 . . . . 0.0 107.208 -171.163 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -61.03 1.09 0.91 Allowed Glycine 0 CA--C 1.53 1.018 0 C-N-CA 125.025 1.298 . . . . 0.0 114.538 179.288 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 14.9 mt-10 -69.72 -63.32 1.1 Allowed 'General case' 0 N--CA 1.444 -0.754 0 N-CA-C 106.552 -1.647 . . . . 0.0 106.552 171.789 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 82.4 mtt180 -72.91 -23.15 60.67 Favored 'General case' 0 C--O 1.226 -0.146 0 C-N-CA 127.157 2.183 . . . . 0.0 111.323 173.929 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 52.9 mtt85 56.24 69.83 0.7 Allowed 'General case' 0 C--O 1.232 0.151 0 C-N-CA 126.295 1.838 . . . . 0.0 109.456 -162.861 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 6.8 t -144.24 -175.11 4.49 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 118.385 0.539 . . . . 0.0 110.194 170.165 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 91.3 m-85 -120.54 129.1 53.66 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 107.101 -1.444 . . . . 0.0 107.101 164.351 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.474 HG23 ' CE2' ' A' ' 53' ' ' TYR . 0.0 OUTLIER -126.22 154.92 74.49 Favored Pre-proline 0 C--N 1.325 -0.458 0 C-N-CA 125.95 1.7 . . . . 0.0 113.068 -175.763 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.585 ' HA ' HD22 ' A' ' 52' ' ' LEU . 71.5 Cg_endo -80.42 132.15 8.91 Favored 'Trans proline' 0 N--CA 1.443 -1.467 0 C-N-CA 121.355 1.37 . . . . 0.0 112.36 -171.907 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -79.13 48.59 0.87 Allowed 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.832 0.853 . . . . 0.0 113.118 -172.704 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 62.4 mt -69.79 -50.66 40.85 Favored 'General case' 0 C--O 1.226 -0.147 0 C-N-CA 124.488 1.115 . . . . 0.0 110.677 -173.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -137.11 -56.54 0.71 Allowed 'General case' 0 C--N 1.333 -0.142 0 C-N-CA 124.766 1.226 . . . . 0.0 108.943 -177.152 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER 65.16 93.74 0.06 Allowed 'General case' 0 CA--C 1.529 0.171 0 C-N-CA 126.208 1.803 . . . . 0.0 108.691 179.886 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 58.7 m -155.33 109.35 2.87 Favored 'General case' 0 C--O 1.236 0.351 0 O-C-N 120.74 -1.225 . . . . 0.0 108.172 -173.266 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 47.38 -157.28 0.05 OUTLIER 'General case' 0 C--O 1.236 0.393 0 C-N-CA 125.278 1.431 . . . . 0.0 111.029 -169.809 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -157.76 -176.72 6.09 Favored 'General case' 0 C--O 1.238 0.497 0 N-CA-C 108.103 -1.073 . . . . 0.0 108.103 179.008 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -172.5 -171.39 37.3 Favored Glycine 0 CA--C 1.524 0.649 0 O-C-N 120.738 -1.226 . . . . 0.0 110.326 173.405 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 11.1 m80 -65.28 -19.82 66.13 Favored 'General case' 0 CA--C 1.542 0.647 0 O-C-N 121.924 -0.751 . . . . 0.0 111.792 162.754 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 19.6 pttp -93.67 -177.74 4.48 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 124.338 1.055 . . . . 0.0 111.089 -179.444 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 21.7 mt-10 -122.9 -178.1 3.85 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 125.116 1.367 . . . . 0.0 108.797 166.044 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -64.46 -31.73 73.07 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 125.791 1.636 . . . . 0.0 112.493 179.427 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -162.23 81.32 0.13 Allowed Glycine 0 CA--C 1.525 0.688 0 C-N-CA 124.69 1.138 . . . . 0.0 110.406 -172.536 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -143.49 85.94 9.16 Favored Pre-proline 0 CA--C 1.545 0.757 0 C-N-CA 125.184 1.394 . . . . 0.0 109.438 177.337 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -78.54 82.66 2.42 Favored 'Trans proline' 0 CA--C 1.549 1.27 0 C-N-CA 124.172 3.248 . . . . 0.0 114.281 -174.806 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 35.0 m 65.03 91.75 0.08 Allowed 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 124.646 1.179 . . . . 0.0 110.979 170.142 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 16.5 mmtt -129.7 -27.42 2.35 Favored 'General case' 0 CA--C 1.52 -0.209 0 CA-C-O 117.673 -1.156 . . . . 0.0 113.743 174.454 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -170.12 -13.47 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.948 0 N-CA-C 116.262 1.949 . . . . 0.0 116.262 -162.131 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -132.67 -80.69 0.18 Allowed Glycine 0 C--N 1.334 0.431 0 N-CA-C 108.444 -1.862 . . . . 0.0 108.444 -178.854 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 15.1 ptpt -60.58 -10.48 5.2 Favored 'General case' 0 N--CA 1.465 0.277 0 N-CA-C 113.585 0.957 . . . . 0.0 113.585 175.586 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -56.93 -29.31 63.0 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 119.488 1.04 . . . . 0.0 111.844 -175.648 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 3.1 mmpt? -126.42 23.37 6.92 Favored 'General case' 0 N--CA 1.463 0.193 0 C-N-CA 125.896 1.679 . . . . 0.0 110.158 178.673 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 52.9 mtpt 51.31 38.33 21.22 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 124.452 1.101 . . . . 0.0 111.18 -175.829 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 53.87 39.02 29.93 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 125.364 1.466 . . . . 0.0 112.509 174.104 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 4.4 mttp -53.24 -70.09 0.1 Allowed 'General case' 0 C--N 1.34 0.152 0 C-N-CA 125.207 1.403 . . . . 0.0 111.319 177.517 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 58.3 t-80 -155.96 160.11 39.8 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 124.399 1.08 . . . . 0.0 108.775 -179.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 7.4 mtmp? -138.95 143.14 38.45 Favored 'General case' 0 C--O 1.232 0.156 0 C-N-CA 125.76 1.624 . . . . 0.0 106.716 174.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 10.1 m -129.45 69.56 1.42 Allowed 'General case' 0 C--O 1.235 0.341 0 C-N-CA 123.839 0.856 . . . . 0.0 109.503 -172.204 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 43.3 mttt . . . . . 0 C--O 1.244 0.786 0 C-N-CA 126.001 1.72 . . . . 0.0 111.332 -168.194 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.463 0.47 0 N-CA-C 110.644 -0.982 . . . . 0.0 110.644 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 19.8 m170 -130.85 167.22 19.29 Favored 'General case' 0 C--O 1.238 0.472 0 C-N-CA 124.437 1.095 . . . . 0.0 108.116 167.263 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . 0.418 ' HG3' ' H ' ' A' ' 4' ' ' GLN . 16.5 tpp -132.95 -173.39 3.18 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 125.777 1.631 . . . . 0.0 108.063 175.062 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.418 ' H ' ' HG3' ' A' ' 3' ' ' MET . 0.0 OUTLIER -121.86 122.41 39.38 Favored 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 124.465 1.106 . . . . 0.0 109.379 -170.195 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -90.7 -19.06 24.0 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 123.671 0.788 . . . . 0.0 111.318 175.24 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 18.7 m 47.34 56.3 7.12 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.708 1.203 . . . . 0.0 110.783 -177.181 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -132.7 -178.87 5.14 Favored 'General case' 0 C--O 1.233 0.23 0 C-N-CA 125.758 1.623 . . . . 0.0 109.744 -171.695 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 74.75 95.68 0.07 Allowed 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 125.933 1.693 . . . . 0.0 108.39 178.826 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 19.5 mt-30 -59.65 -25.89 65.08 Favored 'General case' 0 CA--C 1.538 0.487 0 O-C-N 121.87 -0.519 . . . . 0.0 111.638 171.583 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 61.2 m-85 -139.64 164.83 35.6 Favored Pre-proline 0 C--O 1.241 0.637 0 C-N-CA 126.332 1.853 . . . . 0.0 109.371 176.924 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 68.2 Cg_endo -67.67 -175.33 0.71 Allowed 'Trans proline' 0 CA--C 1.538 0.687 0 C-N-CA 123.661 2.908 . . . . 0.0 109.874 161.134 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 18.6 t -116.55 86.09 17.8 Favored Pre-proline 0 CA--C 1.541 0.607 0 C-N-CA 125.222 1.409 . . . . 0.0 107.813 -173.994 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo -73.17 174.87 11.34 Favored 'Trans proline' 0 C--N 1.347 0.456 0 C-N-CA 124.72 3.613 . . . . 0.0 111.667 -177.723 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -142.79 131.95 23.22 Favored 'General case' 0 N--CA 1.445 -0.692 0 C-N-CA 125.935 1.694 . . . . 0.0 110.881 -175.194 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 7.1 p -63.81 -26.39 40.5 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.423 0 O-C-N 121.061 -1.025 . . . . 0.0 112.558 179.549 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 93.1 p -71.64 0.67 8.14 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 120.06 1.3 . . . . 0.0 113.568 178.846 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 32.1 p -111.32 1.79 17.29 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.475 1.11 . . . . 0.0 112.02 172.076 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 11.0 m-30 -69.46 172.46 7.19 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.647 1.179 . . . . 0.0 111.88 -178.808 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 2.8 mm100 -116.11 101.88 9.12 Favored 'General case' 0 N--CA 1.478 0.926 0 N-CA-C 114.663 1.357 . . . . 0.0 114.663 179.03 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 55.1 t80 -63.68 147.84 50.57 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 118.426 0.557 . . . . 0.0 111.621 -175.637 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 8.4 t0 -124.82 84.42 2.28 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 123.289 0.636 . . . . 0.0 109.769 176.809 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.75 -19.48 50.49 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 115.152 1.538 . . . . 0.0 115.152 -172.351 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 5.9 t -49.16 -46.93 46.0 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-O 118.346 -0.835 . . . . 0.0 110.313 166.264 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 64.8 m -130.07 -8.16 4.36 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 114.203 1.186 . . . . 0.0 114.203 -171.625 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 96.87 14.57 42.56 Favored Glycine 0 CA--C 1.526 0.771 0 CA-C-N 119.081 0.855 . . . . 0.0 114.221 155.707 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 16.9 m-85 -110.49 171.69 7.31 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 118.287 1.044 . . . . 0.0 109.027 -176.967 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 35.0 m-85 -113.03 121.81 45.72 Favored 'General case' 0 CA--C 1.529 0.142 0 C-N-CA 124.644 1.177 . . . . 0.0 108.624 -175.353 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 71.9 t80 -91.26 138.45 31.58 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 124.475 1.11 . . . . 0.0 110.694 -177.467 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 32.3 t0 -98.78 86.81 0.53 Allowed Pre-proline 0 N--CA 1.472 0.645 0 C-N-CA 126.233 1.813 . . . . 0.0 111.992 179.497 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_endo -60.9 -11.84 19.74 Favored 'Trans proline' 0 N--CA 1.459 -0.541 0 C-N-CA 122.415 2.077 . . . . 0.0 114.196 178.218 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -63.86 -29.52 70.7 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 119.743 1.156 . . . . 0.0 110.0 173.928 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 38.4 p -133.98 -42.42 0.82 Allowed 'General case' 0 C--O 1.235 0.301 0 CA-C-N 118.867 0.758 . . . . 0.0 112.833 -174.102 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 113.78 19.35 6.52 Favored Glycine 0 CA--C 1.534 1.228 0 C-N-CA 125.605 1.574 . . . . 0.0 112.322 -179.533 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 22.5 mt -93.11 176.21 6.5 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 126.466 1.906 . . . . 0.0 109.306 178.989 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 55.6 m-85 -121.96 165.36 16.09 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 124.678 1.191 . . . . 0.0 110.603 172.936 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 77.0 t80 -147.93 160.06 43.2 Favored 'General case' 0 C--O 1.239 0.534 0 C-N-CA 129.112 2.965 . . . . 0.0 108.475 -175.897 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.4 ' HB3' ' HB2' ' A' ' 40' ' ' SER . 8.8 t0 -129.35 143.74 50.07 Favored Pre-proline 0 CA--C 1.537 0.469 0 N-CA-C 107.358 -1.349 . . . . 0.0 107.358 178.712 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_endo -63.72 -42.68 19.35 Favored 'Trans proline' 0 CA--C 1.537 0.633 0 C-N-CA 122.457 2.105 . . . . 0.0 113.262 -179.842 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 88.4 m-20 -75.07 -43.06 55.35 Favored 'General case' 0 N--CA 1.446 -0.647 0 C-N-CA 124.565 1.146 . . . . 0.0 109.596 176.041 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . 0.4 ' HB2' ' HB3' ' A' ' 37' ' ' ASP . 14.9 m -103.92 97.89 7.81 Favored 'General case' 0 N--CA 1.456 -0.132 0 C-N-CA 123.727 0.811 . . . . 0.0 109.11 -171.177 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 7.4 mp0 -58.83 -15.61 13.3 Favored 'General case' 0 CA--C 1.541 0.621 0 O-C-N 121.78 -0.575 . . . . 0.0 111.135 173.526 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 32.1 m-85 -61.5 105.44 0.52 Allowed 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 125.94 1.696 . . . . 0.0 109.7 170.163 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 27.1 m-85 -67.99 168.36 12.01 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 124.692 1.197 . . . . 0.0 110.52 175.078 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 75.7 t80 -123.48 121.22 35.13 Favored 'General case' 0 N--CA 1.446 -0.649 0 C-N-CA 125.422 1.489 . . . . 0.0 109.559 176.183 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 28.1 t30 -86.18 88.38 7.59 Favored 'General case' 0 N--CA 1.443 -0.784 0 C-N-CA 127.875 2.47 . . . . 0.0 108.744 173.147 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -52.09 -36.39 50.7 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.498 0.719 . . . . 0.0 111.825 175.524 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -48.01 -57.09 6.22 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 126.393 1.877 . . . . 0.0 112.172 -178.257 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -111.23 18.48 19.27 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 125.037 1.335 . . . . 0.0 111.603 179.317 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 3.0 mt-30 48.4 34.0 4.37 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 125.579 1.551 . . . . 0.0 112.606 -176.516 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -105.76 174.56 5.83 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 126.714 2.006 . . . . 0.0 110.975 -174.02 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 5.6 m-85 -114.44 146.47 40.59 Favored 'General case' 0 C--N 1.332 -0.153 0 N-CA-C 108.387 -0.968 . . . . 0.0 108.387 179.601 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.473 HD23 ' HA ' ' A' ' 63' ' ' PRO . 85.2 mt -137.82 174.76 10.24 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.966 1.306 . . . . 0.0 108.874 -175.503 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 8.7 p90 -139.46 142.96 37.35 Favored 'General case' 0 C--O 1.239 0.543 0 C-N-CA 125.687 1.595 . . . . 0.0 107.917 165.948 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 41.8 t-105 -85.12 100.86 12.0 Favored 'General case' 0 N--CA 1.449 -0.524 0 N-CA-C 105.543 -2.021 . . . . 0.0 105.543 176.907 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 51.4 t0 -88.53 87.08 7.15 Favored 'General case' 0 N--CA 1.447 -0.615 0 N-CA-C 107.61 -1.255 . . . . 0.0 107.61 -178.47 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -58.55 -17.3 32.89 Favored Glycine 0 CA--C 1.53 1.02 0 CA-C-O 118.299 -1.278 . . . . 0.0 112.345 177.599 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 17.6 mt-10 -69.7 -22.27 63.43 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 120.021 1.911 . . . . 0.0 111.282 174.47 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 8.8 mtt180 -120.16 -2.71 10.13 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 125.173 1.389 . . . . 0.0 111.359 -179.516 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 2.1 mpt_? 44.55 56.15 5.29 Favored 'General case' 0 C--O 1.234 0.252 0 C-N-CA 126.664 1.986 . . . . 0.0 110.278 -173.54 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 5.0 t -148.89 153.46 38.06 Favored 'General case' 0 N--CA 1.448 -0.53 0 N-CA-C 108.851 -0.796 . . . . 0.0 108.851 176.513 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 80.3 m-85 -93.08 115.74 28.39 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 106.186 -1.783 . . . . 0.0 106.186 175.641 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -125.26 154.92 71.99 Favored Pre-proline 0 C--N 1.326 -0.425 0 C-N-CA 125.667 1.587 . . . . 0.0 110.274 -171.462 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.473 ' HA ' HD23 ' A' ' 52' ' ' LEU . 56.4 Cg_endo -68.32 130.32 20.96 Favored 'Trans proline' 0 N--CA 1.455 -0.782 0 C-N-CA 122.36 2.04 . . . . 0.0 110.464 -179.032 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -96.47 14.32 24.95 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-O 121.993 0.901 . . . . 0.0 112.764 177.916 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 7.0 mp -68.31 123.9 22.02 Favored 'General case' 0 N--CA 1.437 -1.115 0 N-CA-C 106.688 -1.597 . . . . 0.0 106.688 170.083 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 73.3 tt0 73.39 -60.53 0.53 Allowed 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 126.508 1.923 . . . . 0.0 113.828 163.518 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 14.4 pt20 44.93 34.33 1.21 Allowed 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 127.309 2.244 . . . . 0.0 114.442 178.84 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 5.5 m 75.27 -12.71 0.93 Allowed 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 127.553 2.341 . . . . 0.0 115.55 173.708 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -81.47 95.25 7.03 Favored 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 125.011 1.325 . . . . 0.0 110.58 -174.966 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 27.5 t0 71.95 -37.29 0.39 Allowed 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 128.434 2.694 . . . . 0.0 114.37 165.873 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 166.11 -176.6 41.41 Favored Glycine 0 N--CA 1.447 -0.584 0 N-CA-C 109.818 -1.313 . . . . 0.0 109.818 167.534 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . 0.447 ' CD2' ' H ' ' A' ' 72' ' ' HIS . 2.4 p80 -77.67 -29.28 51.44 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 112.534 0.568 . . . . 0.0 112.534 175.852 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 67.8 mmtt 58.68 -154.85 0.36 Allowed 'General case' 0 C--O 1.237 0.424 0 C-N-CA 123.559 0.744 . . . . 0.0 110.307 177.866 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -64.35 161.59 16.58 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 109.704 -0.48 . . . . 0.0 109.704 167.322 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -54.42 -1.37 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 130.909 3.683 . . . . 0.0 115.499 -178.487 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -135.66 -86.94 0.23 Allowed Glycine 0 N--CA 1.439 -1.162 0 N-CA-C 106.545 -2.622 . . . . 0.0 106.545 -173.602 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . 44.59 71.13 1.6 Allowed Pre-proline 0 CA--C 1.546 0.809 0 C-N-CA 127.096 2.158 . . . . 0.0 113.156 170.531 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_endo -68.97 -17.36 41.19 Favored 'Trans proline' 0 CA--C 1.536 0.583 0 C-N-CA 124.121 3.214 . . . . 0.0 116.693 -158.548 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 1.6 p 44.86 21.19 0.04 OUTLIER 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 129.197 2.999 . . . . 0.0 117.685 173.836 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 7.9 mtpm? -137.15 23.47 3.01 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 124.712 1.205 . . . . 0.0 110.557 179.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -153.3 29.38 0.49 Allowed 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 112.642 0.608 . . . . 0.0 112.642 178.019 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 163.02 -85.23 0.11 Allowed Glycine 0 C--N 1.335 0.512 0 O-C-N 120.524 -1.36 . . . . 0.0 111.567 173.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 15.8 tttt -92.17 56.41 2.82 Favored 'General case' 0 N--CA 1.455 -0.202 0 CA-C-O 123.284 1.516 . . . . 0.0 108.177 -173.796 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.435 ' HG3' ' H ' ' A' ' 85' ' ' LYS . 7.0 pt-20 -56.96 -53.86 53.27 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 126.078 1.751 . . . . 0.0 110.011 174.25 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.435 ' H ' ' HG3' ' A' ' 84' ' ' GLU . 52.6 pttt -158.12 26.98 0.26 Allowed 'General case' 0 C--O 1.238 0.478 0 C-N-CA 128.669 2.788 . . . . 0.0 109.546 179.565 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.441 ' HA ' ' HE2' ' A' ' 86' ' ' LYS . 7.3 mmpt? -83.94 99.06 10.14 Favored 'General case' 0 C--O 1.231 0.111 0 N-CA-C 107.635 -1.246 . . . . 0.0 107.635 -174.477 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -146.93 -33.35 0.29 Allowed 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 123.983 0.913 . . . . 0.0 111.879 -170.699 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 4.1 mptt -125.41 -174.22 3.01 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 125.116 1.366 . . . . 0.0 110.655 179.571 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 12.4 m80 55.12 98.35 0.02 OUTLIER 'General case' 0 C--O 1.239 0.51 0 C-N-CA 126.633 1.973 . . . . 0.0 113.113 -175.705 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.45 107.08 5.33 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 125.06 1.344 . . . . 0.0 108.638 175.937 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 17.3 m 52.48 69.13 0.72 Allowed 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 125.374 1.469 . . . . 0.0 111.14 178.031 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 1.4 mppt? . . . . . 0 C--O 1.247 0.953 0 N-CA-C 104.454 -2.424 . . . . 0.0 104.454 -127.159 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.113 0 N-CA-C 110.027 -1.229 . . . . 0.0 110.027 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 8.6 t-80 46.9 39.13 6.99 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 125.039 1.336 . . . . 0.0 112.008 -176.525 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 5.3 mpp? 60.3 4.94 0.74 Allowed 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 126.18 1.792 . . . . 0.0 115.075 -178.635 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 12.6 tt0 -47.63 112.7 0.58 Allowed 'General case' 0 C--O 1.236 0.354 0 C-N-CA 126.113 1.765 . . . . 0.0 112.116 -169.431 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 16.4 pt-20 -72.53 -14.85 61.74 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 125.337 1.455 . . . . 0.0 113.295 -177.036 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 67.5 m 53.34 45.59 28.12 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.429 1.092 . . . . 0.0 112.045 176.875 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 20.5 p90 -76.17 -9.41 58.6 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 124.399 1.079 . . . . 0.0 113.545 -174.016 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 44.7 m -77.07 99.02 5.19 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 127.197 2.199 . . . . 0.0 111.856 -169.918 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER 58.88 -60.97 0.04 OUTLIER 'General case' 0 C--O 1.237 0.419 0 C-N-CA 129.88 3.272 . . . . 0.0 114.222 -177.303 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 58.5 m-85 -131.23 154.94 82.1 Favored Pre-proline 0 C--O 1.235 0.329 0 C-N-CA 124.083 0.953 . . . . 0.0 109.542 171.453 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -61.04 169.69 5.73 Favored 'Trans proline' 0 N--CA 1.453 -0.873 0 C-N-CA 121.823 1.682 . . . . 0.0 109.846 161.94 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 59.7 t -104.67 86.69 1.51 Allowed Pre-proline 0 C--O 1.241 0.615 0 N-CA-C 107.073 -1.454 . . . . 0.0 107.073 -173.028 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 69.0 Cg_endo -66.79 169.18 15.13 Favored 'Trans proline' 0 CA--C 1.534 0.48 0 C-N-CA 123.856 3.037 . . . . 0.0 111.525 -168.929 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -146.43 123.15 11.21 Favored 'General case' 0 C--O 1.232 0.164 0 O-C-N 121.535 -0.728 . . . . 0.0 111.057 -175.948 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 13.3 p -58.61 -20.84 17.24 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.671 0 C-N-CA 124.679 1.192 . . . . 0.0 112.695 -178.052 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 38.7 p -64.66 -13.7 55.13 Favored 'General case' 0 N--CA 1.434 -1.229 0 O-C-N 119.856 -1.777 . . . . 0.0 113.705 179.24 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 12.7 t -119.87 8.42 11.1 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 125.185 1.394 . . . . 0.0 110.75 176.669 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 12.9 m-30 -74.68 155.78 37.38 Favored 'General case' 0 C--O 1.238 0.467 0 O-C-N 120.977 -1.077 . . . . 0.0 110.524 170.68 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 25.5 mt-30 -93.47 150.79 20.17 Favored 'General case' 0 C--O 1.224 -0.26 0 CA-C-N 114.915 -1.039 . . . . 0.0 109.79 171.457 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.423 ' CZ ' ' HA2' ' A' ' 25' ' ' GLY . 70.2 t80 -96.46 152.81 18.26 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 124.567 1.147 . . . . 0.0 109.975 167.469 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -132.66 97.28 4.02 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 124.134 0.974 . . . . 0.0 109.415 173.872 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.418 ' HG2' ' H ' ' A' ' 22' ' ' GLU . 1.3 pt-20 -62.22 -20.2 63.95 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 125.307 1.443 . . . . 0.0 113.861 -172.403 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 15.1 t -56.74 -24.8 52.39 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 123.495 0.718 . . . . 0.0 111.617 171.38 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 66.2 m -133.14 -19.92 2.19 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.834 1.254 . . . . 0.0 112.775 179.522 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . 0.423 ' HA2' ' CZ ' ' A' ' 20' ' ' TYR . . . 62.77 25.37 67.49 Favored Glycine 0 CA--C 1.531 1.073 0 O-C-N 121.016 -1.052 . . . . 0.0 112.682 -175.516 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 17.8 m-85 -87.98 170.57 11.01 Favored 'General case' 0 C--O 1.238 0.482 0 N-CA-C 107.419 -1.326 . . . . 0.0 107.419 160.966 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 76.9 m-85 -107.04 152.45 23.99 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 124.316 1.046 . . . . 0.0 108.741 166.782 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 46.6 t80 -111.21 137.63 48.67 Favored 'General case' 0 N--CA 1.447 -0.623 0 C-N-CA 126.933 2.093 . . . . 0.0 108.315 179.162 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 6.2 t0 -96.02 86.7 0.37 Allowed Pre-proline 0 CA--C 1.532 0.267 0 C-N-CA 128.609 2.763 . . . . 0.0 107.048 177.335 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -66.91 -10.27 27.8 Favored 'Trans proline' 0 C--N 1.347 0.485 0 C-N-CA 122.424 2.083 . . . . 0.0 111.983 175.982 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 10.0 tt0 -70.1 -18.54 63.25 Favored 'General case' 0 N--CA 1.447 -0.599 0 C-N-CA 124.578 1.151 . . . . 0.0 110.523 -179.151 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 37.0 p -145.57 -53.29 0.27 Allowed 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 126.165 1.786 . . . . 0.0 111.106 178.438 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 135.1 12.23 1.3 Allowed Glycine 0 CA--C 1.531 1.08 0 C-N-CA 126.329 1.919 . . . . 0.0 113.851 178.727 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 10.7 mt -81.1 177.19 9.2 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 118.92 1.36 . . . . 0.0 110.339 178.332 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 59.5 m-85 -121.95 167.52 12.97 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.275 1.03 . . . . 0.0 110.196 168.915 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 33.9 t80 -149.65 139.73 22.08 Favored 'General case' 0 C--O 1.235 0.317 0 C-N-CA 127.518 2.327 . . . . 0.0 107.835 -172.63 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -99.29 143.25 26.06 Favored Pre-proline 0 CA--C 1.538 0.506 0 N-CA-C 106.951 -1.5 . . . . 0.0 106.951 -178.389 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -66.48 -38.43 19.6 Favored 'Trans proline' 0 C--O 1.236 0.417 0 C-N-CA 121.423 1.415 . . . . 0.0 113.735 -178.841 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 11.2 m-80 -99.78 -14.26 18.91 Favored 'General case' 0 CA--C 1.518 -0.264 0 N-CA-C 113.31 0.855 . . . . 0.0 113.31 -172.414 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 24.2 m -127.93 103.33 7.19 Favored 'General case' 0 C--N 1.32 -0.689 0 C-N-CA 125.954 1.702 . . . . 0.0 107.659 178.161 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -65.62 -1.51 2.75 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 123.56 0.744 . . . . 0.0 112.344 -176.832 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 42.1 m-85 -60.98 120.75 10.82 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 119.414 1.007 . . . . 0.0 108.435 164.769 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 32.5 m-85 -74.1 164.36 26.71 Favored 'General case' 0 N--CA 1.442 -0.838 0 C-N-CA 124.482 1.113 . . . . 0.0 109.355 173.611 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 94.4 t80 -119.44 139.52 51.91 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 125.474 1.509 . . . . 0.0 108.674 173.027 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 18.7 t30 -121.17 79.97 1.59 Allowed 'General case' 0 N--CA 1.444 -0.745 0 C-N-CA 128.169 2.588 . . . . 0.0 106.179 -171.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -52.15 -33.07 38.63 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 123.629 0.772 . . . . 0.0 111.621 179.97 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -46.19 -38.04 7.83 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 127.369 2.268 . . . . 0.0 113.012 177.097 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.3 m -129.05 13.12 6.22 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 125.141 1.376 . . . . 0.0 110.488 179.127 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 52.4 mt-30 44.02 35.25 1.11 Allowed 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 128.859 2.864 . . . . 0.0 113.7 -169.003 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -108.08 -179.83 4.01 Favored 'General case' 0 N--CA 1.448 -0.54 0 C-N-CA 124.839 1.256 . . . . 0.0 112.145 -176.227 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 55.4 m-85 -123.28 139.7 53.78 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 124.723 1.209 . . . . 0.0 109.221 -178.08 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.412 HD23 ' HA ' ' A' ' 63' ' ' PRO . 64.9 mt -130.97 167.25 19.34 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.865 1.266 . . . . 0.0 107.838 -174.28 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 13.6 p90 -126.05 149.85 48.56 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 107.437 -1.319 . . . . 0.0 107.437 165.835 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 62.9 t-105 -88.03 152.92 21.68 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 106.212 -1.774 . . . . 0.0 106.212 166.805 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 49.0 t0 -145.58 155.25 42.93 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 107.595 -1.261 . . . . 0.0 107.595 166.553 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -100.84 -7.93 49.51 Favored Glycine 0 CA--C 1.526 0.758 0 CA-C-O 118.883 -0.954 . . . . 0.0 112.322 177.95 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 75.6 mt-10 -74.11 -44.29 54.42 Favored 'General case' 0 C--N 1.341 0.201 0 CA-C-N 119.664 1.732 . . . . 0.0 107.824 177.251 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 81.3 mtt180 -102.05 -5.21 24.82 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-O 117.703 -1.142 . . . . 0.0 112.499 -178.499 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 60.6 mtt85 43.95 57.89 3.91 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 126.997 2.119 . . . . 0.0 111.941 177.684 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . 0.484 HG23 HG13 ' A' ' 62' ' ' VAL . 10.0 t -151.05 156.44 41.11 Favored 'General case' 0 N--CA 1.442 -0.835 0 N-CA-C 107.848 -1.167 . . . . 0.0 107.848 177.174 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 31.3 m-85 -75.27 128.25 35.0 Favored 'General case' 0 C--O 1.238 0.479 0 N-CA-C 106.616 -1.624 . . . . 0.0 106.616 154.499 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.484 HG13 HG23 ' A' ' 60' ' ' THR . 0.0 OUTLIER -126.04 154.46 73.99 Favored Pre-proline 0 C--N 1.325 -0.481 0 C-N-CA 126.81 2.044 . . . . 0.0 111.429 -178.697 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.412 ' HA ' HD23 ' A' ' 52' ' ' LEU . 54.4 Cg_endo -71.78 122.68 8.74 Favored 'Trans proline' 0 N--CA 1.456 -0.686 0 C-N-CA 122.87 2.38 . . . . 0.0 111.782 -176.17 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -91.02 14.54 13.67 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 115.144 1.535 . . . . 0.0 115.144 -174.691 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -79.76 -61.4 2.01 Favored 'General case' 0 N--CA 1.44 -0.954 0 N-CA-C 108.774 -0.824 . . . . 0.0 108.774 -173.54 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.8 mp0 -83.35 -57.62 3.18 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 123.531 0.732 . . . . 0.0 110.406 -177.585 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 19.0 mt-30 59.53 177.08 0.08 Allowed 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 127.572 2.349 . . . . 0.0 112.804 -178.253 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 72.0 m 44.98 57.68 4.51 Favored 'General case' 0 C--O 1.238 0.478 0 C-N-CA 125.597 1.559 . . . . 0.0 112.257 -176.789 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -68.62 98.28 0.87 Allowed 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 124.572 1.149 . . . . 0.0 110.641 -175.996 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -139.48 -44.15 0.45 Allowed 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 123.806 0.843 . . . . 0.0 113.142 -175.919 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -83.82 158.27 34.96 Favored Glycine 0 CA--C 1.524 0.641 0 N-CA-C 108.906 -1.678 . . . . 0.0 108.906 171.449 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 2.2 t-80 -73.75 90.79 1.87 Allowed 'General case' 0 CA--C 1.537 0.442 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 -178.658 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 65.3 mttp -136.04 161.92 34.35 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 124.436 1.094 . . . . 0.0 110.86 -172.689 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -127.36 164.64 21.37 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 125.259 1.423 . . . . 0.0 110.008 -179.725 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 7.1 m -52.79 -29.47 27.62 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 126.515 1.926 . . . . 0.0 112.975 178.454 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -67.91 -21.09 73.14 Favored Glycine 0 CA--C 1.53 1.004 0 CA-C-O 119.165 -0.797 . . . . 0.0 111.539 -178.151 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . 44.18 68.5 3.07 Favored Pre-proline 0 CA--C 1.536 0.418 0 C-N-CA 127.077 2.151 . . . . 0.0 111.965 -178.657 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -67.27 163.36 34.67 Favored 'Trans proline' 0 N--CA 1.455 -0.784 0 C-N-CA 123.144 2.562 . . . . 0.0 111.249 -179.529 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 3.7 m -139.06 48.05 1.89 Allowed 'General case' 0 C--O 1.235 0.333 0 C-N-CA 125.594 1.557 . . . . 0.0 108.661 179.057 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 15.3 pttm -128.3 -10.12 5.23 Favored 'General case' 0 N--CA 1.463 0.218 0 C-N-CA 123.603 0.761 . . . . 0.0 113.014 174.813 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -158.0 51.08 0.43 Allowed 'General case' 0 C--O 1.237 0.396 0 CA-C-O 122.67 1.224 . . . . 0.0 107.87 -164.832 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 160.27 -113.99 0.59 Allowed Glycine 0 N--CA 1.447 -0.588 0 N-CA-C 107.216 -2.353 . . . . 0.0 107.216 -170.146 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.64 32.16 0.3 Allowed 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 125.609 1.564 . . . . 0.0 112.623 -171.058 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 2.2 pp20? -44.48 -55.69 4.87 Favored 'General case' 0 C--O 1.241 0.649 0 C-N-CA 126.364 1.866 . . . . 0.0 111.553 -176.96 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.01 26.43 8.74 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 125.265 1.426 . . . . 0.0 110.844 -179.966 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 68.9 mmtt 57.02 37.99 29.05 Favored 'General case' 0 N--CA 1.468 0.425 0 C-N-CA 123.981 0.913 . . . . 0.0 110.5 -176.363 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 63.07 10.95 4.83 Favored 'General case' 0 C--O 1.234 0.273 0 C-N-CA 125.247 1.419 . . . . 0.0 112.929 174.216 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 44.4 mtpt -73.32 -17.31 61.32 Favored 'General case' 0 C--O 1.224 -0.241 0 CA-C-O 117.297 -1.335 . . . . 0.0 112.053 -172.707 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 68.5 m80 46.01 89.49 0.02 OUTLIER 'General case' 0 C--N 1.343 0.304 0 C-N-CA 126.905 2.082 . . . . 0.0 110.657 -177.608 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . 0.289 21.1 pttp 52.36 -162.49 0.09 Allowed 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 122.54 0.336 . . . . 0.0 110.167 -168.927 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -133.97 159.52 40.48 Favored 'General case' 0 C--O 1.236 0.379 0 N-CA-C 107.128 -1.434 . . . . 0.0 107.128 155.269 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 1.3 tttp . . . . . 0 C--O 1.252 1.21 0 CA-C-O 117.467 -1.254 . . . . 0.0 107.833 -156.434 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 1.305 0 N-CA-C 108.561 -1.816 . . . . 0.0 108.561 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 11.9 p80 -73.54 155.11 39.5 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 124.387 1.075 . . . . 0.0 110.448 -175.346 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -169.59 -51.19 0.02 OUTLIER 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 124.676 1.19 . . . . 0.0 109.737 168.389 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 10.3 tt0 -76.86 143.03 39.96 Favored 'General case' 0 C--O 1.234 0.286 0 N-CA-C 107.657 -1.238 . . . . 0.0 107.657 166.151 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 25.3 tt0 -84.49 -61.42 1.8 Allowed 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 122.765 0.426 . . . . 0.0 110.069 -177.877 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 27.5 t 45.12 72.69 0.19 Allowed 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 125.861 1.664 . . . . 0.0 110.496 -171.976 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 1.4 m-85 -138.73 144.72 39.63 Favored 'General case' 0 N--CA 1.453 -0.323 0 O-C-N 121.393 -0.817 . . . . 0.0 109.589 173.107 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 3.4 t -150.23 59.36 0.97 Allowed 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 107.078 -1.453 . . . . 0.0 107.078 161.509 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 14.5 pt20 -74.46 -178.74 3.65 Favored 'General case' 0 N--CA 1.446 -0.661 0 C-N-CA 124.392 1.077 . . . . 0.0 109.19 170.055 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 44.0 m-85 -122.4 165.42 21.15 Favored Pre-proline 0 C--O 1.241 0.656 0 C-N-CA 125.74 1.616 . . . . 0.0 109.922 -173.102 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 62.8 Cg_endo -71.82 -169.0 0.4 Allowed 'Trans proline' 0 N--CA 1.46 -0.468 0 C-N-CA 123.598 2.865 . . . . 0.0 110.516 170.497 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 85.9 t -109.38 88.13 5.78 Favored Pre-proline 0 CA--C 1.539 0.544 0 C-N-CA 126.232 1.813 . . . . 0.0 108.341 178.226 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 64.9 Cg_endo -66.4 175.23 5.23 Favored 'Trans proline' 0 CA--C 1.543 0.935 0 C-N-CA 122.957 2.438 . . . . 0.0 112.744 -177.356 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -154.1 147.76 25.26 Favored 'General case' 0 N--CA 1.465 0.295 0 C-N-CA 123.171 0.588 . . . . 0.0 111.144 168.234 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.492 ' HA ' ' CD2' ' A' ' 18' ' ' TYR . 13.0 p -58.01 -22.9 20.01 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.151 0 C-N-CA 125.22 1.408 . . . . 0.0 114.048 178.711 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 8.0 t -64.92 -3.5 3.51 Favored 'General case' 0 CA--C 1.541 0.633 0 O-C-N 121.022 -1.049 . . . . 0.0 112.52 174.476 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 40.9 p -105.48 -7.98 18.36 Favored 'General case' 0 CA--C 1.543 0.707 0 CA-C-N 119.558 1.072 . . . . 0.0 112.369 178.257 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.492 ' CD2' ' HA ' ' A' ' 15' ' ' VAL . 17.8 m-30 -88.99 168.28 12.49 Favored 'General case' 0 C--N 1.342 0.282 0 C-N-CA 124.61 1.164 . . . . 0.0 111.637 -170.226 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 14.5 mt-30 -118.09 116.04 26.05 Favored 'General case' 0 C--O 1.226 -0.181 0 C-N-CA 124.835 1.254 . . . . 0.0 110.099 178.805 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 69.6 t80 -71.27 143.02 50.5 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 118.473 0.578 . . . . 0.0 110.509 172.962 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -131.0 96.75 4.13 Favored 'General case' 0 CA--C 1.515 -0.376 0 C-N-CA 124.425 1.09 . . . . 0.0 110.141 178.529 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.7 pt-20 -53.54 -19.12 3.39 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.86 1.264 . . . . 0.0 113.289 -179.972 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 1.3 t -64.21 -17.92 64.01 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.229 1.412 . . . . 0.0 111.974 178.581 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -143.83 -19.96 0.58 Allowed 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 119.341 0.973 . . . . 0.0 112.467 177.712 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 89.88 10.57 64.63 Favored Glycine 0 CA--C 1.529 0.923 0 CA-C-O 118.331 -1.261 . . . . 0.0 113.433 176.105 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 -110.63 151.08 28.09 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-N 119.257 1.529 . . . . 0.0 108.468 177.602 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 66.0 m-85 -80.29 147.79 31.0 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 106.774 -1.565 . . . . 0.0 106.774 172.764 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 35.9 t80 -105.67 135.32 47.29 Favored 'General case' 0 C--O 1.239 0.515 0 C-N-CA 125.039 1.336 . . . . 0.0 110.223 175.892 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -99.65 85.8 0.51 Allowed Pre-proline 0 N--CA 1.451 -0.403 0 C-N-CA 126.824 2.049 . . . . 0.0 110.771 -178.591 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -65.73 -5.68 12.33 Favored 'Trans proline' 0 N--CA 1.458 -0.58 0 C-N-CA 121.649 1.566 . . . . 0.0 113.994 -179.49 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 36.7 tt0 -77.31 -33.03 55.69 Favored 'General case' 0 N--CA 1.447 -0.594 0 O-C-N 121.263 -0.898 . . . . 0.0 110.46 177.948 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.439 ' HB ' ' CD2' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -135.37 -19.57 1.67 Allowed 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 126.268 1.827 . . . . 0.0 112.988 -162.913 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 94.84 -4.78 68.8 Favored Glycine 0 N--CA 1.445 -0.725 0 CA-C-O 117.678 -1.623 . . . . 0.0 113.623 175.584 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.493 ' N ' HD13 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -76.84 -179.45 5.43 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 119.847 1.824 . . . . 0.0 109.906 178.644 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 41.0 m-85 -116.54 135.34 53.9 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-N 114.672 -1.149 . . . . 0.0 109.688 161.126 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 63.7 t80 -92.18 153.38 19.35 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 126.213 1.805 . . . . 0.0 109.683 168.235 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -128.93 144.28 51.93 Favored Pre-proline 0 CA--C 1.538 0.499 0 O-C-N 121.523 -0.736 . . . . 0.0 110.383 172.461 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 61.9 Cg_endo -72.75 -23.78 18.91 Favored 'Trans proline' 0 N--CA 1.457 -0.654 0 C-N-CA 122.445 2.096 . . . . 0.0 114.573 -176.539 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -84.79 -31.11 24.09 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-N 120.558 1.526 . . . . 0.0 109.935 166.029 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 49.4 m -127.32 92.77 3.57 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-O 122.403 1.096 . . . . 0.0 110.724 -162.924 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 5.5 mp0 -62.7 -5.92 3.14 Favored 'General case' 0 CA--C 1.546 0.825 0 CA-C-N 115.215 -0.902 . . . . 0.0 111.216 168.98 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 24.7 m-85 -62.92 98.0 0.12 Allowed 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 125.829 1.652 . . . . 0.0 107.398 160.395 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 67.9 m-85 -61.69 157.16 18.34 Favored 'General case' 0 C--O 1.232 0.153 0 C-N-CA 126.335 1.854 . . . . 0.0 111.511 177.692 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 10.8 t80 -115.89 108.45 16.3 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 125.029 1.332 . . . . 0.0 108.769 174.812 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 29.7 t30 -90.32 75.74 6.85 Favored 'General case' 0 C--O 1.235 0.299 0 C-N-CA 126.761 2.024 . . . . 0.0 106.111 177.359 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -48.63 -31.07 6.12 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 124.845 1.258 . . . . 0.0 111.413 178.703 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -44.75 -39.25 5.04 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 127.643 2.377 . . . . 0.0 112.594 178.901 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 35.2 m -134.22 20.14 3.72 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.956 1.302 . . . . 0.0 110.101 176.054 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 37.3 mt-30 46.66 17.82 0.06 Allowed 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 128.741 2.817 . . . . 0.0 114.844 -165.995 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 33.7 mm-40 -76.28 166.49 23.37 Favored 'General case' 0 CA--C 1.522 -0.117 0 CA-C-N 119.623 1.101 . . . . 0.0 111.623 -176.027 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 9.6 m-85 -118.98 123.93 45.75 Favored 'General case' 0 N--CA 1.45 -0.448 0 N-CA-C 106.318 -1.734 . . . . 0.0 106.318 -177.788 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.423 HD23 ' HA ' ' A' ' 63' ' ' PRO . 22.6 mt -124.1 167.81 13.72 Favored 'General case' 0 N--CA 1.464 0.252 0 C-N-CA 126.478 1.911 . . . . 0.0 110.495 -177.032 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 9.3 p90 -134.23 148.88 50.92 Favored 'General case' 0 N--CA 1.448 -0.573 0 O-C-N 120.948 -1.095 . . . . 0.0 108.197 164.722 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 39.6 t-105 -70.92 130.49 41.75 Favored 'General case' 0 C--O 1.236 0.365 0 N-CA-C 106.242 -1.762 . . . . 0.0 106.242 167.128 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 18.9 t0 -122.82 92.08 3.63 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-N 119.329 0.968 . . . . 0.0 109.788 174.758 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -59.51 -12.81 20.47 Favored Glycine 0 CA--C 1.529 0.93 0 CA-C-O 117.645 -1.642 . . . . 0.0 113.58 -178.454 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 -69.57 -20.98 63.65 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 120.389 2.094 . . . . 0.0 111.508 174.149 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 78.6 mtt85 -134.58 -0.07 2.95 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 126.771 2.028 . . . . 0.0 111.334 -167.756 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 5.9 mpt_? 44.63 48.3 8.65 Favored 'General case' 0 N--CA 1.463 0.177 0 C-N-CA 129.093 2.957 . . . . 0.0 112.593 174.579 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 13.9 t -143.67 -174.63 4.3 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 107.473 -1.306 . . . . 0.0 107.473 172.052 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 51.6 m-85 -106.05 135.73 46.99 Favored 'General case' 0 C--O 1.234 0.277 0 N-CA-C 106.913 -1.514 . . . . 0.0 106.913 169.77 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -125.87 157.3 69.54 Favored Pre-proline 0 C--N 1.328 -0.359 0 C-N-CA 126.043 1.737 . . . . 0.0 109.176 178.598 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.423 ' HA ' HD23 ' A' ' 52' ' ' LEU . 61.0 Cg_endo -70.77 142.08 42.64 Favored 'Trans proline' 0 N--CA 1.452 -0.932 0 C-N-CA 121.232 1.288 . . . . 0.0 111.331 179.629 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -114.01 38.07 3.11 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 125.589 1.555 . . . . 0.0 111.245 -177.29 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -65.82 -34.73 78.82 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 123.991 0.916 . . . . 0.0 111.977 -173.516 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -172.29 155.61 3.61 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 129.147 2.979 . . . . 0.0 103.96 175.148 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 11.0 mt-30 -155.6 13.77 0.35 Allowed 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 125.763 1.625 . . . . 0.0 112.025 164.175 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -132.94 77.98 1.77 Allowed 'General case' 0 N--CA 1.462 0.134 0 O-C-N 120.795 -1.19 . . . . 0.0 109.4 -177.691 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 60.16 -166.78 0.19 Allowed 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 125.637 1.575 . . . . 0.0 110.172 -166.312 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 6.7 t0 -153.94 115.36 4.15 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 126.814 2.046 . . . . 0.0 106.685 -166.219 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 154.32 -163.77 31.22 Favored Glycine 0 CA--C 1.526 0.73 0 CA-C-N 120.862 1.665 . . . . 0.0 114.57 -176.753 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 6.4 p80 -57.91 -0.87 0.09 Allowed 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 118.056 2.613 . . . . 0.0 118.056 -165.044 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 29.0 mtmm -81.73 -175.43 5.56 Favored 'General case' 0 C--N 1.329 -0.312 0 O-C-N 121.335 -0.853 . . . . 0.0 109.277 179.431 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 4.6 mp0 -62.99 -178.4 0.21 Allowed 'General case' 0 CA--C 1.541 0.61 0 CA-C-O 121.571 0.7 . . . . 0.0 109.546 159.768 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -49.16 -14.02 0.08 Allowed 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 128.982 2.913 . . . . 0.0 114.875 175.8 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -173.07 173.76 45.72 Favored Glycine 0 N--CA 1.437 -1.292 0 O-C-N 121.125 -0.984 . . . . 0.0 111.744 -179.707 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -157.67 165.81 17.91 Favored Pre-proline 0 N--CA 1.451 -0.38 0 C-N-CA 125.847 1.659 . . . . 0.0 108.86 178.911 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -61.2 114.95 2.42 Favored 'Trans proline' 0 CA--C 1.535 0.561 0 C-N-CA 121.962 1.775 . . . . 0.0 110.784 161.435 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 2.5 p -171.38 59.12 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.186 0 C-N-CA 127.773 2.429 . . . . 0.0 107.457 -179.726 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 19.2 tptt -150.57 0.42 0.43 Allowed 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 168.363 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -131.41 79.98 1.91 Allowed 'General case' 0 C--O 1.236 0.358 0 N-CA-C 105.343 -2.095 . . . . 0.0 105.343 172.895 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 105.2 -78.89 0.27 Allowed Glycine 0 C--N 1.335 0.503 0 CA-C-O 122.135 0.853 . . . . 0.0 111.462 167.629 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.98 5.86 0.12 Allowed 'General case' 0 C--O 1.235 0.322 0 C-N-CA 124.566 1.146 . . . . 0.0 113.706 179.554 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 2.7 pt-20 -55.6 -48.32 75.05 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 120.234 1.379 . . . . 0.0 109.524 172.096 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -129.73 -4.16 4.67 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 115.073 1.508 . . . . 0.0 115.073 178.067 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 24.6 mtmt 70.67 170.02 0.31 Allowed 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 126.266 1.826 . . . . 0.0 111.12 172.876 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 17.2 mp0 -81.53 -70.77 0.51 Allowed 'General case' 0 C--O 1.236 0.392 0 N-CA-C 108.483 -0.932 . . . . 0.0 108.483 178.348 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 47.33 -158.32 0.04 OUTLIER 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 124.428 1.091 . . . . 0.0 109.503 -158.506 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 39.5 m-70 46.73 61.87 2.61 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 125.711 1.604 . . . . 0.0 113.274 179.559 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 2.3 ttpt -120.46 0.11 10.45 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 112.733 0.642 . . . . 0.0 112.733 -178.931 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -107.12 173.98 6.09 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.941 0.896 . . . . 0.0 108.805 -174.57 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . 0.431 ' HE3' ' O ' ' A' ' 92' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.243 0.752 0 N-CA-C 104.877 -2.268 . . . . 0.0 104.877 162.147 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.877 0 N-CA-C 109.888 -1.285 . . . . 0.0 109.888 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 35.5 t-80 -118.73 98.96 6.48 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 125.155 1.382 . . . . 0.0 107.754 -176.23 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 28.1 ptm -147.27 -0.68 0.67 Allowed 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 125.013 1.325 . . . . 0.0 113.386 -177.012 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 17.0 mt-30 -119.29 155.65 31.43 Favored 'General case' 0 C--O 1.233 0.233 0 N-CA-C 106.301 -1.74 . . . . 0.0 106.301 160.003 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 17.6 pt-20 -141.31 4.92 1.83 Allowed 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 114.308 1.225 . . . . 0.0 114.308 173.578 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 50.77 65.86 1.34 Allowed 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 124.057 0.943 . . . . 0.0 111.968 163.156 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -74.13 -179.81 4.03 Favored 'General case' 0 C--O 1.239 0.542 0 C-N-CA 124.692 1.197 . . . . 0.0 109.841 -170.772 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 63.75 76.7 0.35 Allowed 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 179.752 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -61.72 -70.82 0.17 Allowed 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 126.879 2.072 . . . . 0.0 109.032 -179.888 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 45.6 m-85 -115.61 157.48 44.22 Favored Pre-proline 0 CA--C 1.536 0.433 0 O-C-N 123.878 0.736 . . . . 0.0 111.567 179.089 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 61.9 Cg_endo -73.11 -177.8 3.18 Favored 'Trans proline' 0 CA--C 1.537 0.672 0 C-N-CA 124.747 3.631 . . . . 0.0 112.084 174.686 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 29.7 t -110.88 87.33 6.78 Favored Pre-proline 0 CA--C 1.532 0.284 0 C-N-CA 126.818 2.047 . . . . 0.0 108.697 -176.184 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 41.0 Cg_endo -67.27 162.1 40.11 Favored 'Trans proline' 0 CA--C 1.542 0.89 0 C-N-CA 121.847 1.698 . . . . 0.0 109.955 171.539 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.424 ' C ' ' H ' ' A' ' 16' ' ' SER . 50.8 t0 -159.45 32.94 0.2 Allowed 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 123.12 0.568 . . . . 0.0 111.302 -172.817 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . 0.376 7.5 p 43.78 -22.68 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.552 1.055 1 C-N-CA 133.408 4.683 . . . . 0.0 116.727 -165.94 . . . . . . . . 3 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . 0.424 ' H ' ' C ' ' A' ' 14' ' ' ASP . 2.8 p -70.18 -18.22 63.19 Favored 'General case' 0 N--CA 1.446 -0.672 0 C-N-CA 128.635 2.774 . . . . 0.0 111.995 -174.086 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 16.5 p -87.62 -13.95 41.37 Favored 'General case' 0 CA--C 1.538 0.501 0 O-C-N 121.139 -0.976 . . . . 0.0 110.712 175.455 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 13.7 m-30 -72.56 148.35 45.04 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-O 122.501 1.143 . . . . 0.0 111.023 -161.014 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 84.7 mt-30 -87.4 101.95 14.06 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 105.921 -1.881 . . . . 0.0 105.921 170.178 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 88.3 t80 -59.05 142.72 50.57 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 107.742 -1.207 . . . . 0.0 107.742 159.817 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -128.13 88.95 2.84 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 104.692 -2.336 . . . . 0.0 104.692 -176.484 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -56.09 -27.89 55.5 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 124.544 1.138 . . . . 0.0 113.699 -171.017 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 10.6 t -45.74 -52.93 10.26 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 126.024 1.73 . . . . 0.0 111.124 177.741 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 22.2 m -93.22 -35.71 12.98 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 118.513 0.597 . . . . 0.0 110.86 169.548 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 80.16 58.36 2.8 Favored Glycine 0 CA--C 1.524 0.61 0 N-CA-C 110.044 -1.222 . . . . 0.0 110.044 -173.198 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 30.3 m-85 -142.23 169.95 16.62 Favored 'General case' 0 C--O 1.24 0.597 0 C-N-CA 130.237 3.415 . . . . 0.0 106.229 173.138 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 82.2 m-85 -101.64 150.89 22.64 Favored 'General case' 0 CA--C 1.522 -0.116 0 O-C-N 121.906 -0.496 . . . . 0.0 111.043 178.709 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 41.6 t80 -119.84 140.92 50.06 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 127.848 2.459 . . . . 0.0 107.886 174.279 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 51.4 t0 -104.92 86.4 1.49 Allowed Pre-proline 0 N--CA 1.467 0.4 0 C-N-CA 127.468 2.307 . . . . 0.0 109.95 -177.134 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo -62.26 -13.77 34.36 Favored 'Trans proline' 0 CA--C 1.533 0.455 0 C-N-CA 122.716 2.278 . . . . 0.0 113.765 -175.924 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -74.32 -14.42 60.89 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 124.169 0.988 . . . . 0.0 111.453 -179.42 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.483 HG21 ' CE2' ' A' ' 61' ' ' TYR . 2.9 p -141.12 -45.77 0.38 Allowed 'General case' 0 C--N 1.332 -0.17 0 C-N-CA 125.519 1.528 . . . . 0.0 110.426 -172.204 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 98.31 46.06 2.25 Favored Glycine 0 N--CA 1.446 -0.654 0 N-CA-C 109.731 -1.348 . . . . 0.0 109.731 -175.719 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 12.7 mt -118.77 173.2 7.01 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 127.111 2.164 . . . . 0.0 107.568 172.535 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 26.4 m-85 -117.86 166.1 12.88 Favored 'General case' 0 C--O 1.238 0.481 0 C-N-CA 123.962 0.905 . . . . 0.0 109.443 168.358 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 69.2 t80 -143.87 158.65 43.55 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 125.995 1.718 . . . . 0.0 109.63 -178.372 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -131.24 143.76 50.66 Favored Pre-proline 0 CA--C 1.538 0.501 0 C-N-CA 125.406 1.482 . . . . 0.0 110.825 175.2 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -74.26 -35.12 4.18 Favored 'Trans proline' 0 CA--C 1.536 0.614 0 C-N-CA 123.465 2.777 . . . . 0.0 114.346 -178.183 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 13.6 m-80 -76.51 -23.32 53.7 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 120.085 1.311 . . . . 0.0 110.851 174.667 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -134.91 85.99 2.22 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 124.135 0.974 . . . . 0.0 108.895 -158.495 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 6.1 mp0 -62.85 -0.08 0.61 Allowed 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 124.598 1.159 . . . . 0.0 114.084 -176.038 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 60.8 m-85 -77.85 110.12 12.46 Favored 'General case' 0 C--O 1.237 0.402 0 O-C-N 120.052 -1.655 . . . . 0.0 108.449 174.525 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 14.5 m-85 -63.03 146.04 54.1 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 125.507 1.523 . . . . 0.0 109.811 -176.094 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 74.7 t80 -102.23 112.81 25.64 Favored 'General case' 0 CA--C 1.516 -0.34 0 CA-C-O 122.735 1.255 . . . . 0.0 108.206 177.785 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 49.3 t30 -84.64 80.88 9.1 Favored 'General case' 0 N--CA 1.44 -0.944 0 C-N-CA 125.266 1.427 . . . . 0.0 108.728 175.785 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -44.42 -37.17 3.25 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 125.182 1.393 . . . . 0.0 111.817 175.737 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 3.2 tt0 -44.35 -43.11 7.3 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 127.842 2.457 . . . . 0.0 112.766 179.927 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 17.9 m -131.78 21.04 4.6 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 125.438 1.495 . . . . 0.0 110.835 177.878 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 43.4 mt-30 48.27 27.99 1.47 Allowed 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 126.153 1.781 . . . . 0.0 112.571 -173.433 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.1 tp-100 -94.09 169.8 10.0 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 124.638 1.175 . . . . 0.0 110.594 -170.422 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 3.4 m-85 -108.29 144.57 35.62 Favored 'General case' 0 C--O 1.236 0.386 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 169.461 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 83.4 mt -142.6 179.93 6.68 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 127.197 2.199 . . . . 0.0 107.663 -178.991 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 17.8 p90 -135.83 146.09 47.13 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 124.435 1.094 . . . . 0.0 108.817 167.75 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 64.8 t-105 -73.43 132.95 43.54 Favored 'General case' 0 C--O 1.236 0.379 0 N-CA-C 105.676 -1.972 . . . . 0.0 105.676 164.961 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 58.9 t0 -129.63 76.6 1.73 Allowed 'General case' 0 CA--C 1.514 -0.412 0 C-N-CA 123.921 0.888 . . . . 0.0 109.004 -174.46 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -57.48 -7.16 2.78 Favored Glycine 0 CA--C 1.534 1.268 0 C-N-CA 124.692 1.139 . . . . 0.0 113.074 -176.079 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 34.3 mm-40 -65.2 -32.68 74.49 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 119.157 1.479 . . . . 0.0 109.414 169.461 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 62.5 mtt180 -118.67 -13.37 9.62 Favored 'General case' 0 C--O 1.231 0.093 0 C-N-CA 127.11 2.164 . . . . 0.0 113.466 -174.732 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 81.9 mtt180 56.58 59.72 3.44 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 124.702 1.201 . . . . 0.0 110.705 -173.8 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 4.7 t -153.94 -179.23 7.67 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 123.515 0.726 . . . . 0.0 109.051 174.475 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . 0.483 ' CE2' HG21 ' A' ' 32' ' ' THR . 98.7 m-85 -116.73 123.0 46.11 Favored 'General case' 0 C--O 1.233 0.207 0 N-CA-C 108.587 -0.894 . . . . 0.0 108.587 172.239 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -124.31 157.26 65.24 Favored Pre-proline 0 C--N 1.328 -0.357 0 C-N-CA 126.029 1.731 . . . . 0.0 110.29 -168.689 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo -72.0 130.87 17.25 Favored 'Trans proline' 0 N--CA 1.454 -0.852 0 C-N-CA 122.013 1.809 . . . . 0.0 110.933 -171.909 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -108.01 37.57 2.42 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-O 122.156 0.979 . . . . 0.0 111.089 -176.551 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.21 -28.87 68.33 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 116.061 1.874 . . . . 0.0 116.061 169.878 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -169.16 -55.3 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 119.528 1.058 . . . . 0.0 109.012 -161.307 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER 44.08 76.57 0.08 Allowed 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 128.528 2.731 . . . . 0.0 112.855 -176.762 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 5.9 t -127.84 37.7 4.15 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.3 1.44 . . . . 0.0 109.757 -178.625 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 44.16 71.86 0.23 Allowed 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 126.83 2.052 . . . . 0.0 111.48 178.232 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 51.3 t0 -103.53 75.16 1.31 Allowed 'General case' 0 N--CA 1.445 -0.712 0 N-CA-C 107.301 -1.37 . . . . 0.0 107.301 -167.451 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 76.92 10.7 86.05 Favored Glycine 0 N--CA 1.439 -1.118 0 C-N-CA 118.602 -1.761 . . . . 0.0 115.022 155.298 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 54.7 m80 56.26 21.19 5.13 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 125.086 1.354 . . . . 0.0 112.49 -163.659 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 78.0 mttt -97.53 120.64 38.27 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 106.679 -1.6 . . . . 0.0 106.679 171.885 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -64.31 104.73 0.8 Allowed 'General case' 0 CA--C 1.51 -0.565 0 N-CA-C 104.234 -2.506 . . . . 0.0 104.234 147.406 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER 44.96 -70.68 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 130.045 3.338 . . . . 0.0 114.425 162.89 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 66.75 26.16 73.02 Favored Glycine 0 N--CA 1.443 -0.851 0 N-CA-C 110.439 -1.064 . . . . 0.0 110.439 178.35 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -150.86 85.92 5.06 Favored Pre-proline 0 N--CA 1.446 -0.648 0 C-N-CA 125.891 1.676 . . . . 0.0 108.237 -173.692 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_endo -70.98 94.15 0.63 Allowed 'Trans proline' 0 CA--C 1.536 0.586 0 C-N-CA 123.055 2.503 . . . . 0.0 109.341 175.43 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 11.0 t -112.41 81.08 1.42 Allowed 'General case' 0 CA--C 1.533 0.312 0 O-C-N 121.056 -1.027 . . . . 0.0 109.07 -177.954 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -129.35 16.8 6.02 Favored 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 123.965 0.906 . . . . 0.0 109.433 172.596 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 49.1 mm-40 68.68 120.15 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 126.246 1.818 . . . . 0.0 109.415 -166.293 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 145.19 -49.02 0.68 Allowed Glycine 0 CA--C 1.53 0.97 0 C-N-CA 127.884 2.659 . . . . 0.0 110.52 -175.773 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 9.5 ttmm -148.77 16.99 0.99 Allowed 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 125.054 1.341 . . . . 0.0 111.517 -167.984 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -57.85 -46.0 85.42 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 124.78 1.232 . . . . 0.0 110.393 -167.422 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 17.1 pttm -136.4 -35.52 0.74 Allowed 'General case' 0 CA--C 1.53 0.175 0 CA-C-O 117.113 -1.422 . . . . 0.0 112.303 -178.618 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 18.1 mtmt -76.73 170.34 16.63 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 119.916 1.234 . . . . 0.0 110.472 178.924 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 72.7 mm-40 45.26 61.71 2.45 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 127.212 2.205 . . . . 0.0 111.703 174.21 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 3.7 ptpp? -124.04 49.66 1.74 Allowed 'General case' 0 C--O 1.237 0.436 0 C-N-CA 126.17 1.788 . . . . 0.0 108.785 169.269 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 28.7 m-70 -72.4 175.9 5.81 Favored 'General case' 0 CA--C 1.539 0.532 0 O-C-N 121.741 -0.599 . . . . 0.0 111.729 -178.459 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 57.8 mtpt -119.96 -29.22 4.99 Favored 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 112.868 0.692 . . . . 0.0 112.868 -166.208 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 6.9 t -156.35 42.27 0.38 Allowed 'General case' 0 C--N 1.321 -0.635 0 C-N-CA 127.315 2.246 . . . . 0.0 105.8 -179.889 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 29.2 mtpp . . . . . 0 C--O 1.25 1.098 0 CA-C-O 116.691 -1.623 . . . . 0.0 110.742 -135.973 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.546 0 N-CA-C 110.663 -0.975 . . . . 0.0 110.663 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 22.6 p80 -117.65 -172.76 2.3 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 125.719 1.608 . . . . 0.0 108.572 179.122 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 27.2 ptt? -117.05 161.23 19.74 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 108.639 -0.875 . . . . 0.0 108.639 169.851 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -151.14 171.19 17.76 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 124.581 1.152 . . . . 0.0 108.419 173.243 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -118.13 -87.09 0.63 Allowed 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 106.504 -1.665 . . . . 0.0 106.504 173.173 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 4.7 t -153.1 35.4 0.47 Allowed 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 129.028 2.931 . . . . 0.0 106.71 168.405 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 9.2 p90 -77.48 -11.79 59.89 Favored 'General case' 0 C--O 1.236 0.349 0 O-C-N 120.985 -1.072 . . . . 0.0 112.228 -174.593 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 5.3 t -63.55 171.1 2.75 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-O 122.001 0.905 . . . . 0.0 110.822 178.263 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 1.1 pt20 -62.72 175.17 0.86 Allowed 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 124.993 1.317 . . . . 0.0 110.523 170.581 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 -75.61 158.29 83.3 Favored Pre-proline 0 C--O 1.239 0.53 0 O-C-N 121.815 -0.553 . . . . 0.0 110.96 -175.361 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_endo -75.79 -178.07 4.07 Favored 'Trans proline' 0 N--CA 1.455 -0.757 0 C-N-CA 123.571 2.847 . . . . 0.0 110.288 168.93 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 13.8 t -109.81 87.64 5.83 Favored Pre-proline 0 CA--C 1.544 0.719 0 C-N-CA 126.95 2.1 . . . . 0.0 108.58 -170.38 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 25.1 Cg_endo -77.1 -178.25 4.44 Favored 'Trans proline' 0 CA--C 1.539 0.769 0 C-N-CA 124.552 3.501 . . . . 0.0 111.726 -173.76 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 22.7 t0 -152.5 142.48 22.19 Favored 'General case' 0 N--CA 1.468 0.437 0 O-C-N 121.473 -0.767 . . . . 0.0 110.102 166.417 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 12.5 p -62.65 -19.95 24.02 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.64 0 O-C-N 121.336 -0.853 . . . . 0.0 110.971 174.089 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 17.4 m -59.41 -10.55 3.3 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.804 1.242 . . . . 0.0 113.914 173.276 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.4 t -115.97 9.26 14.85 Favored 'General case' 0 CA--C 1.545 0.767 0 CA-C-N 120.159 1.345 . . . . 0.0 111.199 177.729 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 11.4 m-30 -89.01 167.68 12.97 Favored 'General case' 0 C--O 1.236 0.36 0 O-C-N 120.837 -1.165 . . . . 0.0 111.756 -178.224 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 43.9 mt-30 -98.54 129.69 45.1 Favored 'General case' 0 C--O 1.224 -0.268 0 N-CA-C 107.455 -1.313 . . . . 0.0 107.455 170.652 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 69.2 t80 -73.62 150.25 41.49 Favored 'General case' 0 C--O 1.24 0.577 0 CA-C-N 119.239 0.927 . . . . 0.0 108.742 161.281 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -126.25 93.83 3.92 Favored 'General case' 0 C--O 1.233 0.206 0 N-CA-C 107.513 -1.292 . . . . 0.0 107.513 175.541 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.82 -27.46 51.47 Favored 'General case' 0 N--CA 1.462 0.141 0 C-N-CA 124.864 1.265 . . . . 0.0 112.676 -179.677 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 13.5 t -50.95 -30.67 15.54 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 126.084 1.754 . . . . 0.0 112.385 173.43 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 31.0 m -139.18 -13.11 1.19 Allowed 'General case' 0 CA--C 1.532 0.255 0 N-CA-C 114.004 1.113 . . . . 0.0 114.004 -172.759 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 77.11 39.65 26.79 Favored Glycine 0 CA--C 1.527 0.841 0 CA-C-N 119.623 1.101 . . . . 0.0 111.651 174.181 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 4.8 m-85 -129.0 171.56 12.23 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 126.833 2.053 . . . . 0.0 107.317 170.691 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 84.2 m-85 -102.79 151.35 22.51 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 124.851 1.261 . . . . 0.0 107.717 163.92 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 37.4 t80 -117.59 139.98 50.24 Favored 'General case' 0 N--CA 1.45 -0.446 0 C-N-CA 126.801 2.04 . . . . 0.0 107.977 174.824 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -113.91 84.06 8.29 Favored Pre-proline 0 N--CA 1.439 -1.014 0 C-N-CA 125.705 1.602 . . . . 0.0 108.939 -162.184 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_endo -64.83 -14.42 44.88 Favored 'Trans proline' 0 C--N 1.349 0.587 0 C-N-CA 123.143 2.562 . . . . 0.0 113.176 -176.881 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 26.9 tt0 -69.38 -20.29 63.82 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 126.349 1.859 . . . . 0.0 111.495 -178.786 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -146.69 -33.63 0.3 Allowed 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 125.235 1.414 . . . . 0.0 112.391 -166.732 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 91.98 39.3 5.51 Favored Glycine 0 CA--C 1.527 0.831 0 C-N-CA 125.079 1.323 . . . . 0.0 111.648 -176.89 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 10.0 mt -122.66 -179.2 4.14 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 125.707 1.603 . . . . 0.0 108.012 177.546 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 47.2 m-85 -123.14 154.98 37.91 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 123.447 0.699 . . . . 0.0 109.369 166.61 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 39.7 t80 -124.41 158.38 32.87 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 127.376 2.27 . . . . 0.0 110.195 177.081 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 15.5 t0 -132.42 142.05 43.5 Favored Pre-proline 0 N--CA 1.468 0.461 0 C-N-CA 126.124 1.77 . . . . 0.0 108.253 -179.414 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo -81.1 -30.18 1.74 Allowed 'Trans proline' 0 C--O 1.239 0.572 0 C-N-CA 122.345 2.03 . . . . 0.0 114.18 -174.577 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -76.74 -30.4 56.58 Favored 'General case' 0 N--CA 1.453 -0.309 0 O-C-N 121.141 -0.974 . . . . 0.0 110.833 173.365 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 48.9 m -136.92 98.08 3.68 Favored 'General case' 0 C--O 1.219 -0.527 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 -168.82 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 26.9 mp0 -56.97 -6.68 0.37 Allowed 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 125.942 1.697 . . . . 0.0 113.782 -178.985 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 25.4 m-85 -66.26 103.51 1.01 Allowed 'General case' 0 N--CA 1.446 -0.643 0 C-N-CA 126.049 1.74 . . . . 0.0 107.803 173.549 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 50.2 m-85 -59.56 156.94 12.42 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 125.056 1.342 . . . . 0.0 109.771 178.235 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 66.7 t80 -111.57 112.76 24.71 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 125.169 1.388 . . . . 0.0 108.042 177.579 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 50.3 t30 -84.15 81.41 8.82 Favored 'General case' 0 N--CA 1.446 -0.651 0 C-N-CA 125.875 1.67 . . . . 0.0 109.098 178.096 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -50.21 -30.83 12.36 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 124.82 1.248 . . . . 0.0 112.354 178.425 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -53.65 -36.61 62.27 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 127.182 2.193 . . . . 0.0 113.68 -179.35 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 60.5 m -128.59 -1.0 5.52 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.656 1.182 . . . . 0.0 112.543 -179.505 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 20.6 mt-30 65.7 35.97 6.6 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.799 1.639 . . . . 0.0 110.166 -169.494 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -103.78 170.39 7.95 Favored 'General case' 0 N--CA 1.468 0.451 0 O-C-N 120.435 -1.416 . . . . 0.0 110.822 -175.331 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 4.2 m-85 -117.98 133.02 56.32 Favored 'General case' 0 C--O 1.234 0.245 0 C-N-CA 124.888 1.275 . . . . 0.0 107.898 177.771 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.455 ' HA ' ' HA ' ' A' ' 63' ' ' PRO . 41.9 mt -132.9 177.84 7.34 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 125.777 1.631 . . . . 0.0 109.135 -175.136 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 32.5 p90 -139.16 153.15 47.89 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 125.457 1.503 . . . . 0.0 108.697 168.611 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 57.2 t-105 -85.71 128.6 34.83 Favored 'General case' 0 C--O 1.233 0.227 0 N-CA-C 106.806 -1.554 . . . . 0.0 106.806 168.927 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 61.8 t0 -121.16 100.01 6.81 Favored 'General case' 0 N--CA 1.446 -0.657 0 N-CA-C 108.444 -0.946 . . . . 0.0 108.444 -174.743 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -71.23 -15.79 74.89 Favored Glycine 0 CA--C 1.526 0.732 0 CA-C-O 118.317 -1.268 . . . . 0.0 112.835 176.95 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -62.99 -43.96 97.35 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 119.615 1.708 . . . . 0.0 107.028 173.389 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 5.6 mtt180 -107.1 -6.44 17.39 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 125.097 1.359 . . . . 0.0 113.288 -170.494 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 86.1 mtt180 43.88 60.81 2.55 Favored 'General case' 0 CA--C 1.52 -0.205 0 C-N-CA 127.989 2.515 . . . . 0.0 109.753 -169.874 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 6.2 t -150.2 172.2 15.71 Favored 'General case' 0 N--CA 1.447 -0.594 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 -179.831 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 74.0 m-85 -104.43 129.16 52.41 Favored 'General case' 0 C--O 1.236 0.363 0 N-CA-C 108.701 -0.852 . . . . 0.0 108.701 166.223 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -126.16 154.98 74.32 Favored Pre-proline 0 C--N 1.327 -0.388 0 C-N-CA 127.272 2.229 . . . . 0.0 108.815 -177.142 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.455 ' HA ' ' HA ' ' A' ' 52' ' ' LEU . 68.5 Cg_endo -75.39 137.73 21.24 Favored 'Trans proline' 0 N--CA 1.456 -0.691 0 C-N-CA 122.104 1.869 . . . . 0.0 111.726 -176.986 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -107.65 29.11 7.51 Favored 'General case' 0 N--CA 1.461 0.113 0 C-N-CA 124.847 1.259 . . . . 0.0 111.703 -178.047 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 7.6 mp -56.72 -63.2 1.28 Allowed 'General case' 0 N--CA 1.448 -0.571 0 N-CA-C 107.553 -1.277 . . . . 0.0 107.553 161.239 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 17.7 tp10 -124.35 -52.65 1.72 Allowed 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 112.961 0.726 . . . . 0.0 112.961 -161.551 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . 0.265 17.0 pt20 47.69 18.63 0.13 Allowed 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 126.49 1.916 . . . . 0.0 116.148 -176.442 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 1.8 t -120.71 14.83 11.8 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 125.089 1.356 . . . . 0.0 113.524 -166.993 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 62.06 53.87 2.88 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 124.816 1.246 . . . . 0.0 111.671 179.372 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -82.36 -68.93 0.66 Allowed 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 115.831 -0.622 . . . . 0.0 109.998 174.158 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 173.53 -156.41 24.09 Favored Glycine 0 CA--C 1.528 0.899 0 C-N-CA 125.92 1.724 . . . . 0.0 109.542 -171.299 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 40.9 t-80 -123.75 19.77 9.4 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 126.407 1.883 . . . . 0.0 110.998 -179.185 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 89.4 mttt -68.5 100.69 1.13 Allowed 'General case' 0 C--O 1.225 -0.193 0 C-N-CA 124.885 1.274 . . . . 0.0 110.704 -165.523 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 44.99 74.67 0.12 Allowed 'General case' 0 CA--C 1.517 -0.295 0 C-N-CA 124.857 1.263 . . . . 0.0 109.594 -165.885 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 1.8 m 75.48 -37.52 0.33 Allowed 'General case' 0 CA--C 1.537 0.454 0 O-C-N 121.492 -0.755 . . . . 0.0 111.268 167.135 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 164.75 174.31 34.34 Favored Glycine 0 CA--C 1.527 0.791 0 C-N-CA 124.781 1.181 . . . . 0.0 110.931 -168.71 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -108.51 158.07 34.89 Favored Pre-proline 0 CA--C 1.537 0.446 0 C-N-CA 123.895 0.878 . . . . 0.0 110.63 -174.132 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_endo -73.19 125.03 9.95 Favored 'Trans proline' 0 N--CA 1.456 -0.735 0 C-N-CA 122.486 2.124 . . . . 0.0 109.363 171.16 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 1.7 m -136.06 84.53 2.09 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 107.874 -1.158 . . . . 0.0 107.874 171.901 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 7.9 tptm -155.49 -16.97 0.11 Allowed 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 125.448 1.499 . . . . 0.0 112.524 177.212 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 80.1 mt-10 -74.25 9.05 1.81 Allowed 'General case' 0 CA--C 1.547 0.845 0 O-C-N 120.233 -1.542 . . . . 0.0 112.628 -177.949 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 102.19 -24.73 30.16 Favored Glycine 0 C--N 1.335 0.497 0 C-N-CA 124.996 1.284 . . . . 0.0 112.208 170.508 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 5.1 mptt -84.28 12.11 7.19 Favored 'General case' 0 C--O 1.215 -0.726 0 CA-C-O 116.868 -1.539 . . . . 0.0 111.353 168.716 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 18.0 pt-20 -45.57 19.67 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.043 1 C-N-CA 134.779 5.232 . . . . 0.0 118.329 -176.534 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 1.8 tmtp? -178.83 -21.86 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 128.493 2.717 . . . . 0.0 111.288 -155.946 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -145.54 22.04 1.48 Allowed 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 127.357 2.263 . . . . 0.0 110.809 -160.949 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.532 ' CD ' ' H ' ' A' ' 87' ' ' GLU . 0.2 OUTLIER -66.25 48.67 0.03 OUTLIER 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 128.972 2.909 . . . . 0.0 112.594 176.293 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 46.1 mttp -113.98 110.48 20.13 Favored 'General case' 0 N--CA 1.449 -0.517 0 N-CA-C 106.145 -1.798 . . . . 0.0 106.145 173.052 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 41.5 m80 -66.13 153.87 41.21 Favored 'General case' 0 C--O 1.238 0.49 0 N-CA-C 107.847 -1.168 . . . . 0.0 107.847 167.58 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 7.0 mmtp -78.01 96.07 4.99 Favored 'General case' 0 N--CA 1.462 0.144 0 N-CA-C 106.491 -1.67 . . . . 0.0 106.491 164.525 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -144.83 149.07 34.77 Favored 'General case' 0 C--O 1.237 0.402 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 176.953 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 3.3 ttpp . . . . . 0 C--O 1.247 0.969 0 CA-C-O 117.156 -1.402 . . . . 0.0 109.691 -162.67 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.733 0 N-CA-C 108.28 -1.928 . . . . 0.0 108.28 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 97.2 m-70 -130.69 146.52 52.19 Favored 'General case' 0 C--O 1.234 0.282 0 N-CA-C 108.277 -1.008 . . . . 0.0 108.277 -177.191 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 7.8 ptt? -161.33 -169.3 2.27 Favored 'General case' 0 N--CA 1.45 -0.444 0 C-N-CA 127.103 2.161 . . . . 0.0 107.335 168.179 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 46.6 mt-30 -59.7 165.16 3.18 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 123.892 0.877 . . . . 0.0 110.768 171.774 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 1.8 pt-20 -147.54 -86.74 0.09 Allowed 'General case' 0 C--O 1.233 0.194 0 O-C-N 121.628 -0.67 . . . . 0.0 109.348 -175.777 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -161.61 11.71 0.08 Allowed 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 123.26 0.624 . . . . 0.0 111.789 -174.256 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 38.3 p90 -73.61 -28.68 61.94 Favored 'General case' 0 C--O 1.232 0.17 0 O-C-N 121.155 -0.966 . . . . 0.0 110.726 -166.581 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER 60.42 150.95 0.02 OUTLIER 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 129.448 3.099 . . . . 0.0 113.386 178.212 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -153.54 -178.67 7.16 Favored 'General case' 0 N--CA 1.45 -0.473 0 O-C-N 121.248 -0.908 . . . . 0.0 110.344 -177.914 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 27.9 m-85 -82.93 164.33 46.99 Favored Pre-proline 0 CA--C 1.536 0.432 0 C-N-CA 124.643 1.177 . . . . 0.0 111.52 -167.842 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -65.67 170.09 11.83 Favored 'Trans proline' 0 CA--C 1.536 0.582 0 C-N-CA 123.819 3.012 . . . . 0.0 109.842 165.313 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 42.4 t -109.23 86.19 3.96 Favored Pre-proline 0 CA--C 1.536 0.428 0 C-N-CA 125.277 1.431 . . . . 0.0 108.539 -170.479 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 42.1 Cg_endo -75.93 166.78 27.44 Favored 'Trans proline' 0 N--CA 1.449 -1.103 0 C-N-CA 121.74 1.627 . . . . 0.0 110.34 -174.366 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 61.5 t0 -142.61 129.38 20.47 Favored 'General case' 0 C--O 1.237 0.412 0 N-CA-C 107.08 -1.452 . . . . 0.0 107.08 173.838 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.476 HG21 ' CE1' ' A' ' 36' ' ' TYR . 12.3 p -53.85 -24.55 10.57 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.352 0 C-N-CA 124.626 1.17 . . . . 0.0 111.995 176.039 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 38.7 t -45.54 -29.54 1.2 Allowed 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.74 1.616 . . . . 0.0 112.389 170.267 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 49.0 p -109.68 2.22 20.03 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 125.149 1.38 . . . . 0.0 112.879 -171.557 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 15.7 m-30 -77.37 175.49 9.72 Favored 'General case' 0 C--O 1.236 0.382 0 O-C-N 121.302 -0.873 . . . . 0.0 110.605 -178.973 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 80.9 mt-30 -116.85 106.59 13.62 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 125.263 1.425 . . . . 0.0 107.473 -176.313 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 49.4 t80 -66.34 147.11 53.78 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.826 -0.435 . . . . 0.0 109.826 176.371 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -135.08 86.0 2.22 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 125.319 1.448 . . . . 0.0 107.203 176.709 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -49.86 -32.22 13.86 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 126.946 2.098 . . . . 0.0 113.635 179.415 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 7.1 t -60.54 -18.65 53.61 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 125.035 1.334 . . . . 0.0 112.503 179.165 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 58.6 m -107.17 -50.3 3.11 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 118.965 0.802 . . . . 0.0 109.582 153.967 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 117.27 9.56 10.38 Favored Glycine 0 CA--C 1.522 0.499 0 C-N-CA 125.452 1.501 . . . . 0.0 112.05 -172.048 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -105.63 168.94 8.77 Favored 'General case' 0 CA--C 1.519 -0.236 0 CA-C-N 118.576 1.188 . . . . 0.0 109.011 -175.443 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 94.8 m-85 -93.33 147.37 22.99 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 107.602 -1.258 . . . . 0.0 107.602 167.884 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 14.9 t80 -111.96 136.11 51.72 Favored 'General case' 0 N--CA 1.442 -0.871 0 C-N-CA 126.35 1.86 . . . . 0.0 107.027 171.57 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -119.69 77.71 21.29 Favored Pre-proline 0 N--CA 1.437 -1.091 0 C-N-CA 125.407 1.483 . . . . 0.0 108.773 -162.874 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 22.6 Cg_endo -62.9 -12.13 27.82 Favored 'Trans proline' 0 C--N 1.348 0.518 0 C-N-CA 122.83 2.354 . . . . 0.0 113.445 -176.861 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 21.0 mm-40 -62.71 -19.92 64.38 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.68 0.792 . . . . 0.0 111.111 174.459 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 5.8 p -141.74 -23.58 0.71 Allowed 'General case' 0 C--O 1.234 0.286 0 N-CA-C 113.834 1.049 . . . . 0.0 113.834 178.569 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 79.03 43.2 11.08 Favored Glycine 0 CA--C 1.531 1.034 0 N-CA-C 109.905 -1.278 . . . . 0.0 109.905 -166.301 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 42.3 mt -111.84 178.55 4.28 Favored 'General case' 0 C--O 1.234 0.282 0 C-N-CA 124.712 1.205 . . . . 0.0 108.175 165.659 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 36.9 m-85 -123.65 154.63 39.09 Favored 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 124.883 1.273 . . . . 0.0 107.605 166.304 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.476 ' CE1' HG21 ' A' ' 15' ' ' VAL . 24.3 t80 -131.02 156.06 45.79 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 125.414 1.485 . . . . 0.0 109.358 -178.217 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -127.22 144.15 49.62 Favored Pre-proline 0 CA--C 1.536 0.436 0 C-N-CA 123.649 0.78 . . . . 0.0 110.359 175.529 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -74.28 -31.75 7.21 Favored 'Trans proline' 0 CA--C 1.535 0.54 0 C-N-CA 122.894 2.396 . . . . 0.0 113.849 -176.758 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 8.5 m-80 -75.38 -29.62 59.91 Favored 'General case' 0 N--CA 1.462 0.144 0 CA-C-N 119.346 0.976 . . . . 0.0 109.925 170.395 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -129.64 89.73 2.88 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 123.881 0.873 . . . . 0.0 109.841 -158.267 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -68.15 9.94 0.27 Allowed 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 124.49 1.116 . . . . 0.0 112.913 -177.627 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 56.6 m-85 -81.78 112.77 19.24 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 126.589 1.956 . . . . 0.0 106.947 170.314 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 23.1 m-85 -77.96 124.49 28.07 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 124.255 1.022 . . . . 0.0 111.036 -177.681 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 92.1 t80 -77.2 118.85 20.12 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 125.153 1.381 . . . . 0.0 108.983 178.925 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 26.4 t30 -90.41 83.96 5.96 Favored 'General case' 0 CA--C 1.512 -0.489 0 C-N-CA 125.432 1.493 . . . . 0.0 109.565 -178.558 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -53.26 -26.03 16.64 Favored 'General case' 0 CA--C 1.538 0.504 0 N-CA-C 114.37 1.248 . . . . 0.0 114.37 -173.734 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -52.67 -66.01 0.46 Allowed 'General case' 0 C--O 1.236 0.343 0 C-N-CA 125.898 1.679 . . . . 0.0 109.084 178.178 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 19.2 m -112.69 22.67 14.3 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 124.922 1.289 . . . . 0.0 111.258 -171.272 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . 0.337 5.3 pt20 44.65 34.14 1.08 Allowed 'General case' 0 CA--C 1.554 1.11 0 C-N-CA 126.72 2.008 . . . . 0.0 113.312 -178.525 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 7.0 mm-40 -97.47 152.69 18.73 Favored 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 126.483 1.913 . . . . 0.0 112.26 178.844 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 3.4 m-30 -95.57 139.72 31.42 Favored 'General case' 0 N--CA 1.47 0.566 0 O-C-N 120.833 -1.167 . . . . 0.0 108.762 172.862 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.486 ' HA ' ' H ' ' A' ' 64' ' ' ALA . 41.4 mt -131.33 174.29 10.21 Favored 'General case' 0 N--CA 1.465 0.279 0 C-N-CA 126.749 2.02 . . . . 0.0 110.267 -176.478 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 31.2 p90 -143.53 149.14 37.03 Favored 'General case' 0 C--O 1.238 0.493 0 C-N-CA 124.107 0.963 . . . . 0.0 110.361 168.077 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 50.1 t-105 -93.16 92.6 7.84 Favored 'General case' 0 CA--C 1.516 -0.36 0 N-CA-C 105.075 -2.195 . . . . 0.0 105.075 -176.53 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 43.8 t0 -87.52 96.45 10.4 Favored 'General case' 0 N--CA 1.446 -0.669 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 -177.691 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -59.44 -15.37 31.55 Favored Glycine 0 CA--C 1.53 0.971 0 CA-C-O 118.414 -1.215 . . . . 0.0 112.694 178.754 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 22.7 mt-10 -66.92 -34.84 78.65 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 119.987 1.894 . . . . 0.0 110.1 175.4 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 21.1 mtt180 -109.58 -4.97 15.86 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 125.541 1.536 . . . . 0.0 111.453 -177.05 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 76.1 mtm180 44.21 49.16 7.77 Favored 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 126.374 1.87 . . . . 0.0 110.169 -174.697 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 3.2 t -147.13 178.81 8.09 Favored 'General case' 0 N--CA 1.443 -0.798 0 N-CA-C 108.909 -0.775 . . . . 0.0 108.909 -177.451 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 89.3 m-85 -109.76 131.72 54.8 Favored 'General case' 0 C--O 1.24 0.572 0 N-CA-C 108.146 -1.057 . . . . 0.0 108.146 178.1 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -125.88 154.43 73.56 Favored Pre-proline 0 C--N 1.325 -0.484 0 C-N-CA 125.788 1.635 . . . . 0.0 108.907 176.092 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.42 ' HA ' HD23 ' A' ' 52' ' ' LEU . 72.0 Cg_endo -75.43 124.03 8.06 Favored 'Trans proline' 0 N--CA 1.453 -0.871 0 C-N-CA 122.562 2.174 . . . . 0.0 111.105 179.497 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.486 ' H ' ' HA ' ' A' ' 52' ' ' LEU . . . -85.97 56.9 4.18 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-O 122.531 1.158 . . . . 0.0 109.379 166.674 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -63.8 176.97 0.81 Allowed 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 115.106 -0.952 . . . . 0.0 110.553 153.885 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -52.81 -33.26 48.34 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 124.064 0.946 . . . . 0.0 112.683 -175.982 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 8.5 pt20 50.32 11.03 0.06 Allowed 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 129.251 3.02 . . . . 0.0 115.151 175.252 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 13.3 t -140.24 17.5 2.42 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 125.782 1.633 . . . . 0.0 110.452 -178.668 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -149.51 164.24 35.61 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 119.266 0.939 . . . . 0.0 111.35 177.179 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 56.0 t0 65.67 -83.65 0.03 OUTLIER 'General case' 0 C--O 1.236 0.39 0 C-N-CA 130.754 3.622 . . . . 0.0 109.69 172.576 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 173.61 -162.6 33.59 Favored Glycine 0 N--CA 1.437 -1.263 0 N-CA-C 108.829 -1.708 . . . . 0.0 108.829 171.062 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 12.4 m80 -65.48 83.53 0.06 Allowed 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 118.408 1.104 . . . . 0.0 108.687 165.242 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 37.8 mttm -150.3 -167.35 2.8 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 125.205 1.402 . . . . 0.0 109.77 -173.085 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -64.56 -43.88 92.52 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 124.425 1.09 . . . . 0.0 111.087 179.39 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER 53.61 -10.45 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 127.867 2.467 . . . . 0.0 116.995 -164.925 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -85.55 92.53 1.78 Allowed Glycine 0 N--CA 1.434 -1.446 0 N-CA-C 107.823 -2.111 . . . . 0.0 107.823 -160.515 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -137.73 82.35 26.88 Favored Pre-proline 0 C--O 1.24 0.603 0 N-CA-C 107.388 -1.338 . . . . 0.0 107.388 170.97 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -84.46 64.16 6.71 Favored 'Trans proline' 0 N--CA 1.457 -0.622 0 C-N-CA 124.079 3.186 . . . . 0.0 110.182 -168.762 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 1.8 p -128.41 57.06 1.6 Allowed 'General case' 0 C--N 1.328 -0.352 0 O-C-N 121.06 -1.025 . . . . 0.0 111.06 -165.202 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 4.1 tmtt? -81.25 53.62 2.08 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 120.828 -1.17 . . . . 0.0 111.172 176.424 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . 0.302 0.1 OUTLIER 51.9 6.08 0.04 OUTLIER 'General case' 0 N--CA 1.47 0.558 1 C-N-CA 132.389 4.276 . . . . 0.0 118.403 158.064 . . . . . . . . 4 3 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -179.52 -20.61 0.03 OUTLIER Glycine 0 CA--C 1.526 0.751 0 C-N-CA 127.971 2.7 . . . . 0.0 110.412 178.866 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 37.6 tttt -79.54 -16.24 56.3 Favored 'General case' 0 C--N 1.349 0.567 0 CA-C-N 119.544 1.672 . . . . 0.0 110.701 168.095 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.48 ' HG3' ' H ' ' A' ' 85' ' ' LYS . 2.2 pt-20 -42.01 -71.68 0.08 Allowed 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 125.998 1.719 . . . . 0.0 110.358 -135.938 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.48 ' H ' ' HG3' ' A' ' 84' ' ' GLU . 2.3 ptmt -117.29 10.26 13.67 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 127.821 2.448 . . . . 0.0 110.751 174.78 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 84.2 tttt -80.37 -36.71 33.62 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 124.033 0.933 . . . . 0.0 112.062 -162.451 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 21.2 tp10 51.5 40.14 26.21 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 124.812 1.245 . . . . 0.0 112.617 173.059 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 36.4 mtpt 56.15 -65.29 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 129.858 3.263 . . . . 0.0 116.36 176.997 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 57.7 m80 49.48 70.29 0.5 Allowed 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 126.54 1.936 . . . . 0.0 112.326 -174.364 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 1.6 pptp? -93.11 118.15 30.89 Favored 'General case' 0 CA--C 1.529 0.144 0 C-N-CA 124.187 0.995 . . . . 0.0 109.457 -177.864 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 9.1 m -81.77 71.38 8.79 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-O 121.578 0.704 . . . . 0.0 109.406 175.607 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 1.3 mptm? . . . . . 0 C--O 1.249 1.053 0 N-CA-C 101.093 -3.669 . . . . 0.0 101.093 161.73 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.553 0 N-CA-C 109.873 -1.291 . . . . 0.0 109.873 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 3.1 t-160 61.79 -178.15 0.12 Allowed 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 125.333 1.453 . . . . 0.0 109.873 -168.521 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 44.8 ttm -69.4 -33.88 73.67 Favored 'General case' 0 N--CA 1.463 0.198 0 O-C-N 121.209 -0.932 . . . . 0.0 110.176 -179.944 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 10.7 pt20 -139.97 158.0 44.78 Favored 'General case' 0 N--CA 1.449 -0.503 0 C-N-CA 123.421 0.688 . . . . 0.0 110.237 -154.697 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -84.84 -82.75 0.17 Allowed 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 106.99 -1.485 . . . . 0.0 106.99 167.508 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 5.4 p -171.74 15.73 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 124.498 1.119 . . . . 0.0 111.152 -165.164 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 22.5 t80 -85.37 120.24 26.62 Favored 'General case' 0 N--CA 1.434 -1.242 0 N-CA-C 107.901 -1.148 . . . . 0.0 107.901 -164.756 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 25.8 p -157.87 -62.66 0.09 Allowed 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 108.456 -0.942 . . . . 0.0 108.456 -178.601 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 11.8 mm100 -130.54 -85.07 0.53 Allowed 'General case' 0 N--CA 1.437 -1.088 0 C-N-CA 126.951 2.101 . . . . 0.0 109.507 176.898 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 68.6 m-85 -97.19 159.1 32.09 Favored Pre-proline 0 CA--C 1.537 0.457 0 CA-C-N 118.757 0.708 . . . . 0.0 111.208 -179.763 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -71.7 178.47 5.71 Favored 'Trans proline' 0 N--CA 1.459 -0.514 0 C-N-CA 123.964 3.109 . . . . 0.0 110.848 167.498 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 37.1 t -104.6 85.85 1.26 Allowed Pre-proline 0 CA--C 1.541 0.609 0 C-N-CA 127.009 2.123 . . . . 0.0 108.987 -171.494 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_endo -69.91 171.71 14.14 Favored 'Trans proline' 0 C--O 1.237 0.462 0 C-N-CA 123.142 2.561 . . . . 0.0 111.045 179.845 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 14.0 t0 -144.61 139.94 28.41 Favored 'General case' 0 C--O 1.224 -0.238 0 N-CA-C 107.412 -1.329 . . . . 0.0 107.412 178.401 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 6.5 p -65.61 -19.89 26.46 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.599 0 CA-C-N 119.291 0.951 . . . . 0.0 111.22 175.382 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 10.6 t -60.42 -17.83 46.87 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-O 117.334 -1.317 . . . . 0.0 112.092 173.079 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 29.7 p -100.15 -6.13 26.7 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 121.577 1.989 . . . . 0.0 113.028 176.005 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 13.3 m-30 -70.74 173.67 6.96 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 119.531 1.06 . . . . 0.0 112.472 -174.322 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 77.0 mt-30 -114.79 109.28 17.94 Favored 'General case' 0 CA--C 1.528 0.122 0 C-N-CA 126.142 1.777 . . . . 0.0 108.949 176.745 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 81.8 t80 -68.64 142.08 55.2 Favored 'General case' 0 C--O 1.238 0.491 0 CA-C-N 119.343 0.974 . . . . 0.0 110.674 169.708 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 3.6 t0 -119.71 111.42 18.0 Favored 'General case' 0 CA--C 1.504 -0.822 0 N-CA-C 106.686 -1.598 . . . . 0.0 106.686 170.817 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -64.2 -21.94 66.75 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 118.155 -0.926 . . . . 0.0 112.927 178.082 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 1.3 t -61.34 -38.76 88.1 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 118.327 0.512 . . . . 0.0 110.555 -171.82 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 7.8 m -113.36 -19.34 11.77 Favored 'General case' 0 C--O 1.233 0.219 0 C-N-CA 124.703 1.201 . . . . 0.0 111.018 173.87 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 81.46 34.49 25.51 Favored Glycine 0 C--N 1.337 0.599 0 N-CA-C 110.74 -0.944 . . . . 0.0 110.74 174.692 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 4.4 m-85 -119.69 171.05 8.66 Favored 'General case' 0 N--CA 1.463 0.213 0 C-N-CA 126.482 1.913 . . . . 0.0 108.352 178.475 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 67.5 m-85 -103.76 141.01 36.83 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 107.701 -1.222 . . . . 0.0 107.701 171.929 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 52.3 t80 -102.2 136.91 41.21 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 125.868 1.667 . . . . 0.0 106.574 169.91 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 16.7 t0 -97.82 87.45 0.53 Allowed Pre-proline 0 C--N 1.327 -0.387 0 C-N-CA 126.458 1.903 . . . . 0.0 110.332 179.826 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -61.51 -10.54 16.63 Favored 'Trans proline' 0 CA--C 1.537 0.647 0 C-N-CA 121.618 1.546 . . . . 0.0 113.236 176.22 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -80.88 -13.52 58.85 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 124.643 1.177 . . . . 0.0 112.219 -177.784 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 69.8 p -146.48 -23.81 0.43 Allowed 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 113.98 1.104 . . . . 0.0 113.98 168.2 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 108.14 3.27 33.7 Favored Glycine 0 CA--C 1.53 1.009 0 C-N-CA 124.881 1.229 . . . . 0.0 113.936 -179.272 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 39.4 mt -71.38 178.19 3.55 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 125.562 1.545 . . . . 0.0 110.587 173.983 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 54.3 m-85 -116.7 167.19 11.31 Favored 'General case' 0 C--O 1.237 0.424 0 C-N-CA 124.682 1.193 . . . . 0.0 108.333 158.295 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 80.3 t80 -141.4 163.06 33.97 Favored 'General case' 0 C--O 1.237 0.431 0 C-N-CA 126.376 1.87 . . . . 0.0 108.916 176.808 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -133.11 143.9 50.39 Favored Pre-proline 0 CA--C 1.536 0.406 0 C-N-CA 124.189 0.996 . . . . 0.0 110.503 177.971 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -73.71 -38.65 2.27 Favored 'Trans proline' 0 N--CA 1.454 -0.84 0 C-N-CA 123.236 2.624 . . . . 0.0 112.656 -176.017 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 27.0 m-80 -78.13 -35.97 48.38 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-N 119.091 0.86 . . . . 0.0 110.414 -178.272 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 48.8 p -130.86 91.95 3.14 Favored 'General case' 0 C--O 1.223 -0.301 0 N-CA-C 108.379 -0.971 . . . . 0.0 108.379 -159.886 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -60.79 0.17 0.23 Allowed 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 126.311 1.844 . . . . 0.0 115.549 -163.828 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 38.2 m-85 -68.53 123.98 22.33 Favored 'General case' 0 N--CA 1.448 -0.575 0 C-N-CA 125.134 1.374 . . . . 0.0 108.927 174.271 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 25.6 m-85 -75.92 141.64 42.25 Favored 'General case' 0 N--CA 1.448 -0.54 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 175.789 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 56.9 t80 -102.51 115.32 30.34 Favored 'General case' 0 C--N 1.33 -0.242 0 C-N-CA 123.949 0.899 . . . . 0.0 109.288 176.318 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 26.4 t30 -88.29 87.16 7.21 Favored 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 106.992 -1.484 . . . . 0.0 106.992 172.43 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -48.62 -39.6 24.59 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 124.618 1.167 . . . . 0.0 110.112 175.858 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -55.95 -11.34 1.02 Allowed 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 127.673 2.389 . . . . 0.0 116.409 -177.807 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -145.02 6.56 1.16 Allowed 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 119.728 1.149 . . . . 0.0 111.268 160.847 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 50.4 mt-30 64.94 15.78 10.14 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 129.345 3.058 . . . . 0.0 113.273 -168.045 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.92 148.64 49.89 Favored 'General case' 0 N--CA 1.466 0.334 0 O-C-N 121.096 -1.003 . . . . 0.0 111.19 -179.399 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 8.8 m-85 -106.34 132.31 52.53 Favored 'General case' 0 C--O 1.234 0.262 0 N-CA-C 108.165 -1.05 . . . . 0.0 108.165 168.037 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 78.5 mt -135.17 -176.03 4.12 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 127.136 2.174 . . . . 0.0 107.511 -172.741 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 19.6 p90 -146.7 160.24 42.47 Favored 'General case' 0 C--O 1.235 0.316 0 O-C-N 120.758 -1.213 . . . . 0.0 109.527 163.871 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 45.9 t-105 -82.39 105.07 13.15 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 125.15 1.38 . . . . 0.0 108.068 173.104 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 23.1 t0 -89.94 96.86 10.87 Favored 'General case' 0 C--O 1.235 0.339 0 N-CA-C 105.986 -1.857 . . . . 0.0 105.986 170.858 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -76.49 -7.38 85.35 Favored Glycine 0 CA--C 1.531 1.075 0 CA-C-O 118.235 -1.314 . . . . 0.0 112.804 -179.989 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 25.3 mt-10 -73.58 -48.6 31.55 Favored 'General case' 0 C--N 1.341 0.236 0 CA-C-N 119.853 1.827 . . . . 0.0 108.808 172.158 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -81.02 -14.62 57.74 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.631 1.172 . . . . 0.0 112.449 174.01 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.9 mpt_? 46.91 61.42 2.85 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 125.436 1.495 . . . . 0.0 109.913 -164.339 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 5.6 t -150.38 174.85 12.42 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-O 121.543 0.687 . . . . 0.0 109.978 174.059 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 93.6 m-85 -108.63 121.25 44.63 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 125.158 1.383 . . . . 0.0 108.106 179.028 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -125.21 154.31 71.82 Favored Pre-proline 0 C--N 1.324 -0.514 0 C-N-CA 125.403 1.481 . . . . 0.0 110.25 -170.263 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_endo -70.0 126.57 13.3 Favored 'Trans proline' 0 N--CA 1.454 -0.843 0 C-N-CA 122.479 2.119 . . . . 0.0 110.527 178.937 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -86.62 12.74 9.88 Favored 'General case' 0 C--N 1.332 -0.158 0 N-CA-C 114.235 1.198 . . . . 0.0 114.235 -173.621 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 5.1 mp -144.37 -85.13 0.14 Allowed 'General case' 0 N--CA 1.444 -0.73 0 C-N-CA 126.995 2.118 . . . . 0.0 108.011 -166.91 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -155.29 -63.84 0.12 Allowed 'General case' 0 N--CA 1.446 -0.664 0 C-N-CA 128.943 2.897 . . . . 0.0 104.911 176.188 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 48.31 173.79 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 130.231 3.412 . . . . 0.0 115.224 170.595 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 1.8 t 67.09 145.89 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 126.324 1.849 . . . . 0.0 110.559 -168.791 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 54.11 49.46 18.72 Favored 'General case' 0 C--O 1.239 0.523 0 C-N-CA 125.917 1.687 . . . . 0.0 112.704 179.443 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -60.36 137.0 58.21 Favored 'General case' 0 N--CA 1.447 -0.591 0 N-CA-C 106.764 -1.569 . . . . 0.0 106.764 168.45 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -154.75 -108.09 0.3 Allowed Glycine 0 N--CA 1.444 -0.775 0 N-CA-C 110.299 -1.12 . . . . 0.0 110.299 -163.643 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 1.4 m80 -134.02 56.22 1.86 Allowed 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 128.497 2.719 . . . . 0.0 106.369 170.691 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.67 ' HD3' ' HB3' ' A' ' 77' ' ' ALA . 48.5 mttt -142.59 -176.72 4.97 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 126.544 1.938 . . . . 0.0 107.881 -166.336 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -67.85 -75.24 0.1 Allowed 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 119.202 0.91 . . . . 0.0 109.364 177.844 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -125.75 -49.43 1.62 Allowed 'General case' 0 CA--C 1.516 -0.344 0 C-N-CA 124.873 1.269 . . . . 0.0 111.083 -179.015 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -142.63 162.18 27.37 Favored Glycine 0 N--CA 1.446 -0.684 0 N-CA-C 108.374 -1.89 . . . . 0.0 108.374 179.448 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.67 ' HB3' ' HD3' ' A' ' 73' ' ' LYS . . . 174.02 160.99 0.33 Allowed Pre-proline 0 CA--C 1.537 0.463 0 C-N-CA 126.576 1.951 . . . . 0.0 109.922 164.351 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . 0.528 ' HD2' ' HB1' ' A' ' 77' ' ' ALA . 86.5 Cg_endo -71.83 -176.59 2.12 Favored 'Trans proline' 0 CA--C 1.536 0.576 0 C-N-CA 124.535 3.49 . . . . 0.0 112.528 177.586 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 38.0 m -45.37 114.35 0.73 Allowed 'General case' 0 C--O 1.242 0.677 0 C-N-CA 125.114 1.365 . . . . 0.0 109.133 162.874 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 9.0 tmtt? -134.47 28.13 3.69 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 126.377 1.871 . . . . 0.0 107.664 -174.614 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 23.5 tt0 67.59 134.55 0.03 OUTLIER 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 127.821 2.448 . . . . 0.0 110.078 -168.943 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 95.24 -0.72 64.08 Favored Glycine 0 N--CA 1.466 0.68 0 O-C-N 120.91 -1.119 . . . . 0.0 112.485 159.344 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -149.84 16.61 0.87 Allowed 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 126.655 1.982 . . . . 0.0 108.994 172.108 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -59.88 132.76 54.94 Favored 'General case' 0 C--O 1.232 0.144 0 O-C-N 120.954 -1.091 . . . . 0.0 108.948 -172.004 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 50.39 18.66 0.46 Allowed 'General case' 0 CA--C 1.545 0.757 0 N-CA-C 114.386 1.254 . . . . 0.0 114.386 -177.262 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 72.0 mmtt 47.66 56.38 7.18 Favored 'General case' 0 N--CA 1.461 0.099 0 C-N-CA 124.734 1.214 . . . . 0.0 110.526 -171.264 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.23 97.91 0.1 Allowed 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 108.326 -0.99 . . . . 0.0 108.326 154.709 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 25.6 ttmt -114.51 129.01 56.63 Favored 'General case' 0 N--CA 1.464 0.271 0 N-CA-C 107.064 -1.458 . . . . 0.0 107.064 -178.037 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 27.4 m170 -131.61 162.37 30.5 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 123.236 0.614 . . . . 0.0 110.469 178.411 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 8.0 ttpp -97.09 119.49 35.67 Favored 'General case' 0 CA--C 1.515 -0.368 0 N-CA-C 106.803 -1.554 . . . . 0.0 106.803 175.296 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 3.3 p -130.51 152.86 49.43 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 108.049 -1.093 . . . . 0.0 108.049 168.982 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 27.6 mttm . . . . . 0 C--O 1.248 0.989 0 N-CA-C 105.524 -2.028 . . . . 0.0 105.524 -151.921 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.268 0 N-CA-C 110.485 -1.046 . . . . 0.0 110.485 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 77.8 m80 -143.58 105.52 4.36 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 118.41 1.105 . . . . 0.0 109.758 -178.913 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 78.7 mtm -141.72 144.1 33.87 Favored 'General case' 0 C--N 1.333 -0.123 0 C-N-CA 124.085 0.954 . . . . 0.0 108.674 165.876 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 8.3 mt-30 44.68 74.38 0.13 Allowed 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 128.092 2.557 . . . . 0.0 112.672 179.193 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 27.1 tt0 -64.64 -12.41 45.68 Favored 'General case' 0 CA--C 1.55 0.955 0 O-C-N 121.565 -0.709 . . . . 0.0 112.819 179.131 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 18.9 m 48.67 81.89 0.05 OUTLIER 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 126.732 2.013 . . . . 0.0 112.8 162.733 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 32.3 p90 -122.29 115.08 21.71 Favored 'General case' 0 N--CA 1.45 -0.443 0 O-C-N 121.347 -0.846 . . . . 0.0 110.755 -157.363 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 89.5 p -152.49 -31.01 0.14 Allowed 'General case' 0 C--N 1.326 -0.43 0 C-N-CA 124.407 1.083 . . . . 0.0 111.302 174.474 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -66.0 -172.76 0.15 Allowed 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.767 1.627 . . . . 0.0 111.473 173.79 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 49.9 m-85 -95.0 161.11 29.38 Favored Pre-proline 0 CA--C 1.547 0.837 0 O-C-N 121.267 -0.895 . . . . 0.0 112.579 -170.532 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -69.08 -176.51 1.32 Allowed 'Trans proline' 0 CA--C 1.539 0.742 0 C-N-CA 124.672 3.582 . . . . 0.0 110.699 164.336 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 45.9 t -107.89 86.79 3.26 Favored Pre-proline 0 CA--C 1.541 0.625 0 C-N-CA 125.612 1.565 . . . . 0.0 109.351 -178.881 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 94.3 Cg_endo -67.76 154.81 72.17 Favored 'Trans proline' 0 C--N 1.348 0.523 0 C-N-CA 123.276 2.651 . . . . 0.0 111.772 175.513 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -127.13 129.17 47.41 Favored 'General case' 0 N--CA 1.433 -1.277 0 C-N-CA 126.003 1.721 . . . . 0.0 109.723 -175.254 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 11.8 p -60.03 -24.44 30.02 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 O-C-N 121.776 -0.577 . . . . 0.0 111.41 173.452 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -49.84 -53.73 23.74 Favored 'General case' 0 N--CA 1.438 -1.044 0 C-N-CA 125.818 1.647 . . . . 0.0 112.213 173.507 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 4.4 t -77.91 -4.22 45.71 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-O 117.897 -1.049 . . . . 0.0 112.716 -178.985 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 11.9 m-30 -64.6 156.51 29.75 Favored 'General case' 0 C--O 1.238 0.479 0 CA-C-N 121.412 1.915 . . . . 0.0 111.018 178.888 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 63.0 mt-30 -92.74 121.67 34.37 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 124.332 1.053 . . . . 0.0 108.219 169.148 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 33.8 t80 -63.28 158.67 19.64 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 118.653 0.661 . . . . 0.0 110.639 163.085 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -135.32 108.05 7.49 Favored 'General case' 0 CA--C 1.513 -0.465 0 C-N-CA 123.992 0.917 . . . . 0.0 109.375 160.158 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 1.9 pt-20 -61.34 -25.24 67.01 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 124.636 1.174 . . . . 0.0 112.675 177.912 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 1.4 t -62.73 -50.46 71.0 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 119.388 0.995 . . . . 0.0 109.587 -177.245 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 74.2 m -78.03 -47.76 17.69 Favored 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 124.651 1.18 . . . . 0.0 109.315 173.671 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 102.43 13.51 30.36 Favored Glycine 0 CA--C 1.53 1.027 0 C-N-CA 125.153 1.359 . . . . 0.0 111.004 -168.834 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 3.8 m-85 -111.53 178.28 4.38 Favored 'General case' 0 C--O 1.227 -0.129 0 C-N-CA 126.713 2.005 . . . . 0.0 109.347 -168.635 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 72.1 m-85 -117.13 156.28 27.89 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 108.521 -0.918 . . . . 0.0 108.521 170.889 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 42.3 t80 -114.33 134.95 54.6 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 127.213 2.205 . . . . 0.0 108.78 175.866 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 56.3 t0 -98.56 87.13 0.54 Allowed Pre-proline 0 C--O 1.237 0.404 0 C-N-CA 127.366 2.266 . . . . 0.0 110.381 -178.593 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 61.7 Cg_endo -62.28 -8.55 12.7 Favored 'Trans proline' 0 N--CA 1.457 -0.671 0 C-N-CA 122.085 1.857 . . . . 0.0 114.254 -178.565 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -74.14 -28.2 61.21 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 119.473 1.033 . . . . 0.0 110.703 178.907 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.593 HG21 ' CE2' ' A' ' 61' ' ' TYR . 0.1 OUTLIER -142.35 -22.78 0.68 Allowed 'General case' 0 C--O 1.238 0.48 0 C-N-CA 124.238 1.015 . . . . 0.0 113.317 -164.901 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 103.0 -3.41 48.32 Favored Glycine 0 N--CA 1.444 -0.784 0 C-N-CA 125.091 1.329 . . . . 0.0 112.841 169.593 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.512 HD21 ' HB ' ' A' ' 32' ' ' THR . 0.0 OUTLIER -74.86 173.86 10.02 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 118.807 1.304 . . . . 0.0 108.298 -178.721 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 37.2 m-85 -107.14 165.05 11.65 Favored 'General case' 0 C--N 1.321 -0.639 0 C-N-CA 124.389 1.075 . . . . 0.0 108.609 162.509 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 71.2 t80 -144.0 144.69 31.78 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 126.618 1.967 . . . . 0.0 108.092 -172.672 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -113.26 143.08 28.57 Favored Pre-proline 0 C--O 1.236 0.378 0 C-N-CA 124.952 1.301 . . . . 0.0 108.513 175.706 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 91.2 Cg_endo -77.64 -29.33 4.66 Favored 'Trans proline' 0 N--CA 1.456 -0.729 0 C-N-CA 121.917 1.744 . . . . 0.0 112.423 -178.519 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -73.97 -34.6 64.32 Favored 'General case' 0 C--O 1.234 0.279 0 C-N-CA 123.983 0.913 . . . . 0.0 110.734 174.488 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 1.1 m -131.64 93.5 3.34 Favored 'General case' 0 C--O 1.222 -0.381 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 -157.471 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 8.2 mp0 -64.88 6.68 0.21 Allowed 'General case' 0 CA--C 1.549 0.922 0 O-C-N 121.083 -1.011 . . . . 0.0 113.487 -178.013 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 24.3 m-85 -77.13 104.42 7.62 Favored 'General case' 0 C--O 1.235 0.333 0 O-C-N 120.626 -1.296 . . . . 0.0 108.668 166.893 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 29.0 m-85 -64.3 162.89 13.94 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 126.955 2.102 . . . . 0.0 110.784 179.727 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 64.2 t80 -120.25 110.25 16.36 Favored 'General case' 0 CA--C 1.521 -0.143 0 C-N-CA 125.934 1.694 . . . . 0.0 109.038 179.19 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 41.9 t30 -85.29 86.6 7.36 Favored 'General case' 0 C--N 1.32 -0.716 0 C-N-CA 125.082 1.353 . . . . 0.0 109.142 175.985 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -58.37 -15.55 11.07 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 125.401 1.48 . . . . 0.0 114.049 -176.356 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -54.63 -76.5 0.03 OUTLIER 'General case' 0 CA--C 1.528 0.111 0 C-N-CA 125.027 1.331 . . . . 0.0 108.923 170.475 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 10.3 m -94.59 13.69 23.35 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.243 0.617 . . . . 0.0 110.624 -174.342 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 49.4 mt-30 56.28 24.61 8.41 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 127.3 2.24 . . . . 0.0 112.802 -173.049 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -92.75 166.84 12.25 Favored 'General case' 0 CA--C 1.532 0.285 0 O-C-N 121.269 -0.894 . . . . 0.0 111.629 -167.103 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 4.8 m-85 -109.79 138.64 45.87 Favored 'General case' 0 N--CA 1.467 0.401 0 O-C-N 121.4 -0.812 . . . . 0.0 109.117 -179.996 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.42 HD23 ' HA ' ' A' ' 63' ' ' PRO . 32.8 mt -134.48 179.69 6.13 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 124.82 1.248 . . . . 0.0 110.294 -177.172 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 14.1 p90 -145.75 154.35 41.95 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 124.545 1.138 . . . . 0.0 109.113 161.019 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 53.7 t-105 -80.43 120.26 24.21 Favored 'General case' 0 C--O 1.24 0.558 0 N-CA-C 107.181 -1.415 . . . . 0.0 107.181 167.714 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 42.3 t0 -114.76 95.36 5.19 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 123.926 0.89 . . . . 0.0 108.975 174.552 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -66.67 -15.94 64.96 Favored Glycine 0 N--CA 1.444 -0.796 0 CA-C-O 117.492 -1.727 . . . . 0.0 112.564 174.244 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -64.54 -23.83 67.4 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 120.681 2.24 . . . . 0.0 109.551 171.324 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 4.5 mtt-85 -120.11 -2.3 10.22 Favored 'General case' 0 C--O 1.233 0.208 0 C-N-CA 126.062 1.745 . . . . 0.0 112.677 -177.537 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 81.3 mtp180 44.07 50.28 7.38 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 125.643 1.577 . . . . 0.0 110.607 -171.919 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 4.9 t -151.31 174.85 12.81 Favored 'General case' 0 N--CA 1.45 -0.437 0 O-C-N 121.691 -0.631 . . . . 0.0 110.49 179.399 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . 0.593 ' CE2' HG21 ' A' ' 32' ' ' THR . 97.4 m-85 -100.11 135.23 41.84 Favored 'General case' 0 C--O 1.238 0.467 0 N-CA-C 108.547 -0.909 . . . . 0.0 108.547 171.181 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -126.06 153.81 74.02 Favored Pre-proline 0 C--N 1.321 -0.645 0 C-N-CA 125.081 1.353 . . . . 0.0 107.431 -178.86 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.42 ' HA ' HD23 ' A' ' 52' ' ' LEU . 88.2 Cg_endo -84.43 131.28 4.76 Favored 'Trans proline' 0 N--CA 1.457 -0.672 0 C-N-CA 122.257 1.971 . . . . 0.0 109.99 -177.591 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -92.48 16.74 11.23 Favored 'General case' 0 N--CA 1.469 0.497 0 N-CA-C 115.87 1.804 . . . . 0.0 115.87 -167.08 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.454 ' CD2' ' H ' ' A' ' 65' ' ' LEU . 1.2 pt? -72.33 161.14 31.25 Favored 'General case' 0 C--O 1.238 0.488 0 N-CA-C 112.21 0.448 . . . . 0.0 112.21 175.766 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . 0.28 41.5 mt-10 68.04 -57.41 0.47 Allowed 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 129.714 3.206 . . . . 0.0 112.767 163.997 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? 65.59 -163.12 0.25 Allowed 'General case' 0 CA--C 1.545 0.761 0 N-CA-C 108.165 -1.05 . . . . 0.0 108.165 177.445 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 63.9 m 64.88 4.13 2.33 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 117.944 2.572 . . . . 0.0 117.944 162.97 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 54.01 44.6 29.09 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 126.576 1.951 . . . . 0.0 111.938 179.477 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 14.0 p30 -103.04 -32.53 9.66 Favored 'General case' 0 C--O 1.237 0.429 0 C-N-CA 127.604 2.361 . . . . 0.0 113.715 -171.585 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 79.74 -61.72 4.24 Favored Glycine 0 N--CA 1.443 -0.852 0 C-N-CA 126.06 1.79 . . . . 0.0 113.889 178.099 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 30.4 m170 -154.03 34.55 0.43 Allowed 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 125.909 1.684 . . . . 0.0 109.112 -170.034 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 33.4 mtmm -140.96 122.68 15.26 Favored 'General case' 0 CA--C 1.52 -0.179 0 O-C-N 120.973 -1.08 . . . . 0.0 108.225 -165.564 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . 0.641 ' HG2' ' HB2' ' A' ' 77' ' ' ALA . 4.7 tp10 75.55 -39.82 0.4 Allowed 'General case' 0 CA--C 1.486 -1.502 0 C-N-CA 130.428 3.491 . . . . 0.0 113.108 -177.642 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 65.71 -1.33 1.07 Allowed 'General case' 0 N--CA 1.428 -1.547 0 O-C-N 124.6 1.187 . . . . 0.0 112.775 -176.54 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 161.72 78.86 0.03 OUTLIER Glycine 0 N--CA 1.445 -0.717 0 C-N-CA 120.344 -0.931 . . . . 0.0 112.89 -164.375 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.641 ' HB2' ' HG2' ' A' ' 74' ' ' GLU . . . -109.43 161.66 23.14 Favored Pre-proline 0 CA--C 1.537 0.444 0 CA-C-N 117.977 0.888 . . . . 0.0 109.6 157.659 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_endo -62.2 111.43 1.26 Allowed 'Trans proline' 0 N--CA 1.455 -0.741 0 C-N-CA 123.363 2.708 . . . . 0.0 110.281 172.892 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 36.1 t -156.5 124.17 5.49 Favored 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 127.642 2.377 . . . . 0.0 104.675 168.621 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -153.02 43.08 0.62 Allowed 'General case' 0 C--O 1.231 0.127 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 171.437 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 50.6 tt0 49.07 94.88 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 128.524 2.73 . . . . 0.0 111.978 -174.189 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 98.38 36.53 4.59 Favored Glycine 0 CA--C 1.528 0.883 0 O-C-N 120.86 -1.15 . . . . 0.0 112.648 -171.173 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 176.51 50.35 0.0 OUTLIER 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 129.8 3.24 . . . . 0.0 108.309 173.941 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 1.6 pt-20 -126.71 -179.89 5.02 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.305 1.042 . . . . 0.0 111.395 178.892 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 27.2 mmmt -73.51 34.1 0.08 Allowed 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 126.337 1.855 . . . . 0.0 112.999 169.945 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 4.4 ptpt 47.38 27.5 0.92 Allowed 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 128.316 2.646 . . . . 0.0 115.102 -178.008 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 17.7 tt0 -91.9 37.28 0.97 Allowed 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 126.605 1.962 . . . . 0.0 113.169 -158.14 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 5.6 ptmt -111.57 8.64 21.02 Favored 'General case' 0 N--CA 1.47 0.551 0 O-C-N 120.192 -1.567 . . . . 0.0 113.511 -174.61 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 66.8 m80 -91.73 88.16 6.58 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 119.381 0.991 . . . . 0.0 110.587 -168.364 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 62.0 pttt -157.14 148.1 21.7 Favored 'General case' 0 C--O 1.232 0.145 0 C-N-CA 123.581 0.752 . . . . 0.0 110.445 167.664 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -152.35 -169.48 3.36 Favored 'General case' 0 C--O 1.238 0.498 0 C-N-CA 125.634 1.573 . . . . 0.0 107.584 179.022 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 11.1 tmtt? . . . . . 0 C--O 1.242 0.658 0 N-CA-C 105.11 -2.182 . . . . 0.0 105.11 165.951 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.609 0 N-CA-C 109.536 -1.426 . . . . 0.0 109.536 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 25.7 m-70 44.66 45.74 8.15 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 126.702 2.001 . . . . 0.0 112.722 177.748 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 39.5 mtm -94.49 -170.74 2.32 Favored 'General case' 0 CA--C 1.536 0.438 0 N-CA-C 107.773 -1.195 . . . . 0.0 107.773 166.211 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 87.7 mm-40 -80.2 111.78 16.9 Favored 'General case' 0 C--N 1.331 -0.235 0 O-C-N 120.985 -1.072 . . . . 0.0 108.451 166.104 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -115.32 -26.44 7.6 Favored 'General case' 0 N--CA 1.469 0.486 0 N-CA-C 114.1 1.148 . . . . 0.0 114.1 179.231 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 75.5 m 49.01 76.65 0.12 Allowed 'General case' 0 CA--C 1.541 0.597 0 CA-C-N 119.574 1.079 . . . . 0.0 111.511 -167.673 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -135.43 166.88 22.15 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 126.098 1.759 . . . . 0.0 108.017 173.922 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 13.7 m 58.13 60.24 2.76 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 125.377 1.471 . . . . 0.0 112.091 -178.876 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 1.1 mm100 -67.2 -24.73 65.88 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 126.385 1.874 . . . . 0.0 114.455 178.55 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 27.6 m-85 -133.3 164.84 41.14 Favored Pre-proline 0 CA--C 1.54 0.586 0 C-N-CA 126.027 1.731 . . . . 0.0 110.163 -179.166 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -72.19 -173.12 1.01 Allowed 'Trans proline' 0 CA--C 1.534 0.482 0 C-N-CA 124.4 3.4 . . . . 0.0 110.415 166.82 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 61.1 t -113.56 85.66 9.38 Favored Pre-proline 0 CA--C 1.539 0.55 0 N-CA-C 106.204 -1.776 . . . . 0.0 106.204 172.739 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 69.7 Cg_endo -72.86 161.85 42.62 Favored 'Trans proline' 0 CA--C 1.539 0.751 0 C-N-CA 122.399 2.066 . . . . 0.0 110.572 -177.816 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -136.13 137.14 40.69 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 123.773 0.829 . . . . 0.0 110.627 -175.161 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.457 ' HA ' ' CD2' ' A' ' 18' ' ' TYR . 11.9 p -61.2 -22.01 26.21 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.664 0 N-CA-C 112.992 0.738 . . . . 0.0 112.992 179.479 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 3.0 t -68.98 8.35 0.55 Allowed 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 125.145 1.378 . . . . 0.0 112.586 171.748 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.3 t -126.3 4.85 7.02 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 120.598 1.545 . . . . 0.0 111.358 169.174 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.457 ' CD2' ' HA ' ' A' ' 15' ' ' VAL . 16.0 m-30 -82.78 150.49 26.61 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 118.921 0.782 . . . . 0.0 109.719 179.768 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.425 HE21 ' HG3' ' A' ' 30' ' ' PRO . 71.8 mt-30 -95.42 103.92 15.8 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 127.17 2.188 . . . . 0.0 111.035 177.477 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 88.0 t80 -58.12 151.48 18.85 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 120.271 1.396 . . . . 0.0 110.376 -179.991 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -129.61 93.58 3.57 Favored 'General case' 0 CA--C 1.516 -0.354 0 N-CA-C 106.091 -1.818 . . . . 0.0 106.091 177.345 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 1.9 pt-20 -51.99 -33.09 36.52 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-O 118.528 -0.748 . . . . 0.0 112.291 176.487 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 1.3 t -68.82 -5.68 22.32 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 123.297 0.639 . . . . 0.0 111.645 -174.408 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 50.7 m -137.1 -12.91 1.64 Allowed 'General case' 0 CA--C 1.53 0.204 0 O-C-N 120.185 -1.572 . . . . 0.0 112.463 167.874 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 88.39 18.77 54.59 Favored Glycine 0 C--N 1.338 0.64 0 CA-C-N 118.983 0.81 . . . . 0.0 112.124 169.936 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 7.1 m-85 -125.04 175.16 7.53 Favored 'General case' 0 C--N 1.332 -0.195 0 C-N-CA 126.88 2.072 . . . . 0.0 108.122 -171.725 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 58.8 m-85 -99.26 135.35 40.8 Favored 'General case' 0 N--CA 1.448 -0.529 0 N-CA-C 106.892 -1.522 . . . . 0.0 106.892 176.114 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 25.3 t80 -99.41 141.24 32.46 Favored 'General case' 0 C--O 1.238 0.472 0 N-CA-C 107.047 -1.464 . . . . 0.0 107.047 168.026 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 29.5 m-20 -118.45 76.44 12.96 Favored Pre-proline 0 CA--C 1.535 0.389 0 N-CA-C 108.935 -0.765 . . . . 0.0 108.935 -159.088 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.425 ' HG3' HE21 ' A' ' 19' ' ' GLN . 54.3 Cg_endo -65.05 -10.64 26.36 Favored 'Trans proline' 0 CA--C 1.534 0.486 0 C-N-CA 124.326 3.35 . . . . 0.0 114.722 -167.644 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 33.7 tt0 -76.58 -25.73 54.29 Favored 'General case' 0 CA--C 1.537 0.474 0 O-C-N 121.504 -0.747 . . . . 0.0 110.979 175.985 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.599 ' HB ' HD23 ' A' ' 34' ' ' LEU . 0.8 OUTLIER -136.34 -26.32 1.13 Allowed 'General case' 0 C--O 1.234 0.278 0 C-N-CA 124.215 1.006 . . . . 0.0 112.495 -165.642 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 108.12 -3.77 33.5 Favored Glycine 0 CA--C 1.527 0.811 0 C-N-CA 124.069 0.843 . . . . 0.0 115.074 169.924 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.599 HD23 ' HB ' ' A' ' 32' ' ' THR . 0.9 OUTLIER -84.36 -177.11 6.54 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 126.591 1.957 . . . . 0.0 109.975 -172.739 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 25.0 m-85 -115.95 139.04 50.63 Favored 'General case' 0 C--O 1.238 0.459 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 155.569 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 62.4 t80 -104.25 154.43 19.79 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 125.426 1.49 . . . . 0.0 108.246 178.911 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 37.0 t70 -127.4 143.57 47.76 Favored Pre-proline 0 N--CA 1.467 0.388 0 N-CA-C 112.157 0.428 . . . . 0.0 112.157 167.184 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -67.61 -31.01 34.16 Favored 'Trans proline' 0 N--CA 1.455 -0.771 0 C-N-CA 122.953 2.435 . . . . 0.0 114.205 -179.555 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 4.2 m-80 -87.19 -17.57 32.36 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 119.58 1.082 . . . . 0.0 111.626 172.692 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -138.85 81.57 1.85 Allowed 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 -162.52 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -60.5 5.91 0.04 OUTLIER 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.146 1.378 . . . . 0.0 113.709 177.171 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 24.3 m-85 -75.64 93.56 3.08 Favored 'General case' 0 N--CA 1.444 -0.74 0 C-N-CA 125.302 1.441 . . . . 0.0 107.766 171.598 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 43.8 m-85 -58.54 123.97 18.07 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 124.378 1.071 . . . . 0.0 108.675 -179.74 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 8.0 t80 -86.22 108.22 18.27 Favored 'General case' 0 N--CA 1.447 -0.609 0 C-N-CA 125.243 1.417 . . . . 0.0 107.219 -176.65 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 33.6 t30 -82.62 79.42 9.04 Favored 'General case' 0 N--CA 1.446 -0.655 0 N-CA-C 107.997 -1.112 . . . . 0.0 107.997 171.326 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -53.28 -33.12 51.92 Favored 'General case' 0 C--N 1.341 0.213 0 C-N-CA 123.553 0.741 . . . . 0.0 112.129 -178.783 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -44.3 -62.23 1.24 Allowed 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 128.261 2.625 . . . . 0.0 109.904 177.379 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.1 t -106.97 11.22 30.05 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.634 1.173 . . . . 0.0 110.578 -175.233 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 34.0 mt-30 46.98 40.81 9.98 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 127.011 2.125 . . . . 0.0 110.67 -176.433 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 17.4 mm-40 -103.95 159.73 15.41 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 126.238 1.815 . . . . 0.0 109.017 174.66 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -112.09 129.42 56.23 Favored 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 106.679 -1.6 . . . . 0.0 106.679 170.987 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.445 HD12 HD11 ' A' ' 34' ' ' LEU . 50.8 mt -118.4 177.51 4.79 Favored 'General case' 0 N--CA 1.442 -0.875 0 C-N-CA 126.124 1.769 . . . . 0.0 107.352 -179.748 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 14.0 p90 -141.71 154.2 45.15 Favored 'General case' 0 N--CA 1.441 -0.889 0 N-CA-C 106.786 -1.561 . . . . 0.0 106.786 158.751 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 20.3 t-105 -76.22 136.78 39.71 Favored 'General case' 0 N--CA 1.445 -0.687 0 N-CA-C 106.195 -1.78 . . . . 0.0 106.195 169.453 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 6.6 t0 -131.92 99.43 4.75 Favored 'General case' 0 CA--C 1.507 -0.695 0 CA-C-O 122.442 1.115 . . . . 0.0 109.719 175.102 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -65.89 -8.26 40.6 Favored Glycine 0 N--CA 1.442 -0.913 0 CA-C-O 117.256 -1.858 . . . . 0.0 113.221 -174.449 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.464 ' HG3' ' H ' ' A' ' 58' ' ' ARG . 1.8 pt-20 -72.67 -64.82 0.88 Allowed 'General case' 0 C--N 1.338 0.108 0 CA-C-N 120.363 2.082 . . . . 0.0 107.47 177.342 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . 0.464 ' H ' ' HG3' ' A' ' 57' ' ' GLU . 82.3 mtt180 -74.85 -7.12 52.5 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 125.181 1.392 . . . . 0.0 111.817 179.059 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 90.5 mtt180 44.79 56.25 5.39 Favored 'General case' 0 C--O 1.231 0.128 0 C-N-CA 126.51 1.924 . . . . 0.0 110.55 -172.595 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 7.4 t -146.62 164.0 34.05 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 109.217 -0.66 . . . . 0.0 109.217 167.781 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 27.4 m-85 -81.66 135.93 35.52 Favored 'General case' 0 C--O 1.237 0.426 0 N-CA-C 107.216 -1.402 . . . . 0.0 107.216 166.877 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -126.01 154.77 73.93 Favored Pre-proline 0 C--N 1.323 -0.587 0 C-N-CA 125.806 1.642 . . . . 0.0 108.863 176.585 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -67.98 135.67 35.75 Favored 'Trans proline' 0 N--CA 1.451 -1.012 0 C-N-CA 121.949 1.766 . . . . 0.0 109.715 171.791 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -97.57 23.14 8.05 Favored 'General case' 0 N--CA 1.463 0.187 0 C-N-CA 124.154 0.982 . . . . 0.0 112.698 -178.316 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -54.02 -9.04 0.22 Allowed 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 127.164 2.186 . . . . 0.0 116.403 -174.602 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -145.77 -77.74 0.19 Allowed 'General case' 0 N--CA 1.441 -0.906 0 N-CA-C 104.865 -2.272 . . . . 0.0 104.865 -174.892 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 5.3 tm0? 56.95 12.65 1.25 Allowed 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 125.658 1.583 . . . . 0.0 113.381 178.439 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 22.0 m -153.89 99.87 2.31 Favored 'General case' 0 C--O 1.239 0.522 0 O-C-N 119.939 -1.726 . . . . 0.0 106.936 172.092 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -87.83 71.92 9.46 Favored 'General case' 0 N--CA 1.464 0.241 0 N-CA-C 108.498 -0.927 . . . . 0.0 108.498 179.96 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 75.7 m-20 -123.49 18.8 9.67 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 125.478 1.511 . . . . 0.0 109.706 -175.935 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -117.28 -17.67 5.66 Favored Glycine 0 CA--C 1.528 0.866 0 CA-C-O 117.192 -1.893 . . . . 0.0 114.759 -164.826 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 63.1 m80 48.83 40.01 15.41 Favored 'General case' 0 CA--C 1.545 0.773 0 CA-C-N 119.682 1.741 . . . . 0.0 114.58 175.053 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 37.0 mttt -143.18 -166.74 2.38 Favored 'General case' 0 N--CA 1.472 0.63 0 O-C-N 120.724 -1.235 . . . . 0.0 109.424 -178.297 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 14.9 mm-40 -70.64 164.99 23.82 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 123.68 0.792 . . . . 0.0 110.368 164.94 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -49.08 -44.87 42.41 Favored 'General case' 0 N--CA 1.451 -0.425 0 C-N-CA 126.371 1.868 . . . . 0.0 109.891 168.509 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -138.35 -107.08 0.76 Allowed Glycine 0 N--CA 1.446 -0.642 0 N-CA-C 109.438 -1.465 . . . . 0.0 109.438 179.029 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . 55.34 159.98 0.06 OUTLIER Pre-proline 0 CA--C 1.548 0.873 0 C-N-CA 127.131 2.172 . . . . 0.0 112.907 -167.197 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 64.8 Cg_endo -69.43 173.6 10.44 Favored 'Trans proline' 0 CA--C 1.54 0.818 0 C-N-CA 122.705 2.27 . . . . 0.0 111.164 169.285 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 52.9 p -161.19 -177.82 6.31 Favored 'General case' 0 CA--C 1.535 0.375 0 O-C-N 121.07 -1.019 . . . . 0.0 112.626 174.398 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 56.1 mttt 58.15 18.41 5.27 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 127.251 2.22 . . . . 0.0 113.925 161.677 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -145.32 21.62 1.53 Allowed 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.087 1.755 . . . . 0.0 109.543 -167.809 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 74.67 20.2 79.61 Favored Glycine 0 CA--C 1.534 1.248 0 O-C-N 120.451 -1.405 . . . . 0.0 111.321 -168.116 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 29.9 mmtp -122.51 -9.42 8.49 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 126.932 2.093 . . . . 0.0 110.971 -168.237 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -77.21 174.81 10.31 Favored 'General case' 0 N--CA 1.446 -0.63 0 C-N-CA 124.849 1.26 . . . . 0.0 109.859 -178.207 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 6.6 ptmt -65.4 30.12 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 125.564 1.546 . . . . 0.0 114.609 171.666 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 27.3 pttt 44.95 42.9 6.71 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 125.534 1.534 . . . . 0.0 111.686 -171.55 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 70.5 tt0 -69.73 -40.84 75.97 Favored 'General case' 0 C--O 1.235 0.305 0 O-C-N 121.378 -0.826 . . . . 0.0 109.1 176.763 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 1.4 ptpm? -139.83 176.54 8.66 Favored 'General case' 0 CA--C 1.528 0.122 0 C-N-CA 124.695 1.198 . . . . 0.0 110.09 176.099 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 22.1 t-80 -127.15 114.89 18.3 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 104.962 -2.236 . . . . 0.0 104.962 170.62 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 77.6 tttt -154.15 53.17 0.69 Allowed 'General case' 0 N--CA 1.462 0.168 0 N-CA-C 108.132 -1.062 . . . . 0.0 108.132 -178.727 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 2.2 p -147.8 91.15 1.91 Allowed 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 106.496 -1.668 . . . . 0.0 106.496 -166.647 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 2.5 tmtt? . . . . . 0 C--O 1.252 1.212 0 N-CA-C 102.803 -3.036 . . . . 0.0 102.803 166.842 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.462 0.374 0 N-CA-C 110.96 -0.856 . . . . 0.0 110.96 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 54.6 m-70 63.01 70.17 0.56 Allowed 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 127.631 2.372 . . . . 0.0 109.813 -167.272 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 53.2 mtt -132.1 156.72 45.84 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 124.973 1.309 . . . . 0.0 107.579 166.943 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 7.7 tp-100 -166.56 124.7 1.4 Allowed 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 104.415 -2.439 . . . . 0.0 104.415 172.24 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -150.67 -86.28 0.08 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 118.816 0.735 . . . . 0.0 109.117 -176.162 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 72.3 m -161.56 12.97 0.09 Allowed 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 125.02 1.328 . . . . 0.0 113.004 178.07 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 34.4 t80 -96.45 106.51 18.76 Favored 'General case' 0 C--O 1.234 0.255 0 C-N-CA 124.303 1.041 . . . . 0.0 108.51 -173.818 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 26.7 t -161.09 79.21 0.6 Allowed 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 115.134 -0.939 . . . . 0.0 109.25 -172.094 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 18.5 pm0 -70.78 -12.51 61.59 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 125.026 1.33 . . . . 0.0 113.662 178.661 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 51.7 m-85 -125.62 163.1 40.91 Favored Pre-proline 0 C--O 1.239 0.514 0 C-N-CA 124.131 0.972 . . . . 0.0 109.43 162.156 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -70.62 -175.12 1.25 Allowed 'Trans proline' 0 CA--C 1.537 0.646 0 C-N-CA 124.489 3.459 . . . . 0.0 111.239 167.277 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 38.8 t -104.97 88.12 2.21 Favored Pre-proline 0 CA--C 1.543 0.709 0 C-N-CA 125.991 1.717 . . . . 0.0 109.478 -178.744 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 19.8 Cg_endo -70.55 173.66 11.35 Favored 'Trans proline' 0 CA--C 1.546 1.079 0 C-N-CA 123.087 2.525 . . . . 0.0 110.856 173.549 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -156.62 133.61 10.4 Favored 'General case' 0 N--CA 1.468 0.439 0 O-C-N 121.272 -0.893 . . . . 0.0 110.053 171.932 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.439 ' HA ' ' CD2' ' A' ' 18' ' ' TYR . 12.5 p -54.24 -25.14 12.97 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.42 0 N-CA-C 113.604 0.964 . . . . 0.0 113.604 177.928 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 14.0 m -62.02 -14.07 32.08 Favored 'General case' 0 C--O 1.237 0.406 0 O-C-N 120.943 -1.098 . . . . 0.0 112.96 179.987 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 5.5 t -120.55 9.94 10.98 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 124.012 0.925 . . . . 0.0 111.85 176.187 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.439 ' CD2' ' HA ' ' A' ' 15' ' ' VAL . 17.0 m-30 -73.4 152.6 40.76 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-N 119.708 1.14 . . . . 0.0 109.719 168.858 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 51.6 mt-30 -87.38 115.58 24.9 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 108.529 -0.915 . . . . 0.0 108.529 174.236 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 85.4 t80 -66.32 147.89 52.65 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 118.224 0.465 . . . . 0.0 110.233 168.693 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -119.13 112.58 19.7 Favored 'General case' 0 N--CA 1.442 -0.871 0 C-N-CA 127.681 2.393 . . . . 0.0 106.517 177.829 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -81.6 -15.85 53.39 Favored 'General case' 0 CA--C 1.533 0.314 0 O-C-N 121.396 -0.815 . . . . 0.0 113.087 178.178 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 5.2 t -67.09 -31.77 72.49 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.533 1.133 . . . . 0.0 111.335 179.619 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 69.2 m -128.26 -26.16 2.86 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 119.883 1.22 . . . . 0.0 112.889 171.386 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 104.24 25.3 7.12 Favored Glycine 0 CA--C 1.527 0.806 0 CA-C-O 117.889 -1.506 . . . . 0.0 113.674 172.651 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 2.7 m-85 -110.91 -179.58 3.78 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 120.206 2.003 . . . . 0.0 108.821 -179.84 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 68.2 m-85 -120.88 123.35 42.33 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 124.636 1.174 . . . . 0.0 108.239 178.055 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 23.5 t80 -91.14 134.77 34.26 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 125.571 1.548 . . . . 0.0 110.76 -179.642 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 12.6 t0 -101.11 88.06 0.99 Allowed Pre-proline 0 CA--C 1.533 0.319 0 C-N-CA 128.034 2.534 . . . . 0.0 112.429 178.543 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -64.81 -6.84 13.33 Favored 'Trans proline' 0 CA--C 1.533 0.47 0 C-N-CA 121.656 1.571 . . . . 0.0 115.332 172.002 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 3.3 tm0? -64.92 -52.03 58.66 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 119.852 1.206 . . . . 0.0 108.297 176.032 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 77.7 p -99.97 -51.96 3.56 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-N 118.295 0.498 . . . . 0.0 111.081 174.461 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 125.98 5.82 6.13 Favored Glycine 0 CA--C 1.535 1.341 0 C-N-CA 126.818 2.151 . . . . 0.0 112.135 -166.257 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 84.5 mt -74.21 174.36 8.86 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 119.126 1.463 . . . . 0.0 110.935 176.476 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 27.0 m-85 -120.38 169.77 9.99 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 125.902 1.681 . . . . 0.0 108.294 161.604 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 28.3 t80 -145.52 153.57 41.26 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 128.913 2.885 . . . . 0.0 107.67 -174.935 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 8.9 t0 -121.32 142.51 35.42 Favored Pre-proline 0 CA--C 1.532 0.267 0 C-N-CA 124.968 1.307 . . . . 0.0 107.89 179.419 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -74.74 -32.95 5.37 Favored 'Trans proline' 0 N--CA 1.453 -0.887 0 C-N-CA 121.635 1.557 . . . . 0.0 115.279 -174.101 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -73.32 -35.6 66.08 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 120.508 1.503 . . . . 0.0 108.45 172.072 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 69.4 m -126.43 93.52 3.82 Favored 'General case' 0 N--CA 1.449 -0.494 0 C-N-CA 123.493 0.717 . . . . 0.0 110.246 -157.349 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 25.6 mp0 -55.72 -0.92 0.04 OUTLIER 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 127.34 2.256 . . . . 0.0 114.597 179.531 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 49.3 m-85 -70.9 106.19 3.53 Favored 'General case' 0 N--CA 1.442 -0.839 0 C-N-CA 125.595 1.558 . . . . 0.0 108.194 170.351 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 40.7 m-85 -65.75 153.82 40.72 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 125.613 1.565 . . . . 0.0 109.972 179.01 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 74.9 t80 -108.58 133.95 52.01 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 125.668 1.587 . . . . 0.0 107.983 175.41 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 43.1 t30 -110.8 73.9 0.85 Allowed 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 128.944 2.898 . . . . 0.0 109.619 -173.305 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -49.53 -26.4 3.44 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 125.651 1.58 . . . . 0.0 114.036 -172.014 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 3.1 tt0 -53.95 -31.18 49.62 Favored 'General case' 0 N--CA 1.446 -0.656 0 C-N-CA 128.989 2.915 . . . . 0.0 113.315 174.858 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 4.1 m -143.9 9.6 1.52 Allowed 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 124.894 1.277 . . . . 0.0 111.479 -168.537 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 52.0 mt-30 47.39 30.43 1.57 Allowed 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 126.415 1.886 . . . . 0.0 113.623 -173.907 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -104.22 161.48 14.0 Favored 'General case' 0 C--O 1.233 0.213 0 C-N-CA 125.083 1.353 . . . . 0.0 112.653 -175.995 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -103.26 134.86 45.95 Favored 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 124.7 1.2 . . . . 0.0 110.783 178.336 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 53.8 mt -133.34 179.8 5.98 Favored 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 125.943 1.697 . . . . 0.0 109.193 -177.091 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 14.1 p90 -148.52 155.21 40.85 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 125.103 1.361 . . . . 0.0 108.684 164.518 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 68.9 t-105 -77.42 119.29 20.83 Favored 'General case' 0 C--O 1.233 0.232 0 N-CA-C 107.333 -1.358 . . . . 0.0 107.333 167.878 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 39.7 t0 -98.68 94.44 6.64 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 107.88 -1.155 . . . . 0.0 107.88 167.505 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -62.7 -14.98 53.27 Favored Glycine 0 CA--C 1.531 1.091 0 CA-C-O 119.081 -0.844 . . . . 0.0 113.394 178.13 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -74.6 -17.29 60.74 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 119.228 1.514 . . . . 0.0 110.667 174.941 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 83.9 mtt85 -123.34 -4.49 8.35 Favored 'General case' 0 C--O 1.223 -0.299 0 C-N-CA 125.342 1.457 . . . . 0.0 111.799 178.711 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 97.2 mtt180 44.34 59.36 3.31 Favored 'General case' 0 C--O 1.233 0.209 0 C-N-CA 125.389 1.476 . . . . 0.0 110.335 -173.096 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 5.8 t -152.95 173.67 15.1 Favored 'General case' 0 N--CA 1.448 -0.551 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 177.681 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 82.2 m-85 -104.96 134.34 48.23 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 107.624 -1.25 . . . . 0.0 107.624 173.185 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -126.12 154.6 74.21 Favored Pre-proline 0 C--N 1.324 -0.527 0 C-N-CA 125.327 1.451 . . . . 0.0 109.492 -178.223 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -74.16 125.68 9.95 Favored 'Trans proline' 0 N--CA 1.458 -0.581 0 C-N-CA 123.413 2.742 . . . . 0.0 111.08 -178.916 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -85.43 14.61 5.26 Favored 'General case' 0 N--CA 1.463 0.187 0 N-CA-C 114.607 1.336 . . . . 0.0 114.607 -173.25 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -61.37 -33.91 74.44 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 125.068 1.347 . . . . 0.0 112.037 -167.514 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 31.0 mt-10 -101.58 -30.16 11.54 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-O 118.548 -0.739 . . . . 0.0 112.43 175.16 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . 0.269 1.7 pt20 44.02 30.22 0.4 Allowed 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 126.701 2.0 . . . . 0.0 115.173 -179.085 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 1.5 t 63.0 136.94 0.02 OUTLIER 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 127.465 2.306 . . . . 0.0 112.155 -176.753 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 54.54 -167.34 0.08 Allowed 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 124.943 1.297 . . . . 0.0 110.979 -165.902 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 15.9 t0 -147.28 169.07 20.18 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 107.471 -1.307 . . . . 0.0 107.471 -175.698 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 73.91 -68.74 1.6 Allowed Glycine 0 C--O 1.22 -0.764 0 C-N-CA 124.562 1.077 . . . . 0.0 111.869 179.021 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . 0.444 ' CE1' ' HE2' ' A' ' 83' ' ' LYS . 4.5 m-70 -65.06 -5.01 5.41 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 125.017 1.327 . . . . 0.0 113.936 179.702 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 34.2 pttt -58.22 123.1 14.88 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 107.181 -1.415 . . . . 0.0 107.181 164.469 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 87.3 mt-10 -72.06 -47.34 52.29 Favored 'General case' 0 CA--C 1.511 -0.542 0 N-CA-C 107.522 -1.288 . . . . 0.0 107.522 173.563 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER 57.53 -24.59 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 127.541 2.337 . . . . 0.0 114.306 -169.883 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 173.83 67.46 0.05 OUTLIER Glycine 0 CA--C 1.524 0.642 0 N-CA-C 106.64 -2.584 . . . . 0.0 106.64 -160.724 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -160.2 155.3 21.29 Favored Pre-proline 0 CA--C 1.538 0.51 0 C-N-CA 127.335 2.254 . . . . 0.0 107.27 170.604 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 12.2 Cg_endo -65.87 134.43 37.42 Favored 'Trans proline' 0 C--O 1.237 0.445 0 C-N-CA 122.509 2.14 . . . . 0.0 110.673 171.446 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 14.6 m -78.23 74.13 4.77 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 125.125 1.37 . . . . 0.0 110.888 179.242 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -143.77 -13.48 0.65 Allowed 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 125.447 1.499 . . . . 0.0 112.187 177.441 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 6.6 pt-20 -76.63 17.53 0.39 Allowed 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 125.731 1.612 . . . . 0.0 113.427 -171.609 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 76.67 4.97 82.63 Favored Glycine 0 CA--C 1.534 1.247 0 CA-C-O 122.328 0.96 . . . . 0.0 112.833 -178.039 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.444 ' HE2' ' CE1' ' A' ' 72' ' ' HIS . 92.7 mttt -110.46 9.34 23.31 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 125.015 1.326 . . . . 0.0 109.256 170.401 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -46.01 -51.98 12.62 Favored 'General case' 0 CA--C 1.517 -0.301 0 C-N-CA 129.214 3.005 . . . . 0.0 110.574 -166.932 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -141.7 41.29 1.71 Allowed 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 125.496 1.519 . . . . 0.0 108.331 179.103 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 19.6 mttt 45.33 73.39 0.16 Allowed 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 126.975 2.11 . . . . 0.0 113.257 167.31 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -62.63 5.88 0.11 Allowed 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 127.626 2.371 . . . . 0.0 115.516 176.647 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 24.6 mttt 56.86 88.15 0.05 Allowed 'General case' 0 N--CA 1.467 0.381 0 C-N-CA 126.363 1.865 . . . . 0.0 109.77 -171.133 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 35.2 t-80 -61.92 -31.21 71.51 Favored 'General case' 0 CA--C 1.535 0.372 0 O-C-N 121.792 -0.567 . . . . 0.0 111.478 178.713 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 43.7 pttt -136.35 162.56 32.68 Favored 'General case' 0 C--O 1.238 0.457 0 C-N-CA 124.721 1.209 . . . . 0.0 109.884 176.103 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 1.7 p -96.37 179.69 4.94 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 125.886 1.675 . . . . 0.0 110.377 172.569 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 6.4 ttpm? . . . . . 0 C--O 1.246 0.883 0 N-CA-C 105.507 -2.034 . . . . 0.0 105.507 157.213 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.564 0 N-CA-C 108.639 -1.784 . . . . 0.0 108.639 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 6.2 m170 56.73 -164.36 0.16 Allowed 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 124.333 1.053 . . . . 0.0 110.32 -174.509 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 2.5 mpt? -124.9 -65.42 1.03 Allowed 'General case' 0 N--CA 1.453 -0.317 0 N-CA-C 108.181 -1.044 . . . . 0.0 108.181 178.689 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 10.9 pt20 -150.05 137.4 19.73 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 124.203 1.001 . . . . 0.0 109.491 -172.709 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -65.01 -38.97 92.7 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 174.837 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 37.5 m 52.75 37.49 23.95 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 124.233 1.013 . . . . 0.0 111.189 -162.03 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER 58.16 -60.36 0.03 OUTLIER 'General case' 0 C--N 1.342 0.262 1 C-N-CA 133.984 4.914 . . . . 0.0 113.583 170.432 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 7.2 t 60.49 -0.11 0.29 Allowed 'General case' 0 N--CA 1.445 -0.724 0 C-N-CA 128.919 2.888 . . . . 0.0 114.232 177.861 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 15.7 mm100 -140.54 -169.8 2.86 Favored 'General case' 0 N--CA 1.445 -0.689 0 C-N-CA 126.72 2.008 . . . . 0.0 111.539 -163.058 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 82.0 m-85 -67.48 163.35 48.27 Favored Pre-proline 0 CA--C 1.543 0.706 0 C-N-CA 126.04 1.736 . . . . 0.0 110.865 178.39 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_endo -72.71 -167.44 0.34 Allowed 'Trans proline' 0 CA--C 1.536 0.578 0 C-N-CA 123.991 3.128 . . . . 0.0 109.891 166.255 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 43.2 t -106.99 86.5 2.43 Favored Pre-proline 0 CA--C 1.541 0.634 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 174.016 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 91.8 Cg_endo -65.08 164.6 24.51 Favored 'Trans proline' 0 CA--C 1.536 0.604 0 C-N-CA 123.577 2.852 . . . . 0.0 110.252 178.205 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -152.94 142.97 22.28 Favored 'General case' 0 N--CA 1.475 0.776 0 O-C-N 120.608 -1.307 . . . . 0.0 113.236 -179.64 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 14.4 p -60.13 -19.82 18.75 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.287 0 C-N-CA 124.906 1.282 . . . . 0.0 112.885 171.494 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.4 t -57.59 -5.59 0.38 Allowed 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 124.632 1.173 . . . . 0.0 113.079 170.267 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.4 t -137.11 12.67 3.07 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-N 119.617 1.099 . . . . 0.0 113.74 176.468 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 16.4 m-30 -72.42 164.18 26.78 Favored 'General case' 0 C--O 1.236 0.363 0 O-C-N 120.476 -1.39 . . . . 0.0 111.295 175.028 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 19.2 mt-30 -108.08 129.22 55.16 Favored 'General case' 0 CA--C 1.519 -0.217 0 C-N-CA 125.179 1.392 . . . . 0.0 108.794 169.726 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 49.8 t80 -77.94 150.71 33.97 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 118.357 0.526 . . . . 0.0 110.073 170.017 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -128.58 88.08 2.68 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 107.504 -1.295 . . . . 0.0 107.504 173.846 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.7 pt-20 -52.77 -19.89 2.8 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 127.831 2.452 . . . . 0.0 113.589 175.057 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 6.7 t -51.33 -36.72 44.15 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 124.137 0.975 . . . . 0.0 111.413 168.344 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 54.3 m -138.61 -8.07 1.46 Allowed 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 124.7 1.2 . . . . 0.0 113.834 -178.05 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 88.47 19.96 50.2 Favored Glycine 0 CA--C 1.528 0.859 0 O-C-N 120.198 -1.564 . . . . 0.0 113.723 167.798 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 32.7 m-85 -110.37 174.88 5.65 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 125.673 1.589 . . . . 0.0 109.381 -179.025 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 83.8 m-85 -120.56 151.45 39.4 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 124.675 1.19 . . . . 0.0 109.098 177.117 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 55.3 t80 -125.6 137.08 53.88 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 125.412 1.485 . . . . 0.0 110.715 -175.511 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -97.75 88.74 0.65 Allowed Pre-proline 0 N--CA 1.463 0.182 0 C-N-CA 128.088 2.555 . . . . 0.0 112.418 -179.817 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo -58.09 -10.51 8.2 Favored 'Trans proline' 0 CA--C 1.536 0.614 0 CA-C-N 121.19 1.461 . . . . 0.0 115.012 175.265 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -66.81 -41.55 87.38 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 120.058 1.299 . . . . 0.0 109.786 176.295 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 22.4 p -137.34 -11.09 1.66 Allowed 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 116.156 1.909 . . . . 0.0 116.156 -173.819 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 95.14 6.68 60.04 Favored Glycine 0 CA--C 1.528 0.904 0 O-C-N 121.21 -0.931 . . . . 0.0 113.329 171.921 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 15.2 mt -82.1 163.15 22.21 Favored 'General case' 0 C--O 1.237 0.426 0 CA-C-N 118.169 0.985 . . . . 0.0 109.196 174.901 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 57.6 m-85 -108.9 157.44 18.62 Favored 'General case' 0 C--O 1.234 0.274 0 C-N-CA 123.141 0.576 . . . . 0.0 109.954 171.07 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 56.0 t80 -127.93 151.37 49.19 Favored 'General case' 0 C--O 1.238 0.448 0 C-N-CA 128.918 2.887 . . . . 0.0 107.865 -178.995 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -130.14 144.02 51.47 Favored Pre-proline 0 C--N 1.331 -0.213 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 173.345 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -64.99 -24.43 60.28 Favored 'Trans proline' 0 N--CA 1.455 -0.769 0 C-N-CA 122.539 2.159 . . . . 0.0 114.038 -175.427 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 17.7 m-80 -104.07 -19.04 14.31 Favored 'General case' 0 C--O 1.237 0.417 0 C-N-CA 123.721 0.808 . . . . 0.0 112.002 176.527 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 33.6 t -120.77 84.52 2.24 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 125.278 1.431 . . . . 0.0 109.163 177.63 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 24.9 mp0 -58.61 -8.16 1.18 Allowed 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 124.459 1.104 . . . . 0.0 111.657 162.443 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 26.8 m-85 -70.3 99.56 1.57 Allowed 'General case' 0 N--CA 1.45 -0.452 0 N-CA-C 107.357 -1.349 . . . . 0.0 107.357 164.732 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 54.3 m-85 -59.92 146.4 42.43 Favored 'General case' 0 C--O 1.237 0.432 0 C-N-CA 125.877 1.671 . . . . 0.0 109.974 -174.722 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 73.9 t80 -96.81 118.77 33.97 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-O 122.417 1.103 . . . . 0.0 109.748 173.634 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . 0.59 HD22 ' HG2' ' A' ' 50' ' ' GLN . 17.2 t30 -88.07 79.57 7.92 Favored 'General case' 0 N--CA 1.443 -0.806 0 C-N-CA 127.108 2.163 . . . . 0.0 107.557 -179.273 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -53.64 -32.65 52.29 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 123.684 0.794 . . . . 0.0 111.034 177.652 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.7 tt0 -51.01 -28.09 9.26 Favored 'General case' 0 N--CA 1.449 -0.496 0 C-N-CA 127.454 2.302 . . . . 0.0 114.365 -176.8 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -144.95 4.75 1.12 Allowed 'General case' 0 CA--C 1.535 0.39 0 N-CA-C 112.697 0.629 . . . . 0.0 112.697 174.692 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 26.8 mt-30 68.16 60.68 0.41 Allowed 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 125.968 1.707 . . . . 0.0 109.997 -177.461 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.59 ' HG2' HD22 ' A' ' 45' ' ' ASN . 0.0 OUTLIER -124.89 168.18 13.64 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 125.929 1.692 . . . . 0.0 114.871 174.715 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 4.4 m-85 -107.14 149.82 27.25 Favored 'General case' 0 C--O 1.233 0.202 0 N-CA-C 107.898 -1.149 . . . . 0.0 107.898 162.246 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 90.9 mt -145.99 -176.78 5.28 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 127.279 2.232 . . . . 0.0 107.025 -178.607 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 4.4 p90 -127.68 179.81 5.33 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 125.165 1.386 . . . . 0.0 108.278 162.726 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 27.5 t-105 -105.08 135.71 45.91 Favored 'General case' 0 C--O 1.238 0.499 0 N-CA-C 105.055 -2.202 . . . . 0.0 105.055 160.685 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -124.01 115.97 22.08 Favored 'General case' 0 N--CA 1.446 -0.628 0 C-N-CA 124.742 1.217 . . . . 0.0 108.013 177.886 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -77.27 -15.93 81.04 Favored Glycine 0 N--CA 1.445 -0.758 0 CA-C-O 117.407 -1.774 . . . . 0.0 112.361 177.316 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -65.7 -47.85 74.0 Favored 'General case' 0 C--N 1.345 0.388 0 CA-C-N 121.308 2.554 . . . . 0.0 108.241 -177.167 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 5.4 mtt85 -102.19 5.0 39.98 Favored 'General case' 0 CA--C 1.529 0.149 0 C-N-CA 125.805 1.642 . . . . 0.0 111.293 -179.051 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 3.2 mtt180 44.78 60.34 2.97 Favored 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 126.601 1.96 . . . . 0.0 109.798 -178.174 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 5.5 t -149.85 173.05 14.19 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-O 121.763 0.792 . . . . 0.0 110.193 -168.551 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 82.2 m-85 -113.74 116.39 29.33 Favored 'General case' 0 C--O 1.234 0.283 0 C-N-CA 124.906 1.283 . . . . 0.0 108.246 172.802 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -125.58 158.98 62.86 Favored Pre-proline 0 C--N 1.327 -0.382 0 C-N-CA 126.831 2.052 . . . . 0.0 110.409 -168.941 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -72.89 124.14 9.44 Favored 'Trans proline' 0 N--CA 1.458 -0.602 0 C-N-CA 122.931 2.421 . . . . 0.0 111.924 -175.986 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -89.96 22.72 3.06 Favored 'General case' 0 N--CA 1.464 0.245 0 C-N-CA 123.737 0.815 . . . . 0.0 112.713 179.855 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 5.8 mp -79.08 -85.0 0.08 Allowed 'General case' 0 N--CA 1.45 -0.438 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 -172.257 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 64.0 mt-10 -75.9 -23.66 55.55 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 118.438 0.563 . . . . 0.0 110.166 167.775 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER 52.52 30.81 8.93 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 126.152 1.781 . . . . 0.0 112.614 -168.126 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 58.4 p -143.47 123.55 13.64 Favored 'General case' 0 C--O 1.24 0.562 0 O-C-N 121.063 -1.023 . . . . 0.0 109.943 165.582 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 55.36 -179.16 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 128.42 2.688 . . . . 0.0 114.625 176.125 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -93.87 75.37 4.21 Favored 'General case' 0 C--O 1.236 0.354 0 C-N-CA 125.474 1.51 . . . . 0.0 108.131 -172.232 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -78.61 -29.76 51.23 Favored Glycine 0 CA--C 1.525 0.661 0 CA-C-O 118.949 -0.917 . . . . 0.0 111.57 171.621 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 7.4 t-80 74.7 1.04 3.72 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 127.807 2.443 . . . . 0.0 113.481 170.728 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 39.6 mttm -110.28 175.74 5.32 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 126.664 1.986 . . . . 0.0 111.312 -165.362 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 14.9 mt-10 -99.88 178.81 4.71 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 124.702 1.201 . . . . 0.0 110.029 174.113 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -58.79 -44.53 90.76 Favored 'General case' 0 N--CA 1.463 0.191 0 C-N-CA 124.704 1.201 . . . . 0.0 111.317 178.116 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -143.23 151.44 23.23 Favored Glycine 0 N--CA 1.44 -1.042 0 N-CA-C 106.943 -2.463 . . . . 0.0 106.943 179.372 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -162.61 157.9 19.1 Favored Pre-proline 0 C--O 1.241 0.649 0 C-N-CA 125.333 1.453 . . . . 0.0 108.305 -164.814 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -75.31 168.46 24.57 Favored 'Trans proline' 0 N--CA 1.45 -1.085 0 C-N-CA 122.178 1.919 . . . . 0.0 109.636 173.691 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 22.0 m 69.14 -66.42 0.25 Allowed 'General case' 0 C--N 1.333 -0.117 0 CA-C-O 116.045 -1.931 . . . . 0.0 111.262 176.101 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 19.6 tttm -63.16 29.61 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 127.227 2.211 . . . . 0.0 113.808 178.984 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 6.9 tt0 -144.65 -4.13 0.78 Allowed 'General case' 0 CA--C 1.539 0.535 0 O-C-N 119.663 -1.898 . . . . 0.0 112.572 170.834 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 164.55 -46.05 0.3 Allowed Glycine 0 C--N 1.345 1.079 0 C-N-CA 118.781 -1.676 . . . . 0.0 116.45 -176.001 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 7.5 mtpm? -76.39 6.05 6.24 Favored 'General case' 0 C--O 1.219 -0.548 0 O-C-N 120.849 -1.383 . . . . 0.0 109.83 175.824 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 12.0 tt0 -44.82 -60.56 1.97 Allowed 'General case' 0 N--CA 1.443 -0.794 0 C-N-CA 130.535 3.534 . . . . 0.0 112.527 -167.98 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.26 -5.49 58.92 Favored 'General case' 0 C--N 1.331 -0.201 0 C-N-CA 124.086 0.954 . . . . 0.0 110.858 -174.55 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 8.2 ptpt -128.78 22.06 5.87 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 124.453 1.101 . . . . 0.0 110.222 -167.603 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 22.8 tt0 -62.78 -63.62 1.16 Allowed 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 125.57 1.548 . . . . 0.0 109.888 -168.803 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . 0.466 ' HA ' ' HE2' ' A' ' 88' ' ' LYS . 0.2 OUTLIER 61.58 103.1 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 126.94 2.096 . . . . 0.0 111.088 178.828 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -52.9 161.07 0.83 Allowed 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 124.443 1.097 . . . . 0.0 111.932 170.328 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 10.2 mptt -122.13 160.74 24.46 Favored 'General case' 0 C--O 1.238 0.499 0 N-CA-C 104.892 -2.262 . . . . 0.0 104.892 168.617 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 1.3 t -93.9 5.78 50.58 Favored 'General case' 0 CA--C 1.546 0.817 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 175.954 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 72.8 mmtt . . . . . 0 C--O 1.248 0.979 0 CA-C-O 114.456 -2.688 . . . . 0.0 104.681 -137.344 . . . . . . . . 0 0 . 1 stop_ save_